data_1EGF # _entry.id 1EGF # _audit_conform.dict_name mmcif_pdbx.dic _audit_conform.dict_version 5.397 _audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic # loop_ _database_2.database_id _database_2.database_code _database_2.pdbx_database_accession _database_2.pdbx_DOI PDB 1EGF pdb_00001egf 10.2210/pdb1egf/pdb WWPDB D_1000173044 ? ? # loop_ _pdbx_audit_revision_history.ordinal _pdbx_audit_revision_history.data_content_type _pdbx_audit_revision_history.major_revision _pdbx_audit_revision_history.minor_revision _pdbx_audit_revision_history.revision_date 1 'Structure model' 1 0 1994-01-31 2 'Structure model' 1 1 2008-03-24 3 'Structure model' 1 2 2011-07-13 4 'Structure model' 1 3 2022-02-16 5 'Structure model' 1 4 2024-10-23 # _pdbx_audit_revision_details.ordinal 1 _pdbx_audit_revision_details.revision_ordinal 1 _pdbx_audit_revision_details.data_content_type 'Structure model' _pdbx_audit_revision_details.provider repository _pdbx_audit_revision_details.type 'Initial release' _pdbx_audit_revision_details.description ? _pdbx_audit_revision_details.details ? # loop_ _pdbx_audit_revision_group.ordinal _pdbx_audit_revision_group.revision_ordinal _pdbx_audit_revision_group.data_content_type _pdbx_audit_revision_group.group 1 2 'Structure model' 'Version format compliance' 2 3 'Structure model' 'Version format compliance' 3 4 'Structure model' 'Database references' 4 4 'Structure model' 'Derived calculations' 5 4 'Structure model' Other 6 5 'Structure model' 'Data collection' 7 5 'Structure model' 'Structure summary' # loop_ _pdbx_audit_revision_category.ordinal _pdbx_audit_revision_category.revision_ordinal _pdbx_audit_revision_category.data_content_type _pdbx_audit_revision_category.category 1 4 'Structure model' database_2 2 4 'Structure model' pdbx_database_status 3 4 'Structure model' pdbx_struct_assembly 4 4 'Structure model' pdbx_struct_oper_list 5 5 'Structure model' chem_comp_atom 6 5 'Structure model' chem_comp_bond 7 5 'Structure model' pdbx_entry_details 8 5 'Structure model' pdbx_modification_feature # loop_ _pdbx_audit_revision_item.ordinal _pdbx_audit_revision_item.revision_ordinal _pdbx_audit_revision_item.data_content_type _pdbx_audit_revision_item.item 1 4 'Structure model' '_database_2.pdbx_DOI' 2 4 'Structure model' '_database_2.pdbx_database_accession' 3 4 'Structure model' '_pdbx_database_status.process_site' # _pdbx_database_status.status_code REL _pdbx_database_status.entry_id 1EGF _pdbx_database_status.recvd_initial_deposition_date 1991-10-01 _pdbx_database_status.deposit_site ? _pdbx_database_status.process_site BNL _pdbx_database_status.status_code_sf ? _pdbx_database_status.status_code_mr REL _pdbx_database_status.SG_entry ? _pdbx_database_status.pdb_format_compatible Y _pdbx_database_status.status_code_cs ? _pdbx_database_status.status_code_nmr_data ? _pdbx_database_status.methods_development_category ? # loop_ _audit_author.name _audit_author.pdbx_ordinal 'Montelione, G.T.' 1 'Wuthrich, K.' 2 'Scheraga, H.A.' 3 # loop_ _citation.id _citation.title _citation.journal_abbrev _citation.journal_volume _citation.page_first _citation.page_last _citation.year _citation.journal_id_ASTM _citation.country _citation.journal_id_ISSN _citation.journal_id_CSD _citation.book_publisher _citation.pdbx_database_id_PubMed _citation.pdbx_database_id_DOI primary ;Solution structure of murine epidermal growth factor determined by NMR spectroscopy and refined by energy minimization with restraints. ; Biochemistry 31 236 249 1992 BICHAW US 0006-2960 0033 ? 1731873 10.1021/bi00116a033 1 'Sequence-Specific 1H NMR Assignments and Identification of Slowly Exchanging Amide Protons in Murine Epidermal Growth Factor' Biochemistry 27 2235 ? 1988 BICHAW US 0006-2960 0033 ? ? ? 2 ;Solution Structure of Murine Epidermal Growth Factor: Determination of the Polypeptide Backbone Chain-Fold by Nuclear Magnetic Resonance and Distance Geometry ; Proc.Natl.Acad.Sci.USA 84 5226 ? 1987 PNASA6 US 0027-8424 0040 ? ? ? 3 ;Identification of Two Anti-Parallel Beta-Sheet Conformations in the Solution Structure of Murine Epidermal Growth Factor by Proton Magnetic Resonance ; Proc.Natl.Acad.Sci.USA 83 8594 ? 1986 PNASA6 US 0027-8424 0040 ? ? ? # loop_ _citation_author.citation_id _citation_author.name _citation_author.ordinal _citation_author.identifier_ORCID primary 'Montelione, G.T.' 1 ? primary 'Wuthrich, K.' 2 ? primary 'Burgess, A.W.' 3 ? primary 'Nice, E.C.' 4 ? primary 'Wagner, G.' 5 ? primary 'Gibson, K.D.' 6 ? primary 'Scheraga, H.A.' 7 ? 1 'Montelione, G.T.' 8 ? 1 'Wuthrich, K.' 9 ? 1 'Scheraga, H.A.' 10 ? 2 'Montelione, G.T.' 11 ? 2 'Wuthrich, K.' 12 ? 2 'Nice, E.C.' 13 ? 2 'Burgess, A.W.' 14 ? 2 'Scheraga, H.A.' 15 ? 3 'Montelione, G.T.' 16 ? 3 'Wuthrich, K.' 17 ? 3 'Nice, E.C.' 18 ? 3 'Burgess, A.W.' 19 ? 3 'Scheraga, H.A.' 20 ? # _entity.id 1 _entity.type polymer _entity.src_method man _entity.pdbx_description 'EPIDERMAL GROWTH FACTOR' _entity.formula_weight 6050.717 _entity.pdbx_number_of_molecules 1 _entity.pdbx_ec ? _entity.pdbx_mutation ? _entity.pdbx_fragment ? _entity.details ? # _entity_poly.entity_id 1 _entity_poly.type 'polypeptide(L)' _entity_poly.nstd_linkage no _entity_poly.nstd_monomer no _entity_poly.pdbx_seq_one_letter_code NSYPGCPSSYDGYCLNGGVCMHIESLDSYTCNCVIGYSGDRCQTRDLRWWELR _entity_poly.pdbx_seq_one_letter_code_can NSYPGCPSSYDGYCLNGGVCMHIESLDSYTCNCVIGYSGDRCQTRDLRWWELR _entity_poly.pdbx_strand_id A _entity_poly.pdbx_target_identifier ? # loop_ _entity_poly_seq.entity_id _entity_poly_seq.num _entity_poly_seq.mon_id _entity_poly_seq.hetero 1 1 ASN n 1 2 SER n 1 3 TYR n 1 4 PRO n 1 5 GLY n 1 6 CYS n 1 7 PRO n 1 8 SER n 1 9 SER n 1 10 TYR n 1 11 ASP n 1 12 GLY n 1 13 TYR n 1 14 CYS n 1 15 LEU n 1 16 ASN n 1 17 GLY n 1 18 GLY n 1 19 VAL n 1 20 CYS n 1 21 MET n 1 22 HIS n 1 23 ILE n 1 24 GLU n 1 25 SER n 1 26 LEU n 1 27 ASP n 1 28 SER n 1 29 TYR n 1 30 THR n 1 31 CYS n 1 32 ASN n 1 33 CYS n 1 34 VAL n 1 35 ILE n 1 36 GLY n 1 37 TYR n 1 38 SER n 1 39 GLY n 1 40 ASP n 1 41 ARG n 1 42 CYS n 1 43 GLN n 1 44 THR n 1 45 ARG n 1 46 ASP n 1 47 LEU n 1 48 ARG n 1 49 TRP n 1 50 TRP n 1 51 GLU n 1 52 LEU n 1 53 ARG n # _entity_src_gen.entity_id 1 _entity_src_gen.pdbx_src_id 1 _entity_src_gen.pdbx_alt_source_flag sample _entity_src_gen.pdbx_seq_type ? _entity_src_gen.pdbx_beg_seq_num ? _entity_src_gen.pdbx_end_seq_num ? _entity_src_gen.gene_src_common_name 'house mouse' _entity_src_gen.gene_src_genus Mus _entity_src_gen.pdbx_gene_src_gene ? _entity_src_gen.gene_src_species ? _entity_src_gen.gene_src_strain ? _entity_src_gen.gene_src_tissue ? _entity_src_gen.gene_src_tissue_fraction ? _entity_src_gen.gene_src_details ? _entity_src_gen.pdbx_gene_src_fragment ? _entity_src_gen.pdbx_gene_src_scientific_name 'Mus musculus' _entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 10090 _entity_src_gen.pdbx_gene_src_variant ? _entity_src_gen.pdbx_gene_src_cell_line ? _entity_src_gen.pdbx_gene_src_atcc ? _entity_src_gen.pdbx_gene_src_organ ? _entity_src_gen.pdbx_gene_src_organelle ? _entity_src_gen.pdbx_gene_src_cell ? _entity_src_gen.pdbx_gene_src_cellular_location ? _entity_src_gen.host_org_common_name ? _entity_src_gen.pdbx_host_org_scientific_name ? _entity_src_gen.pdbx_host_org_ncbi_taxonomy_id ? _entity_src_gen.host_org_genus ? _entity_src_gen.pdbx_host_org_gene ? _entity_src_gen.pdbx_host_org_organ ? _entity_src_gen.host_org_species ? _entity_src_gen.pdbx_host_org_tissue ? _entity_src_gen.pdbx_host_org_tissue_fraction ? _entity_src_gen.pdbx_host_org_strain ? _entity_src_gen.pdbx_host_org_variant ? _entity_src_gen.pdbx_host_org_cell_line ? _entity_src_gen.pdbx_host_org_atcc ? _entity_src_gen.pdbx_host_org_culture_collection ? _entity_src_gen.pdbx_host_org_cell ? _entity_src_gen.pdbx_host_org_organelle ? _entity_src_gen.pdbx_host_org_cellular_location ? _entity_src_gen.pdbx_host_org_vector_type ? _entity_src_gen.pdbx_host_org_vector ? _entity_src_gen.host_org_details ? _entity_src_gen.expression_system_id ? _entity_src_gen.plasmid_name ? _entity_src_gen.plasmid_details ? _entity_src_gen.pdbx_description ? # loop_ _chem_comp.id _chem_comp.type _chem_comp.mon_nstd_flag _chem_comp.name _chem_comp.pdbx_synonyms _chem_comp.formula _chem_comp.formula_weight ARG 'L-peptide linking' y ARGININE ? 'C6 H15 N4 O2 1' 175.209 ASN 'L-peptide linking' y ASPARAGINE ? 'C4 H8 N2 O3' 132.118 ASP 'L-peptide linking' y 'ASPARTIC ACID' ? 'C4 H7 N O4' 133.103 CYS 'L-peptide linking' y CYSTEINE ? 'C3 H7 N O2 S' 121.158 GLN 'L-peptide linking' y GLUTAMINE ? 'C5 H10 N2 O3' 146.144 GLU 'L-peptide linking' y 'GLUTAMIC ACID' ? 'C5 H9 N O4' 147.129 GLY 'peptide linking' y GLYCINE ? 'C2 H5 N O2' 75.067 HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162 ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173 LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173 MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211 PRO 'L-peptide linking' y PROLINE ? 'C5 H9 N O2' 115.130 SER 'L-peptide linking' y SERINE ? 'C3 H7 N O3' 105.093 THR 'L-peptide linking' y THREONINE ? 'C4 H9 N O3' 119.119 TRP 'L-peptide linking' y TRYPTOPHAN ? 'C11 H12 N2 O2' 204.225 TYR 'L-peptide linking' y TYROSINE ? 'C9 H11 N O3' 181.189 VAL 'L-peptide linking' y VALINE ? 'C5 H11 N O2' 117.146 # loop_ _pdbx_poly_seq_scheme.asym_id _pdbx_poly_seq_scheme.entity_id _pdbx_poly_seq_scheme.seq_id _pdbx_poly_seq_scheme.mon_id _pdbx_poly_seq_scheme.ndb_seq_num _pdbx_poly_seq_scheme.pdb_seq_num _pdbx_poly_seq_scheme.auth_seq_num _pdbx_poly_seq_scheme.pdb_mon_id _pdbx_poly_seq_scheme.auth_mon_id _pdbx_poly_seq_scheme.pdb_strand_id _pdbx_poly_seq_scheme.pdb_ins_code _pdbx_poly_seq_scheme.hetero A 1 1 ASN 1 1 1 ASN ASN A . n A 1 2 SER 2 2 2 SER SER A . n A 1 3 TYR 3 3 3 TYR TYR A . n A 1 4 PRO 4 4 4 PRO PRO A . n A 1 5 GLY 5 5 5 GLY GLY A . n A 1 6 CYS 6 6 6 CYS CYS A . n A 1 7 PRO 7 7 7 PRO PRO A . n A 1 8 SER 8 8 8 SER SER A . n A 1 9 SER 9 9 9 SER SER A . n A 1 10 TYR 10 10 10 TYR TYR A . n A 1 11 ASP 11 11 11 ASP ASP A . n A 1 12 GLY 12 12 12 GLY GLY A . n A 1 13 TYR 13 13 13 TYR TYR A . n A 1 14 CYS 14 14 14 CYS CYS A . n A 1 15 LEU 15 15 15 LEU LEU A . n A 1 16 ASN 16 16 16 ASN ASN A . n A 1 17 GLY 17 17 17 GLY GLY A . n A 1 18 GLY 18 18 18 GLY GLY A . n A 1 19 VAL 19 19 19 VAL VAL A . n A 1 20 CYS 20 20 20 CYS CYS A . n A 1 21 MET 21 21 21 MET MET A . n A 1 22 HIS 22 22 22 HIS HIS A . n A 1 23 ILE 23 23 23 ILE ILE A . n A 1 24 GLU 24 24 24 GLU GLU A . n A 1 25 SER 25 25 25 SER SER A . n A 1 26 LEU 26 26 26 LEU LEU A . n A 1 27 ASP 27 27 27 ASP ASP A . n A 1 28 SER 28 28 28 SER SER A . n A 1 29 TYR 29 29 29 TYR TYR A . n A 1 30 THR 30 30 30 THR THR A . n A 1 31 CYS 31 31 31 CYS CYS A . n A 1 32 ASN 32 32 32 ASN ASN A . n A 1 33 CYS 33 33 33 CYS CYS A . n A 1 34 VAL 34 34 34 VAL VAL A . n A 1 35 ILE 35 35 35 ILE ILE A . n A 1 36 GLY 36 36 36 GLY GLY A . n A 1 37 TYR 37 37 37 TYR TYR A . n A 1 38 SER 38 38 38 SER SER A . n A 1 39 GLY 39 39 39 GLY GLY A . n A 1 40 ASP 40 40 40 ASP ASP A . n A 1 41 ARG 41 41 41 ARG ARG A . n A 1 42 CYS 42 42 42 CYS CYS A . n A 1 43 GLN 43 43 43 GLN GLN A . n A 1 44 THR 44 44 44 THR THR A . n A 1 45 ARG 45 45 45 ARG ARG A . n A 1 46 ASP 46 46 46 ASP ASP A . n A 1 47 LEU 47 47 47 LEU LEU A . n A 1 48 ARG 48 48 48 ARG ARG A . n A 1 49 TRP 49 49 49 TRP TRP A . n A 1 50 TRP 50 50 50 TRP TRP A . n A 1 51 GLU 51 51 51 GLU GLU A . n A 1 52 LEU 52 52 52 LEU LEU A . n A 1 53 ARG 53 53 53 ARG ARG A . n # _cell.entry_id 1EGF _cell.length_a 1.000 _cell.length_b 1.000 _cell.length_c 1.000 _cell.angle_alpha 90.00 _cell.angle_beta 90.00 _cell.angle_gamma 90.00 _cell.Z_PDB 1 _cell.pdbx_unique_axis ? # _symmetry.entry_id 1EGF _symmetry.space_group_name_H-M 'P 1' _symmetry.pdbx_full_space_group_name_H-M ? _symmetry.cell_setting ? _symmetry.Int_Tables_number 1 # _exptl.entry_id 1EGF _exptl.method 'SOLUTION NMR' _exptl.crystals_number ? # _database_PDB_matrix.entry_id 1EGF _database_PDB_matrix.origx[1][1] 1.000000 _database_PDB_matrix.origx[1][2] 0.000000 _database_PDB_matrix.origx[1][3] 0.000000 _database_PDB_matrix.origx[2][1] 0.000000 _database_PDB_matrix.origx[2][2] 1.000000 _database_PDB_matrix.origx[2][3] 0.000000 _database_PDB_matrix.origx[3][1] 0.000000 _database_PDB_matrix.origx[3][2] 0.000000 _database_PDB_matrix.origx[3][3] 1.000000 _database_PDB_matrix.origx_vector[1] 0.00000 _database_PDB_matrix.origx_vector[2] 0.00000 _database_PDB_matrix.origx_vector[3] 0.00000 # _struct.entry_id 1EGF _struct.title ;SOLUTION STRUCTURE OF MURINE EPIDERMAL GROWTH FACTOR DETERMINED BY NMR SPECTROSCOPY AND REFINED BY ENERGY MINIMIZATION WITH RESTRAINTS ; _struct.pdbx_model_details ? _struct.pdbx_CASP_flag ? _struct.pdbx_model_type_details ? # _struct_keywords.entry_id 1EGF _struct_keywords.pdbx_keywords 'GROWTH FACTOR' _struct_keywords.text 'GROWTH FACTOR' # _struct_asym.id A _struct_asym.pdbx_blank_PDB_chainid_flag Y _struct_asym.pdbx_modified N _struct_asym.entity_id 1 _struct_asym.details ? # _struct_ref.id 1 _struct_ref.db_name UNP _struct_ref.db_code EGF_MOUSE _struct_ref.entity_id 1 _struct_ref.pdbx_db_accession P01132 _struct_ref.pdbx_align_begin 1 _struct_ref.pdbx_seq_one_letter_code ;MPWGRRPTWLLLAFLLVFLKISILSVTAWQTGNCQPGPLERSERSGTCAGPAPFLVFSQGKSISRIDPDGTNHQQLVVDA GISADMDIHYKKERLYWVDVERQVLLRVFLNGTGLEKVCNVERKVSGLAIDWIDDEVLWVDQQNGVITVTDMTGKNSRVL LSSLKHPSNIAVDPIERLMFWSSEVTGSLHRAHLKGVDVKTLLETGGISVLTLDVLDKRLFWVQDSGEGSHAYIHSCDYE GGSVRLIRHQARHSLSSMAFFGDRIFYSVLKSKAIWIANKHTGKDTVRINLHPSFVTPGKLMVVHPRAQPRTEDAAKDPD PELLKQRGRPCRFGLCERDPKSHSSACAEGYTLSRDRKYCEDVNECATQNHGCTLGCENTPGSYHCTCPTGFVLLPDGKQ CHELVSCPGNVSKCSHGCVLTSDGPRCICPAGSVLGRDGKTCTGCSSPDNGGCSQICLPLRPGSWECDCFPGYDLQSDRK SCAASGPQPLLLFANSQDIRHMHFDGTDYKVLLSRQMGMVFALDYDPVESKIYFAQTALKWIERANMDGSQRERLITEGV DTLEGLALDWIGRRIYWTDSGKSVVGGSDLSGKHHRIIIQERISRPRGIAVHPRARRLFWTDVGMSPRIESASLQGSDRV LIASSNLLEPSGITIDYLTDTLYWCDTKRSVIEMANLDGSKRRRLIQNDVGHPFSLAVFEDHLWVSDWAIPSVIRVNKRT GQNRVRLQGSMLKPSSLVVVHPLAKPGADPCLYRNGGCEHICQESLGTARCLCREGFVKAWDGKMCLPQDYPILSGENAD LSKEVTSLSNSTQAEVPDDDGTESSTLVAEIMVSGMNYEDDCGPGGCGSHARCVSDGETAECQCLKGFARDGNLCSDIDE CVLARSDCPSTSSRCINTEGGYVCRCSEGYEGDGISCFDIDECQRGAHNCAENAACTNTEGGYNCTCAGRPSSPGRSCPD STAPSLLGEDGHHLDRNSYPGCPSSYDGYCLNGGVCMHIESLDSYTCNCVIGYSGDRCQTRDLRWWELRHAGYGQKHDIM VVAVCMVALVLLLLLGMWGTYYYRTRKQLSNPPKNPCDEPSGSVSSSGPDSSSGAAVASCPQPWFVVLEKHQDPKNGSLP ADGTNGAVVDAGLSPSLQLGSVHLTSWRQKPHIDGMGTGQSCWIPPSSDRGPQEIEGNSHLPSYRPVGPEKLHSLQSANG SCHERAPDLPRQTEPVK ; _struct_ref.pdbx_db_isoform ? # _struct_ref_seq.align_id 1 _struct_ref_seq.ref_id 1 _struct_ref_seq.pdbx_PDB_id_code 1EGF _struct_ref_seq.pdbx_strand_id A _struct_ref_seq.seq_align_beg 1 _struct_ref_seq.pdbx_seq_align_beg_ins_code ? _struct_ref_seq.seq_align_end 53 _struct_ref_seq.pdbx_seq_align_end_ins_code ? _struct_ref_seq.pdbx_db_accession P01132 _struct_ref_seq.db_align_beg 977 _struct_ref_seq.pdbx_db_align_beg_ins_code ? _struct_ref_seq.db_align_end 1029 _struct_ref_seq.pdbx_db_align_end_ins_code ? _struct_ref_seq.pdbx_auth_seq_align_beg 1 _struct_ref_seq.pdbx_auth_seq_align_end 53 # _pdbx_struct_assembly.id 1 _pdbx_struct_assembly.details author_defined_assembly _pdbx_struct_assembly.method_details ? _pdbx_struct_assembly.oligomeric_details monomeric _pdbx_struct_assembly.oligomeric_count 1 # _pdbx_struct_assembly_gen.assembly_id 1 _pdbx_struct_assembly_gen.oper_expression 1 _pdbx_struct_assembly_gen.asym_id_list A # _pdbx_struct_oper_list.id 1 _pdbx_struct_oper_list.type 'identity operation' _pdbx_struct_oper_list.name 1_555 _pdbx_struct_oper_list.symmetry_operation x,y,z _pdbx_struct_oper_list.matrix[1][1] 1.0000000000 _pdbx_struct_oper_list.matrix[1][2] 0.0000000000 _pdbx_struct_oper_list.matrix[1][3] 0.0000000000 _pdbx_struct_oper_list.vector[1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][1] 0.0000000000 _pdbx_struct_oper_list.matrix[2][2] 1.0000000000 _pdbx_struct_oper_list.matrix[2][3] 0.0000000000 _pdbx_struct_oper_list.vector[2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][1] 0.0000000000 _pdbx_struct_oper_list.matrix[3][2] 0.0000000000 _pdbx_struct_oper_list.matrix[3][3] 1.0000000000 _pdbx_struct_oper_list.vector[3] 0.0000000000 # _struct_biol.id 1 # loop_ _struct_conn.id _struct_conn.conn_type_id _struct_conn.pdbx_leaving_atom_flag _struct_conn.pdbx_PDB_id _struct_conn.ptnr1_label_asym_id _struct_conn.ptnr1_label_comp_id _struct_conn.ptnr1_label_seq_id _struct_conn.ptnr1_label_atom_id _struct_conn.pdbx_ptnr1_label_alt_id _struct_conn.pdbx_ptnr1_PDB_ins_code _struct_conn.pdbx_ptnr1_standard_comp_id _struct_conn.ptnr1_symmetry _struct_conn.ptnr2_label_asym_id _struct_conn.ptnr2_label_comp_id _struct_conn.ptnr2_label_seq_id _struct_conn.ptnr2_label_atom_id _struct_conn.pdbx_ptnr2_label_alt_id _struct_conn.pdbx_ptnr2_PDB_ins_code _struct_conn.ptnr1_auth_asym_id _struct_conn.ptnr1_auth_comp_id _struct_conn.ptnr1_auth_seq_id _struct_conn.ptnr2_auth_asym_id _struct_conn.ptnr2_auth_comp_id _struct_conn.ptnr2_auth_seq_id _struct_conn.ptnr2_symmetry _struct_conn.pdbx_ptnr3_label_atom_id _struct_conn.pdbx_ptnr3_label_seq_id _struct_conn.pdbx_ptnr3_label_comp_id _struct_conn.pdbx_ptnr3_label_asym_id _struct_conn.pdbx_ptnr3_label_alt_id _struct_conn.pdbx_ptnr3_PDB_ins_code _struct_conn.details _struct_conn.pdbx_dist_value _struct_conn.pdbx_value_order _struct_conn.pdbx_role disulf1 disulf ? ? A CYS 6 SG ? ? ? 1_555 A CYS 20 SG ? ? A CYS 6 A CYS 20 1_555 ? ? ? ? ? ? ? 1.921 ? ? disulf2 disulf ? ? A CYS 14 SG ? ? ? 1_555 A CYS 31 SG ? ? A CYS 14 A CYS 31 1_555 ? ? ? ? ? ? ? 1.533 ? ? disulf3 disulf ? ? A CYS 33 SG ? ? ? 1_555 A CYS 42 SG ? ? A CYS 33 A CYS 42 1_555 ? ? ? ? ? ? ? 1.855 ? ? # _struct_conn_type.id disulf _struct_conn_type.criteria ? _struct_conn_type.reference ? # loop_ _pdbx_modification_feature.ordinal _pdbx_modification_feature.label_comp_id _pdbx_modification_feature.label_asym_id _pdbx_modification_feature.label_seq_id _pdbx_modification_feature.label_alt_id _pdbx_modification_feature.modified_residue_label_comp_id _pdbx_modification_feature.modified_residue_label_asym_id _pdbx_modification_feature.modified_residue_label_seq_id _pdbx_modification_feature.modified_residue_label_alt_id _pdbx_modification_feature.auth_comp_id _pdbx_modification_feature.auth_asym_id _pdbx_modification_feature.auth_seq_id _pdbx_modification_feature.PDB_ins_code _pdbx_modification_feature.symmetry _pdbx_modification_feature.modified_residue_auth_comp_id _pdbx_modification_feature.modified_residue_auth_asym_id _pdbx_modification_feature.modified_residue_auth_seq_id _pdbx_modification_feature.modified_residue_PDB_ins_code _pdbx_modification_feature.modified_residue_symmetry _pdbx_modification_feature.comp_id_linking_atom _pdbx_modification_feature.modified_residue_id_linking_atom _pdbx_modification_feature.modified_residue_id _pdbx_modification_feature.ref_pcm_id _pdbx_modification_feature.ref_comp_id _pdbx_modification_feature.type _pdbx_modification_feature.category 1 CYS A 6 ? CYS A 20 ? CYS A 6 ? 1_555 CYS A 20 ? 1_555 SG SG . . . None 'Disulfide bridge' 2 CYS A 14 ? CYS A 31 ? CYS A 14 ? 1_555 CYS A 31 ? 1_555 SG SG . . . None 'Disulfide bridge' 3 CYS A 33 ? CYS A 42 ? CYS A 33 ? 1_555 CYS A 42 ? 1_555 SG SG . . . None 'Disulfide bridge' # _struct_sheet.id A _struct_sheet.type ? _struct_sheet.number_strands 3 _struct_sheet.details ? # loop_ _struct_sheet_order.sheet_id _struct_sheet_order.range_id_1 _struct_sheet_order.range_id_2 _struct_sheet_order.offset _struct_sheet_order.sense A 1 2 ? anti-parallel A 2 3 ? anti-parallel # loop_ _struct_sheet_range.sheet_id _struct_sheet_range.id _struct_sheet_range.beg_label_comp_id _struct_sheet_range.beg_label_asym_id _struct_sheet_range.beg_label_seq_id _struct_sheet_range.pdbx_beg_PDB_ins_code _struct_sheet_range.end_label_comp_id _struct_sheet_range.end_label_asym_id _struct_sheet_range.end_label_seq_id _struct_sheet_range.pdbx_end_PDB_ins_code _struct_sheet_range.beg_auth_comp_id _struct_sheet_range.beg_auth_asym_id _struct_sheet_range.beg_auth_seq_id _struct_sheet_range.end_auth_comp_id _struct_sheet_range.end_auth_asym_id _struct_sheet_range.end_auth_seq_id A 1 SER A 2 ? TYR A 3 ? SER A 2 TYR A 3 A 2 VAL A 19 ? ILE A 23 ? VAL A 19 ILE A 23 A 3 TYR A 29 ? ASN A 32 ? TYR A 29 ASN A 32 # loop_ _pdbx_struct_sheet_hbond.sheet_id _pdbx_struct_sheet_hbond.range_id_1 _pdbx_struct_sheet_hbond.range_id_2 _pdbx_struct_sheet_hbond.range_1_label_atom_id _pdbx_struct_sheet_hbond.range_1_label_comp_id _pdbx_struct_sheet_hbond.range_1_label_asym_id _pdbx_struct_sheet_hbond.range_1_label_seq_id _pdbx_struct_sheet_hbond.range_1_PDB_ins_code _pdbx_struct_sheet_hbond.range_1_auth_atom_id _pdbx_struct_sheet_hbond.range_1_auth_comp_id _pdbx_struct_sheet_hbond.range_1_auth_asym_id _pdbx_struct_sheet_hbond.range_1_auth_seq_id _pdbx_struct_sheet_hbond.range_2_label_atom_id _pdbx_struct_sheet_hbond.range_2_label_comp_id _pdbx_struct_sheet_hbond.range_2_label_asym_id _pdbx_struct_sheet_hbond.range_2_label_seq_id _pdbx_struct_sheet_hbond.range_2_PDB_ins_code _pdbx_struct_sheet_hbond.range_2_auth_atom_id _pdbx_struct_sheet_hbond.range_2_auth_comp_id _pdbx_struct_sheet_hbond.range_2_auth_asym_id _pdbx_struct_sheet_hbond.range_2_auth_seq_id A 1 2 N TYR A 3 ? N TYR A 3 O HIS A 22 ? O HIS A 22 A 2 3 O MET A 21 ? O MET A 21 N THR A 30 ? N THR A 30 # _pdbx_entry_details.entry_id 1EGF _pdbx_entry_details.compound_details ? _pdbx_entry_details.source_details ? _pdbx_entry_details.nonpolymer_details ? _pdbx_entry_details.sequence_details ? _pdbx_entry_details.has_ligand_of_interest ? _pdbx_entry_details.has_protein_modification Y # loop_ _pdbx_validate_torsion.id _pdbx_validate_torsion.PDB_model_num _pdbx_validate_torsion.auth_comp_id _pdbx_validate_torsion.auth_asym_id _pdbx_validate_torsion.auth_seq_id _pdbx_validate_torsion.PDB_ins_code _pdbx_validate_torsion.label_alt_id _pdbx_validate_torsion.phi _pdbx_validate_torsion.psi 1 1 CYS A 6 ? ? -178.07 89.11 2 1 TYR A 10 ? ? -92.26 -98.72 3 1 ASP A 11 ? ? 153.89 88.14 4 1 TYR A 13 ? ? -34.48 -34.97 5 1 ASN A 16 ? ? 80.33 -50.93 6 1 LEU A 26 ? ? -158.08 24.08 7 1 CYS A 33 ? ? -111.32 -144.47 8 1 ILE A 35 ? ? -37.98 132.51 9 1 SER A 38 ? ? 179.88 -164.81 10 1 ARG A 41 ? ? -166.43 -87.68 11 1 CYS A 42 ? ? -148.89 18.21 12 1 THR A 44 ? ? -66.21 69.43 13 1 ARG A 45 ? ? -68.56 55.83 14 1 LEU A 47 ? ? -82.82 -114.64 15 1 ARG A 48 ? ? 71.35 87.96 16 1 TRP A 49 ? ? -42.82 99.66 17 1 TRP A 50 ? ? -109.28 65.05 18 2 CYS A 6 ? ? -168.60 94.94 19 2 ASP A 11 ? ? 58.10 80.42 20 2 ASN A 16 ? ? 21.81 56.42 21 2 LEU A 26 ? ? -154.49 22.74 22 2 THR A 30 ? ? -129.84 -166.52 23 2 CYS A 33 ? ? -64.45 -160.89 24 2 ASP A 40 ? ? 70.31 -59.97 25 2 ARG A 41 ? ? -100.20 -71.30 26 2 CYS A 42 ? ? 157.36 42.79 27 2 ASP A 46 ? ? -80.92 -148.02 28 2 LEU A 47 ? ? -131.70 -95.26 29 2 ARG A 48 ? ? 77.79 75.04 30 2 TRP A 49 ? ? 42.06 94.48 31 3 CYS A 6 ? ? -179.70 101.42 32 3 ASN A 16 ? ? 70.02 -55.83 33 3 GLU A 24 ? ? 46.75 -174.74 34 3 SER A 25 ? ? 83.60 -33.68 35 3 LEU A 26 ? ? -145.75 12.94 36 3 CYS A 33 ? ? -84.03 -106.67 37 3 SER A 38 ? ? -177.65 -140.68 38 3 ASP A 40 ? ? 87.92 -35.40 39 3 ARG A 41 ? ? -128.26 -85.93 40 3 CYS A 42 ? ? 176.86 35.49 41 3 ASP A 46 ? ? -40.43 -91.73 42 3 ARG A 48 ? ? 85.23 51.05 43 3 GLU A 51 ? ? -141.14 -55.52 44 4 CYS A 6 ? ? 177.90 97.61 45 4 ASP A 11 ? ? -105.04 47.56 46 4 LEU A 26 ? ? -155.03 21.02 47 4 THR A 30 ? ? -122.27 -165.17 48 4 CYS A 33 ? ? -76.27 -159.36 49 4 ASP A 40 ? ? 67.89 -66.83 50 4 ARG A 41 ? ? -96.99 -71.77 51 4 CYS A 42 ? ? 156.94 46.19 52 4 LEU A 47 ? ? -161.08 -161.03 53 4 ARG A 48 ? ? -144.57 51.83 54 4 TRP A 49 ? ? -64.24 80.29 55 4 TRP A 50 ? ? -164.66 -54.16 56 4 LEU A 52 ? ? -134.71 -54.83 57 5 CYS A 6 ? ? 179.00 96.88 58 5 ASP A 11 ? ? 60.87 79.71 59 5 ASN A 16 ? ? 32.94 63.39 60 5 GLU A 24 ? ? 68.08 -57.46 61 5 ASP A 27 ? ? 43.65 29.26 62 5 THR A 30 ? ? -76.98 -166.32 63 5 CYS A 33 ? ? -59.76 -157.98 64 5 SER A 38 ? ? -170.30 -179.13 65 5 ASP A 40 ? ? 71.03 -60.66 66 5 ARG A 41 ? ? -86.65 -84.09 67 5 CYS A 42 ? ? 153.95 94.71 68 5 GLN A 43 ? ? -156.93 -39.06 69 5 ASP A 46 ? ? -102.12 -167.74 70 5 LEU A 47 ? ? 56.54 -96.67 71 6 CYS A 6 ? ? -157.23 78.76 72 6 ASP A 11 ? ? 49.09 70.13 73 6 ASN A 16 ? ? 74.48 -53.79 74 6 SER A 25 ? ? 87.36 -31.88 75 6 LEU A 26 ? ? -146.67 15.55 76 6 CYS A 33 ? ? -127.45 -152.70 77 6 ARG A 41 ? ? -144.11 -78.75 78 6 CYS A 42 ? ? 169.87 66.90 79 6 LEU A 47 ? ? 41.04 72.45 80 6 ARG A 48 ? ? 161.32 91.49 81 7 CYS A 6 ? ? 178.03 107.13 82 7 TYR A 13 ? ? 67.86 -43.85 83 7 ASN A 16 ? ? 32.25 58.35 84 7 LEU A 26 ? ? -159.70 25.09 85 7 CYS A 33 ? ? -84.89 -118.01 86 7 SER A 38 ? ? -167.04 -161.57 87 7 ASP A 40 ? ? -37.66 -30.94 88 7 ARG A 41 ? ? -132.30 -64.12 89 7 CYS A 42 ? ? 173.69 22.76 90 7 THR A 44 ? ? -66.21 62.76 91 7 ASP A 46 ? ? -60.15 -145.48 92 8 CYS A 6 ? ? -172.40 100.41 93 8 ASP A 11 ? ? 59.25 78.31 94 8 MET A 21 ? ? -160.96 113.99 95 8 CYS A 33 ? ? -88.98 -153.67 96 8 ILE A 35 ? ? -45.86 158.38 97 8 TYR A 37 ? ? -161.71 103.42 98 8 ASP A 40 ? ? 60.96 117.29 99 8 CYS A 42 ? ? 65.20 87.84 100 8 THR A 44 ? ? -65.46 98.57 101 8 ASP A 46 ? ? 40.93 -153.53 102 8 LEU A 47 ? ? 49.06 72.60 103 8 ARG A 48 ? ? 169.13 81.89 104 8 TRP A 49 ? ? 59.78 140.25 105 8 TRP A 50 ? ? -172.56 -97.81 106 9 CYS A 6 ? ? 172.56 108.73 107 9 ASP A 11 ? ? -99.21 46.60 108 9 LEU A 26 ? ? -157.20 24.08 109 9 CYS A 33 ? ? -60.30 -121.41 110 9 VAL A 34 ? ? -147.35 -155.61 111 9 SER A 38 ? ? -169.63 -160.44 112 9 ARG A 41 ? ? -142.06 -87.03 113 9 CYS A 42 ? ? 176.88 33.58 114 9 ASP A 46 ? ? -82.55 -71.64 115 9 ARG A 48 ? ? -179.80 59.22 116 10 CYS A 6 ? ? -178.44 100.82 117 10 ASP A 11 ? ? 49.70 75.60 118 10 GLU A 24 ? ? 52.78 170.24 119 10 SER A 25 ? ? 77.18 -25.03 120 10 LEU A 26 ? ? -143.20 15.50 121 10 ASP A 27 ? ? 49.05 22.30 122 10 CYS A 33 ? ? -119.94 -150.15 123 10 CYS A 42 ? ? 48.07 73.18 124 10 ASP A 46 ? ? -66.13 -144.32 125 10 LEU A 47 ? ? -150.56 -44.72 126 10 ARG A 48 ? ? -172.05 68.75 127 10 GLU A 51 ? ? -132.48 -50.99 128 11 CYS A 6 ? ? 168.72 119.11 129 11 TYR A 13 ? ? 58.76 13.44 130 11 ASN A 16 ? ? 65.32 -59.92 131 11 SER A 25 ? ? 88.44 -29.83 132 11 LEU A 26 ? ? -151.79 18.07 133 11 CYS A 33 ? ? -78.41 -145.37 134 11 ASP A 40 ? ? 37.96 38.97 135 11 ARG A 41 ? ? 177.08 -27.69 136 11 CYS A 42 ? ? 81.76 79.49 137 11 GLN A 43 ? ? -134.49 -37.70 138 11 ASP A 46 ? ? -130.38 -68.51 139 11 LEU A 47 ? ? -10.85 116.32 140 11 ARG A 48 ? ? -160.57 62.38 141 11 GLU A 51 ? ? -167.87 -50.81 142 12 CYS A 6 ? ? -174.80 94.74 143 12 TYR A 13 ? ? 47.15 20.68 144 12 ASN A 16 ? ? 76.78 -53.34 145 12 SER A 25 ? ? 88.70 -30.20 146 12 LEU A 26 ? ? -150.46 17.48 147 12 ASP A 40 ? ? -33.56 117.83 148 12 ARG A 41 ? ? 85.85 16.06 149 12 THR A 44 ? ? -69.49 89.62 150 12 ARG A 48 ? ? 94.04 50.92 151 12 GLU A 51 ? ? -164.11 -55.93 152 13 CYS A 6 ? ? 176.05 111.02 153 13 SER A 8 ? ? 95.05 -6.17 154 13 TYR A 10 ? ? -85.38 -89.08 155 13 ASP A 11 ? ? 157.33 89.71 156 13 ASN A 16 ? ? 82.11 -54.15 157 13 LEU A 26 ? ? -161.86 26.18 158 13 CYS A 33 ? ? -61.13 -147.24 159 13 ARG A 41 ? ? -128.40 -82.52 160 13 CYS A 42 ? ? 172.15 26.99 161 13 ASP A 46 ? ? -64.19 -145.58 162 13 LEU A 47 ? ? -121.82 -51.06 163 13 ARG A 48 ? ? 174.16 74.15 164 13 TRP A 49 ? ? -88.44 47.22 165 14 CYS A 6 ? ? -177.07 82.99 166 14 ASP A 11 ? ? -113.77 55.58 167 14 ASN A 16 ? ? 48.16 23.05 168 14 LEU A 26 ? ? -164.04 31.98 169 14 ASP A 27 ? ? 46.10 28.88 170 14 CYS A 33 ? ? -75.12 -135.36 171 14 SER A 38 ? ? -164.78 -154.23 172 14 ASP A 40 ? ? -177.74 108.14 173 14 CYS A 42 ? ? 68.32 69.82 174 14 THR A 44 ? ? -65.72 72.87 175 14 ASP A 46 ? ? -71.20 -143.64 176 14 ARG A 48 ? ? 75.78 68.08 177 15 CYS A 6 ? ? 157.43 89.33 178 15 SER A 8 ? ? 47.39 15.25 179 15 SER A 9 ? ? 46.86 22.87 180 15 TYR A 10 ? ? 31.39 38.36 181 15 ASP A 11 ? ? 61.98 74.29 182 15 ASP A 27 ? ? 44.18 24.47 183 15 CYS A 31 ? ? -162.56 118.89 184 15 CYS A 33 ? ? -67.01 -147.47 185 15 SER A 38 ? ? -161.27 -168.79 186 15 ASP A 40 ? ? 38.09 48.67 187 15 ARG A 41 ? ? 174.60 -30.37 188 15 CYS A 42 ? ? 83.70 20.33 189 15 LEU A 47 ? ? 38.28 81.07 190 15 ARG A 48 ? ? -164.49 31.54 191 15 TRP A 50 ? ? -139.76 -50.31 192 16 CYS A 6 ? ? -174.78 95.94 193 16 ASP A 11 ? ? 53.67 72.66 194 16 SER A 25 ? ? 88.28 -29.59 195 16 LEU A 26 ? ? -151.30 17.99 196 16 CYS A 33 ? ? -119.38 -159.43 197 16 ILE A 35 ? ? -34.47 138.59 198 16 ASP A 40 ? ? -36.35 -32.65 199 16 CYS A 42 ? ? 153.43 38.74 200 16 ASP A 46 ? ? -32.99 -34.31 201 16 LEU A 47 ? ? -65.96 60.51 202 16 ARG A 48 ? ? 164.75 82.31 203 16 TRP A 49 ? ? -55.21 -168.90 204 16 TRP A 50 ? ? -158.49 -67.16 205 16 GLU A 51 ? ? -155.06 -97.83 # loop_ _pdbx_validate_planes.id _pdbx_validate_planes.PDB_model_num _pdbx_validate_planes.auth_comp_id _pdbx_validate_planes.auth_asym_id _pdbx_validate_planes.auth_seq_id _pdbx_validate_planes.PDB_ins_code _pdbx_validate_planes.label_alt_id _pdbx_validate_planes.rmsd _pdbx_validate_planes.type 1 1 ARG A 41 ? ? 0.299 'SIDE CHAIN' 2 1 ARG A 45 ? ? 0.282 'SIDE CHAIN' 3 1 ARG A 48 ? ? 0.299 'SIDE CHAIN' 4 1 ARG A 53 ? ? 0.299 'SIDE CHAIN' 5 2 ARG A 41 ? ? 0.300 'SIDE CHAIN' 6 2 ARG A 45 ? ? 0.299 'SIDE CHAIN' 7 2 ARG A 48 ? ? 0.300 'SIDE CHAIN' 8 2 ARG A 53 ? ? 0.299 'SIDE CHAIN' 9 3 ARG A 41 ? ? 0.298 'SIDE CHAIN' 10 3 ARG A 45 ? ? 0.299 'SIDE CHAIN' 11 3 ARG A 48 ? ? 0.299 'SIDE CHAIN' 12 3 ARG A 53 ? ? 0.299 'SIDE CHAIN' 13 4 ARG A 41 ? ? 0.300 'SIDE CHAIN' 14 4 ARG A 45 ? ? 0.298 'SIDE CHAIN' 15 4 ARG A 48 ? ? 0.294 'SIDE CHAIN' 16 4 ARG A 53 ? ? 0.299 'SIDE CHAIN' 17 5 ARG A 41 ? ? 0.298 'SIDE CHAIN' 18 5 ARG A 45 ? ? 0.299 'SIDE CHAIN' 19 5 ARG A 48 ? ? 0.294 'SIDE CHAIN' 20 5 ARG A 53 ? ? 0.299 'SIDE CHAIN' 21 6 ARG A 41 ? ? 0.299 'SIDE CHAIN' 22 6 ARG A 45 ? ? 0.299 'SIDE CHAIN' 23 6 ARG A 48 ? ? 0.299 'SIDE CHAIN' 24 6 ARG A 53 ? ? 0.293 'SIDE CHAIN' 25 7 ARG A 41 ? ? 0.298 'SIDE CHAIN' 26 7 ARG A 45 ? ? 0.297 'SIDE CHAIN' 27 7 ARG A 48 ? ? 0.299 'SIDE CHAIN' 28 7 ARG A 53 ? ? 0.299 'SIDE CHAIN' 29 8 ARG A 41 ? ? 0.298 'SIDE CHAIN' 30 8 ARG A 45 ? ? 0.299 'SIDE CHAIN' 31 8 ARG A 48 ? ? 0.298 'SIDE CHAIN' 32 8 ARG A 53 ? ? 0.263 'SIDE CHAIN' 33 9 ARG A 41 ? ? 0.299 'SIDE CHAIN' 34 9 ARG A 45 ? ? 0.297 'SIDE CHAIN' 35 9 ARG A 48 ? ? 0.297 'SIDE CHAIN' 36 9 ARG A 53 ? ? 0.292 'SIDE CHAIN' 37 10 ARG A 41 ? ? 0.299 'SIDE CHAIN' 38 10 ARG A 45 ? ? 0.299 'SIDE CHAIN' 39 10 ARG A 48 ? ? 0.299 'SIDE CHAIN' 40 10 ARG A 53 ? ? 0.266 'SIDE CHAIN' 41 11 ARG A 41 ? ? 0.297 'SIDE CHAIN' 42 11 ARG A 45 ? ? 0.299 'SIDE CHAIN' 43 11 ARG A 48 ? ? 0.283 'SIDE CHAIN' 44 11 ARG A 53 ? ? 0.298 'SIDE CHAIN' 45 12 ARG A 41 ? ? 0.300 'SIDE CHAIN' 46 12 ARG A 45 ? ? 0.300 'SIDE CHAIN' 47 12 ARG A 48 ? ? 0.298 'SIDE CHAIN' 48 12 ARG A 53 ? ? 0.299 'SIDE CHAIN' 49 13 ARG A 41 ? ? 0.299 'SIDE CHAIN' 50 13 ARG A 45 ? ? 0.299 'SIDE CHAIN' 51 13 ARG A 48 ? ? 0.299 'SIDE CHAIN' 52 13 ARG A 53 ? ? 0.299 'SIDE CHAIN' 53 14 ARG A 41 ? ? 0.299 'SIDE CHAIN' 54 14 ARG A 45 ? ? 0.298 'SIDE CHAIN' 55 14 ARG A 48 ? ? 0.276 'SIDE CHAIN' 56 14 ARG A 53 ? ? 0.299 'SIDE CHAIN' 57 15 ARG A 41 ? ? 0.299 'SIDE CHAIN' 58 15 ARG A 45 ? ? 0.299 'SIDE CHAIN' 59 15 ARG A 48 ? ? 0.299 'SIDE CHAIN' 60 15 ARG A 53 ? ? 0.299 'SIDE CHAIN' 61 16 ARG A 41 ? ? 0.299 'SIDE CHAIN' 62 16 ARG A 45 ? ? 0.299 'SIDE CHAIN' 63 16 ARG A 48 ? ? 0.299 'SIDE CHAIN' 64 16 ARG A 53 ? ? 0.168 'SIDE CHAIN' # _pdbx_nmr_ensemble.entry_id 1EGF _pdbx_nmr_ensemble.conformers_calculated_total_number ? _pdbx_nmr_ensemble.conformers_submitted_total_number 16 _pdbx_nmr_ensemble.conformer_selection_criteria ? # _pdbx_nmr_software.classification refinement _pdbx_nmr_software.name DISMAN _pdbx_nmr_software.version ? _pdbx_nmr_software.authors BRAUN,GO _pdbx_nmr_software.ordinal 1 # loop_ _chem_comp_atom.comp_id _chem_comp_atom.atom_id _chem_comp_atom.type_symbol _chem_comp_atom.pdbx_aromatic_flag _chem_comp_atom.pdbx_stereo_config _chem_comp_atom.pdbx_ordinal ARG N N N N 1 ARG CA C N S 2 ARG C C N N 3 ARG O O N N 4 ARG CB C N N 5 ARG CG C N N 6 ARG CD C N N 7 ARG NE N N N 8 ARG CZ C N N 9 ARG NH1 N N N 10 ARG NH2 N N N 11 ARG OXT O N N 12 ARG H H N N 13 ARG H2 H N N 14 ARG HA H N N 15 ARG HB2 H N N 16 ARG HB3 H N N 17 ARG HG2 H N N 18 ARG HG3 H N N 19 ARG HD2 H N N 20 ARG HD3 H N N 21 ARG HE H N N 22 ARG HH11 H N N 23 ARG HH12 H N N 24 ARG HH21 H N N 25 ARG HH22 H N N 26 ARG HXT H N N 27 ASN N N N N 28 ASN CA C N S 29 ASN C C N N 30 ASN O O N N 31 ASN CB C N N 32 ASN CG C N N 33 ASN OD1 O N N 34 ASN ND2 N N N 35 ASN OXT O N N 36 ASN H H N N 37 ASN H2 H N N 38 ASN HA H N N 39 ASN HB2 H N N 40 ASN HB3 H N N 41 ASN HD21 H N N 42 ASN HD22 H N N 43 ASN HXT H N N 44 ASP N N N N 45 ASP CA C N S 46 ASP C C N N 47 ASP O O N N 48 ASP CB C N N 49 ASP CG C N N 50 ASP OD1 O N N 51 ASP OD2 O N N 52 ASP OXT O N N 53 ASP H H N N 54 ASP H2 H N N 55 ASP HA H N N 56 ASP HB2 H N N 57 ASP HB3 H N N 58 ASP HD2 H N N 59 ASP HXT H N N 60 CYS N N N N 61 CYS CA C N R 62 CYS C C N N 63 CYS O O N N 64 CYS CB C N N 65 CYS SG S N N 66 CYS OXT O N N 67 CYS H H N N 68 CYS H2 H N N 69 CYS HA H N N 70 CYS HB2 H N N 71 CYS HB3 H N N 72 CYS HG H N N 73 CYS HXT H N N 74 GLN N N N N 75 GLN CA C N S 76 GLN C C N N 77 GLN O O N N 78 GLN CB C N N 79 GLN CG C N N 80 GLN CD C N N 81 GLN OE1 O N N 82 GLN NE2 N N N 83 GLN OXT O N N 84 GLN H H N N 85 GLN H2 H N N 86 GLN HA H N N 87 GLN HB2 H N N 88 GLN HB3 H N N 89 GLN HG2 H N N 90 GLN HG3 H N N 91 GLN HE21 H N N 92 GLN HE22 H N N 93 GLN HXT H N N 94 GLU N N N N 95 GLU CA C N S 96 GLU C C N N 97 GLU O O N N 98 GLU CB C N N 99 GLU CG C N N 100 GLU CD C N N 101 GLU OE1 O N N 102 GLU OE2 O N N 103 GLU OXT O N N 104 GLU H H N N 105 GLU H2 H N N 106 GLU HA H N N 107 GLU HB2 H N N 108 GLU HB3 H N N 109 GLU HG2 H N N 110 GLU HG3 H N N 111 GLU HE2 H N N 112 GLU HXT H N N 113 GLY N N N N 114 GLY CA C N N 115 GLY C C N N 116 GLY O O N N 117 GLY OXT O N N 118 GLY H H N N 119 GLY H2 H N N 120 GLY HA2 H N N 121 GLY HA3 H N N 122 GLY HXT H N N 123 HIS N N N N 124 HIS CA C N S 125 HIS C C N N 126 HIS O O N N 127 HIS CB C N N 128 HIS CG C Y N 129 HIS ND1 N Y N 130 HIS CD2 C Y N 131 HIS CE1 C Y N 132 HIS NE2 N Y N 133 HIS OXT O N N 134 HIS H H N N 135 HIS H2 H N N 136 HIS HA H N N 137 HIS HB2 H N N 138 HIS HB3 H N N 139 HIS HD1 H N N 140 HIS HD2 H N N 141 HIS HE1 H N N 142 HIS HE2 H N N 143 HIS HXT H N N 144 ILE N N N N 145 ILE CA C N S 146 ILE C C N N 147 ILE O O N N 148 ILE CB C N S 149 ILE CG1 C N N 150 ILE CG2 C N N 151 ILE CD1 C N N 152 ILE OXT O N N 153 ILE H H N N 154 ILE H2 H N N 155 ILE HA H N N 156 ILE HB H N N 157 ILE HG12 H N N 158 ILE HG13 H N N 159 ILE HG21 H N N 160 ILE HG22 H N N 161 ILE HG23 H N N 162 ILE HD11 H N N 163 ILE HD12 H N N 164 ILE HD13 H N N 165 ILE HXT H N N 166 LEU N N N N 167 LEU CA C N S 168 LEU C C N N 169 LEU O O N N 170 LEU CB C N N 171 LEU CG C N N 172 LEU CD1 C N N 173 LEU CD2 C N N 174 LEU OXT O N N 175 LEU H H N N 176 LEU H2 H N N 177 LEU HA H N N 178 LEU HB2 H N N 179 LEU HB3 H N N 180 LEU HG H N N 181 LEU HD11 H N N 182 LEU HD12 H N N 183 LEU HD13 H N N 184 LEU HD21 H N N 185 LEU HD22 H N N 186 LEU HD23 H N N 187 LEU HXT H N N 188 MET N N N N 189 MET CA C N S 190 MET C C N N 191 MET O O N N 192 MET CB C N N 193 MET CG C N N 194 MET SD S N N 195 MET CE C N N 196 MET OXT O N N 197 MET H H N N 198 MET H2 H N N 199 MET HA H N N 200 MET HB2 H N N 201 MET HB3 H N N 202 MET HG2 H N N 203 MET HG3 H N N 204 MET HE1 H N N 205 MET HE2 H N N 206 MET HE3 H N N 207 MET HXT H N N 208 PRO N N N N 209 PRO CA C N S 210 PRO C C N N 211 PRO O O N N 212 PRO CB C N N 213 PRO CG C N N 214 PRO CD C N N 215 PRO OXT O N N 216 PRO H H N N 217 PRO HA H N N 218 PRO HB2 H N N 219 PRO HB3 H N N 220 PRO HG2 H N N 221 PRO HG3 H N N 222 PRO HD2 H N N 223 PRO HD3 H N N 224 PRO HXT H N N 225 SER N N N N 226 SER CA C N S 227 SER C C N N 228 SER O O N N 229 SER CB C N N 230 SER OG O N N 231 SER OXT O N N 232 SER H H N N 233 SER H2 H N N 234 SER HA H N N 235 SER HB2 H N N 236 SER HB3 H N N 237 SER HG H N N 238 SER HXT H N N 239 THR N N N N 240 THR CA C N S 241 THR C C N N 242 THR O O N N 243 THR CB C N R 244 THR OG1 O N N 245 THR CG2 C N N 246 THR OXT O N N 247 THR H H N N 248 THR H2 H N N 249 THR HA H N N 250 THR HB H N N 251 THR HG1 H N N 252 THR HG21 H N N 253 THR HG22 H N N 254 THR HG23 H N N 255 THR HXT H N N 256 TRP N N N N 257 TRP CA C N S 258 TRP C C N N 259 TRP O O N N 260 TRP CB C N N 261 TRP CG C Y N 262 TRP CD1 C Y N 263 TRP CD2 C Y N 264 TRP NE1 N Y N 265 TRP CE2 C Y N 266 TRP CE3 C Y N 267 TRP CZ2 C Y N 268 TRP CZ3 C Y N 269 TRP CH2 C Y N 270 TRP OXT O N N 271 TRP H H N N 272 TRP H2 H N N 273 TRP HA H N N 274 TRP HB2 H N N 275 TRP HB3 H N N 276 TRP HD1 H N N 277 TRP HE1 H N N 278 TRP HE3 H N N 279 TRP HZ2 H N N 280 TRP HZ3 H N N 281 TRP HH2 H N N 282 TRP HXT H N N 283 TYR N N N N 284 TYR CA C N S 285 TYR C C N N 286 TYR O O N N 287 TYR CB C N N 288 TYR CG C Y N 289 TYR CD1 C Y N 290 TYR CD2 C Y N 291 TYR CE1 C Y N 292 TYR CE2 C Y N 293 TYR CZ C Y N 294 TYR OH O N N 295 TYR OXT O N N 296 TYR H H N N 297 TYR H2 H N N 298 TYR HA H N N 299 TYR HB2 H N N 300 TYR HB3 H N N 301 TYR HD1 H N N 302 TYR HD2 H N N 303 TYR HE1 H N N 304 TYR HE2 H N N 305 TYR HH H N N 306 TYR HXT H N N 307 VAL N N N N 308 VAL CA C N S 309 VAL C C N N 310 VAL O O N N 311 VAL CB C N N 312 VAL CG1 C N N 313 VAL CG2 C N N 314 VAL OXT O N N 315 VAL H H N N 316 VAL H2 H N N 317 VAL HA H N N 318 VAL HB H N N 319 VAL HG11 H N N 320 VAL HG12 H N N 321 VAL HG13 H N N 322 VAL HG21 H N N 323 VAL HG22 H N N 324 VAL HG23 H N N 325 VAL HXT H N N 326 # loop_ _chem_comp_bond.comp_id _chem_comp_bond.atom_id_1 _chem_comp_bond.atom_id_2 _chem_comp_bond.value_order _chem_comp_bond.pdbx_aromatic_flag _chem_comp_bond.pdbx_stereo_config _chem_comp_bond.pdbx_ordinal ARG N CA sing N N 1 ARG N H sing N N 2 ARG N H2 sing N N 3 ARG CA C sing N N 4 ARG CA CB sing N N 5 ARG CA HA sing N N 6 ARG C O doub N N 7 ARG C OXT sing N N 8 ARG CB CG sing N N 9 ARG CB HB2 sing N N 10 ARG CB HB3 sing N N 11 ARG CG CD sing N N 12 ARG CG HG2 sing N N 13 ARG CG HG3 sing N N 14 ARG CD NE sing N N 15 ARG CD HD2 sing N N 16 ARG CD HD3 sing N N 17 ARG NE CZ sing N N 18 ARG NE HE sing N N 19 ARG CZ NH1 sing N N 20 ARG CZ NH2 doub N N 21 ARG NH1 HH11 sing N N 22 ARG NH1 HH12 sing N N 23 ARG NH2 HH21 sing N N 24 ARG NH2 HH22 sing N N 25 ARG OXT HXT sing N N 26 ASN N CA sing N N 27 ASN N H sing N N 28 ASN N H2 sing N N 29 ASN CA C sing N N 30 ASN CA CB sing N N 31 ASN CA HA sing N N 32 ASN C O doub N N 33 ASN C OXT sing N N 34 ASN CB CG sing N N 35 ASN CB HB2 sing N N 36 ASN CB HB3 sing N N 37 ASN CG OD1 doub N N 38 ASN CG ND2 sing N N 39 ASN ND2 HD21 sing N N 40 ASN ND2 HD22 sing N N 41 ASN OXT HXT sing N N 42 ASP N CA sing N N 43 ASP N H sing N N 44 ASP N H2 sing N N 45 ASP CA C sing N N 46 ASP CA CB sing N N 47 ASP CA HA sing N N 48 ASP C O doub N N 49 ASP C OXT sing N N 50 ASP CB CG sing N N 51 ASP CB HB2 sing N N 52 ASP CB HB3 sing N N 53 ASP CG OD1 doub N N 54 ASP CG OD2 sing N N 55 ASP OD2 HD2 sing N N 56 ASP OXT HXT sing N N 57 CYS N CA sing N N 58 CYS N H sing N N 59 CYS N H2 sing N N 60 CYS CA C sing N N 61 CYS CA CB sing N N 62 CYS CA HA sing N N 63 CYS C O doub N N 64 CYS C OXT sing N N 65 CYS CB SG sing N N 66 CYS CB HB2 sing N N 67 CYS CB HB3 sing N N 68 CYS SG HG sing N N 69 CYS OXT HXT sing N N 70 GLN N CA sing N N 71 GLN N H sing N N 72 GLN N H2 sing N N 73 GLN CA C sing N N 74 GLN CA CB sing N N 75 GLN CA HA sing N N 76 GLN C O doub N N 77 GLN C OXT sing N N 78 GLN CB CG sing N N 79 GLN CB HB2 sing N N 80 GLN CB HB3 sing N N 81 GLN CG CD sing N N 82 GLN CG HG2 sing N N 83 GLN CG HG3 sing N N 84 GLN CD OE1 doub N N 85 GLN CD NE2 sing N N 86 GLN NE2 HE21 sing N N 87 GLN NE2 HE22 sing N N 88 GLN OXT HXT sing N N 89 GLU N CA sing N N 90 GLU N H sing N N 91 GLU N H2 sing N N 92 GLU CA C sing N N 93 GLU CA CB sing N N 94 GLU CA HA sing N N 95 GLU C O doub N N 96 GLU C OXT sing N N 97 GLU CB CG sing N N 98 GLU CB HB2 sing N N 99 GLU CB HB3 sing N N 100 GLU CG CD sing N N 101 GLU CG HG2 sing N N 102 GLU CG HG3 sing N N 103 GLU CD OE1 doub N N 104 GLU CD OE2 sing N N 105 GLU OE2 HE2 sing N N 106 GLU OXT HXT sing N N 107 GLY N CA sing N N 108 GLY N H sing N N 109 GLY N H2 sing N N 110 GLY CA C sing N N 111 GLY CA HA2 sing N N 112 GLY CA HA3 sing N N 113 GLY C O doub N N 114 GLY C OXT sing N N 115 GLY OXT HXT sing N N 116 HIS N CA sing N N 117 HIS N H sing N N 118 HIS N H2 sing N N 119 HIS CA C sing N N 120 HIS CA CB sing N N 121 HIS CA HA sing N N 122 HIS C O doub N N 123 HIS C OXT sing N N 124 HIS CB CG sing N N 125 HIS CB HB2 sing N N 126 HIS CB HB3 sing N N 127 HIS CG ND1 sing Y N 128 HIS CG CD2 doub Y N 129 HIS ND1 CE1 doub Y N 130 HIS ND1 HD1 sing N N 131 HIS CD2 NE2 sing Y N 132 HIS CD2 HD2 sing N N 133 HIS CE1 NE2 sing Y N 134 HIS CE1 HE1 sing N N 135 HIS NE2 HE2 sing N N 136 HIS OXT HXT sing N N 137 ILE N CA sing N N 138 ILE N H sing N N 139 ILE N H2 sing N N 140 ILE CA C sing N N 141 ILE CA CB sing N N 142 ILE CA HA sing N N 143 ILE C O doub N N 144 ILE C OXT sing N N 145 ILE CB CG1 sing N N 146 ILE CB CG2 sing N N 147 ILE CB HB sing N N 148 ILE CG1 CD1 sing N N 149 ILE CG1 HG12 sing N N 150 ILE CG1 HG13 sing N N 151 ILE CG2 HG21 sing N N 152 ILE CG2 HG22 sing N N 153 ILE CG2 HG23 sing N N 154 ILE CD1 HD11 sing N N 155 ILE CD1 HD12 sing N N 156 ILE CD1 HD13 sing N N 157 ILE OXT HXT sing N N 158 LEU N CA sing N N 159 LEU N H sing N N 160 LEU N H2 sing N N 161 LEU CA C sing N N 162 LEU CA CB sing N N 163 LEU CA HA sing N N 164 LEU C O doub N N 165 LEU C OXT sing N N 166 LEU CB CG sing N N 167 LEU CB HB2 sing N N 168 LEU CB HB3 sing N N 169 LEU CG CD1 sing N N 170 LEU CG CD2 sing N N 171 LEU CG HG sing N N 172 LEU CD1 HD11 sing N N 173 LEU CD1 HD12 sing N N 174 LEU CD1 HD13 sing N N 175 LEU CD2 HD21 sing N N 176 LEU CD2 HD22 sing N N 177 LEU CD2 HD23 sing N N 178 LEU OXT HXT sing N N 179 MET N CA sing N N 180 MET N H sing N N 181 MET N H2 sing N N 182 MET CA C sing N N 183 MET CA CB sing N N 184 MET CA HA sing N N 185 MET C O doub N N 186 MET C OXT sing N N 187 MET CB CG sing N N 188 MET CB HB2 sing N N 189 MET CB HB3 sing N N 190 MET CG SD sing N N 191 MET CG HG2 sing N N 192 MET CG HG3 sing N N 193 MET SD CE sing N N 194 MET CE HE1 sing N N 195 MET CE HE2 sing N N 196 MET CE HE3 sing N N 197 MET OXT HXT sing N N 198 PRO N CA sing N N 199 PRO N CD sing N N 200 PRO N H sing N N 201 PRO CA C sing N N 202 PRO CA CB sing N N 203 PRO CA HA sing N N 204 PRO C O doub N N 205 PRO C OXT sing N N 206 PRO CB CG sing N N 207 PRO CB HB2 sing N N 208 PRO CB HB3 sing N N 209 PRO CG CD sing N N 210 PRO CG HG2 sing N N 211 PRO CG HG3 sing N N 212 PRO CD HD2 sing N N 213 PRO CD HD3 sing N N 214 PRO OXT HXT sing N N 215 SER N CA sing N N 216 SER N H sing N N 217 SER N H2 sing N N 218 SER CA C sing N N 219 SER CA CB sing N N 220 SER CA HA sing N N 221 SER C O doub N N 222 SER C OXT sing N N 223 SER CB OG sing N N 224 SER CB HB2 sing N N 225 SER CB HB3 sing N N 226 SER OG HG sing N N 227 SER OXT HXT sing N N 228 THR N CA sing N N 229 THR N H sing N N 230 THR N H2 sing N N 231 THR CA C sing N N 232 THR CA CB sing N N 233 THR CA HA sing N N 234 THR C O doub N N 235 THR C OXT sing N N 236 THR CB OG1 sing N N 237 THR CB CG2 sing N N 238 THR CB HB sing N N 239 THR OG1 HG1 sing N N 240 THR CG2 HG21 sing N N 241 THR CG2 HG22 sing N N 242 THR CG2 HG23 sing N N 243 THR OXT HXT sing N N 244 TRP N CA sing N N 245 TRP N H sing N N 246 TRP N H2 sing N N 247 TRP CA C sing N N 248 TRP CA CB sing N N 249 TRP CA HA sing N N 250 TRP C O doub N N 251 TRP C OXT sing N N 252 TRP CB CG sing N N 253 TRP CB HB2 sing N N 254 TRP CB HB3 sing N N 255 TRP CG CD1 doub Y N 256 TRP CG CD2 sing Y N 257 TRP CD1 NE1 sing Y N 258 TRP CD1 HD1 sing N N 259 TRP CD2 CE2 doub Y N 260 TRP CD2 CE3 sing Y N 261 TRP NE1 CE2 sing Y N 262 TRP NE1 HE1 sing N N 263 TRP CE2 CZ2 sing Y N 264 TRP CE3 CZ3 doub Y N 265 TRP CE3 HE3 sing N N 266 TRP CZ2 CH2 doub Y N 267 TRP CZ2 HZ2 sing N N 268 TRP CZ3 CH2 sing Y N 269 TRP CZ3 HZ3 sing N N 270 TRP CH2 HH2 sing N N 271 TRP OXT HXT sing N N 272 TYR N CA sing N N 273 TYR N H sing N N 274 TYR N H2 sing N N 275 TYR CA C sing N N 276 TYR CA CB sing N N 277 TYR CA HA sing N N 278 TYR C O doub N N 279 TYR C OXT sing N N 280 TYR CB CG sing N N 281 TYR CB HB2 sing N N 282 TYR CB HB3 sing N N 283 TYR CG CD1 doub Y N 284 TYR CG CD2 sing Y N 285 TYR CD1 CE1 sing Y N 286 TYR CD1 HD1 sing N N 287 TYR CD2 CE2 doub Y N 288 TYR CD2 HD2 sing N N 289 TYR CE1 CZ doub Y N 290 TYR CE1 HE1 sing N N 291 TYR CE2 CZ sing Y N 292 TYR CE2 HE2 sing N N 293 TYR CZ OH sing N N 294 TYR OH HH sing N N 295 TYR OXT HXT sing N N 296 VAL N CA sing N N 297 VAL N H sing N N 298 VAL N H2 sing N N 299 VAL CA C sing N N 300 VAL CA CB sing N N 301 VAL CA HA sing N N 302 VAL C O doub N N 303 VAL C OXT sing N N 304 VAL CB CG1 sing N N 305 VAL CB CG2 sing N N 306 VAL CB HB sing N N 307 VAL CG1 HG11 sing N N 308 VAL CG1 HG12 sing N N 309 VAL CG1 HG13 sing N N 310 VAL CG2 HG21 sing N N 311 VAL CG2 HG22 sing N N 312 VAL CG2 HG23 sing N N 313 VAL OXT HXT sing N N 314 # _atom_sites.entry_id 1EGF _atom_sites.fract_transf_matrix[1][1] 1.000000 _atom_sites.fract_transf_matrix[1][2] 0.000000 _atom_sites.fract_transf_matrix[1][3] 0.000000 _atom_sites.fract_transf_matrix[2][1] 0.000000 _atom_sites.fract_transf_matrix[2][2] 1.000000 _atom_sites.fract_transf_matrix[2][3] 0.000000 _atom_sites.fract_transf_matrix[3][1] 0.000000 _atom_sites.fract_transf_matrix[3][2] 0.000000 _atom_sites.fract_transf_matrix[3][3] 1.000000 _atom_sites.fract_transf_vector[1] 0.00000 _atom_sites.fract_transf_vector[2] 0.00000 _atom_sites.fract_transf_vector[3] 0.00000 # loop_ _atom_type.symbol C N O S # 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 1 N N . ASN A 1 1 ? -2.273 16.593 1.039 1.00 0.00 ? 1 ASN A N 1 ATOM 2 C CA . ASN A 1 1 ? -3.420 16.141 1.806 1.00 0.00 ? 1 ASN A CA 1 ATOM 3 C C . ASN A 1 1 ? -3.715 14.679 1.458 1.00 0.00 ? 1 ASN A C 1 ATOM 4 O O . ASN A 1 1 ? -3.180 14.149 0.485 1.00 0.00 ? 1 ASN A O 1 ATOM 5 C CB . ASN A 1 1 ? -4.665 16.965 1.474 1.00 0.00 ? 1 ASN A CB 1 ATOM 6 C CG . ASN A 1 1 ? -4.756 18.203 2.369 1.00 0.00 ? 1 ASN A CG 1 ATOM 7 O OD1 . ASN A 1 1 ? -4.165 19.237 2.107 1.00 0.00 ? 1 ASN A OD1 1 ATOM 8 N ND2 . ASN A 1 1 ? -5.529 18.040 3.439 1.00 0.00 ? 1 ASN A ND2 1 ATOM 9 N N . SER A 1 2 ? -4.566 14.070 2.272 1.00 0.00 ? 2 SER A N 1 ATOM 10 C CA . SER A 1 2 ? -4.937 12.682 2.063 1.00 0.00 ? 2 SER A CA 1 ATOM 11 C C . SER A 1 2 ? -6.423 12.585 1.708 1.00 0.00 ? 2 SER A C 1 ATOM 12 O O . SER A 1 2 ? -7.251 13.278 2.300 1.00 0.00 ? 2 SER A O 1 ATOM 13 C CB . SER A 1 2 ? -4.630 11.836 3.299 1.00 0.00 ? 2 SER A CB 1 ATOM 14 O OG . SER A 1 2 ? -3.244 11.521 3.400 1.00 0.00 ? 2 SER A OG 1 ATOM 15 N N . TYR A 1 3 ? -6.716 11.721 0.748 1.00 0.00 ? 3 TYR A N 1 ATOM 16 C CA . TYR A 1 3 ? -8.087 11.526 0.310 1.00 0.00 ? 3 TYR A CA 1 ATOM 17 C C . TYR A 1 3 ? -8.328 10.074 -0.106 1.00 0.00 ? 3 TYR A C 1 ATOM 18 O O . TYR A 1 3 ? -7.537 9.499 -0.852 1.00 0.00 ? 3 TYR A O 1 ATOM 19 C CB . TYR A 1 3 ? -8.273 12.431 -0.910 1.00 0.00 ? 3 TYR A CB 1 ATOM 20 C CG . TYR A 1 3 ? -9.654 12.324 -1.559 1.00 0.00 ? 3 TYR A CG 1 ATOM 21 C CD1 . TYR A 1 3 ? -10.024 11.161 -2.203 1.00 0.00 ? 3 TYR A CD1 1 ATOM 22 C CD2 . TYR A 1 3 ? -10.528 13.389 -1.502 1.00 0.00 ? 3 TYR A CD2 1 ATOM 23 C CE1 . TYR A 1 3 ? -11.325 11.059 -2.815 1.00 0.00 ? 3 TYR A CE1 1 ATOM 24 C CE2 . TYR A 1 3 ? -11.828 13.289 -2.114 1.00 0.00 ? 3 TYR A CE2 1 ATOM 25 C CZ . TYR A 1 3 ? -12.162 12.128 -2.740 1.00 0.00 ? 3 TYR A CZ 1 ATOM 26 O OH . TYR A 1 3 ? -13.389 12.032 -3.318 1.00 0.00 ? 3 TYR A OH 1 ATOM 27 N N . PRO A 1 4 ? -9.452 9.507 0.407 1.00 0.00 ? 4 PRO A N 1 ATOM 28 C CA . PRO A 1 4 ? -9.808 8.133 0.097 1.00 0.00 ? 4 PRO A CA 1 ATOM 29 C C . PRO A 1 4 ? -10.357 8.017 -1.326 1.00 0.00 ? 4 PRO A C 1 ATOM 30 O O . PRO A 1 4 ? -11.453 8.497 -1.613 1.00 0.00 ? 4 PRO A O 1 ATOM 31 C CB . PRO A 1 4 ? -10.822 7.740 1.159 1.00 0.00 ? 4 PRO A CB 1 ATOM 32 C CG . PRO A 1 4 ? -11.344 9.044 1.740 1.00 0.00 ? 4 PRO A CG 1 ATOM 33 C CD . PRO A 1 4 ? -10.414 10.159 1.294 1.00 0.00 ? 4 PRO A CD 1 ATOM 34 N N . GLY A 1 5 ? -9.571 7.377 -2.179 1.00 0.00 ? 5 GLY A N 1 ATOM 35 C CA . GLY A 1 5 ? -9.965 7.192 -3.566 1.00 0.00 ? 5 GLY A CA 1 ATOM 36 C C . GLY A 1 5 ? -9.067 6.163 -4.257 1.00 0.00 ? 5 GLY A C 1 ATOM 37 O O . GLY A 1 5 ? -7.906 5.999 -3.888 1.00 0.00 ? 5 GLY A O 1 ATOM 38 N N . CYS A 1 6 ? -9.640 5.498 -5.249 1.00 0.00 ? 6 CYS A N 1 ATOM 39 C CA . CYS A 1 6 ? -8.906 4.491 -5.996 1.00 0.00 ? 6 CYS A CA 1 ATOM 40 C C . CYS A 1 6 ? -9.821 3.946 -7.095 1.00 0.00 ? 6 CYS A C 1 ATOM 41 O O . CYS A 1 6 ? -10.535 2.966 -6.885 1.00 0.00 ? 6 CYS A O 1 ATOM 42 C CB . CYS A 1 6 ? -8.386 3.377 -5.085 1.00 0.00 ? 6 CYS A CB 1 ATOM 43 S SG . CYS A 1 6 ? -7.096 2.315 -5.831 1.00 0.00 ? 6 CYS A SG 1 ATOM 44 N N . PRO A 1 7 ? -9.770 4.623 -8.273 1.00 0.00 ? 7 PRO A N 1 ATOM 45 C CA . PRO A 1 7 ? -10.586 4.218 -9.405 1.00 0.00 ? 7 PRO A CA 1 ATOM 46 C C . PRO A 1 7 ? -10.020 2.958 -10.065 1.00 0.00 ? 7 PRO A C 1 ATOM 47 O O . PRO A 1 7 ? -8.994 2.434 -9.635 1.00 0.00 ? 7 PRO A O 1 ATOM 48 C CB . PRO A 1 7 ? -10.594 5.420 -10.335 1.00 0.00 ? 7 PRO A CB 1 ATOM 49 C CG . PRO A 1 7 ? -9.413 6.280 -9.915 1.00 0.00 ? 7 PRO A CG 1 ATOM 50 C CD . PRO A 1 7 ? -8.938 5.788 -8.558 1.00 0.00 ? 7 PRO A CD 1 ATOM 51 N N . SER A 1 8 ? -10.717 2.505 -11.099 1.00 0.00 ? 8 SER A N 1 ATOM 52 C CA . SER A 1 8 ? -10.298 1.318 -11.822 1.00 0.00 ? 8 SER A CA 1 ATOM 53 C C . SER A 1 8 ? -9.402 1.711 -13.000 1.00 0.00 ? 8 SER A C 1 ATOM 54 O O . SER A 1 8 ? -9.202 0.921 -13.921 1.00 0.00 ? 8 SER A O 1 ATOM 55 C CB . SER A 1 8 ? -11.505 0.520 -12.316 1.00 0.00 ? 8 SER A CB 1 ATOM 56 O OG . SER A 1 8 ? -12.397 0.191 -11.254 1.00 0.00 ? 8 SER A OG 1 ATOM 57 N N . SER A 1 9 ? -8.887 2.930 -12.931 1.00 0.00 ? 9 SER A N 1 ATOM 58 C CA . SER A 1 9 ? -8.019 3.435 -13.979 1.00 0.00 ? 9 SER A CA 1 ATOM 59 C C . SER A 1 9 ? -6.615 2.850 -13.823 1.00 0.00 ? 9 SER A C 1 ATOM 60 O O . SER A 1 9 ? -5.827 2.855 -14.768 1.00 0.00 ? 9 SER A O 1 ATOM 61 C CB . SER A 1 9 ? -7.963 4.965 -13.957 1.00 0.00 ? 9 SER A CB 1 ATOM 62 O OG . SER A 1 9 ? -9.230 5.548 -14.242 1.00 0.00 ? 9 SER A OG 1 ATOM 63 N N . TYR A 1 10 ? -6.342 2.359 -12.623 1.00 0.00 ? 10 TYR A N 1 ATOM 64 C CA . TYR A 1 10 ? -5.046 1.771 -12.331 1.00 0.00 ? 10 TYR A CA 1 ATOM 65 C C . TYR A 1 10 ? -5.059 0.264 -12.579 1.00 0.00 ? 10 TYR A C 1 ATOM 66 O O . TYR A 1 10 ? -4.924 -0.185 -13.718 1.00 0.00 ? 10 TYR A O 1 ATOM 67 C CB . TYR A 1 10 ? -4.790 2.030 -10.845 1.00 0.00 ? 10 TYR A CB 1 ATOM 68 C CG . TYR A 1 10 ? -4.394 3.472 -10.523 1.00 0.00 ? 10 TYR A CG 1 ATOM 69 C CD1 . TYR A 1 10 ? -3.197 3.979 -10.987 1.00 0.00 ? 10 TYR A CD1 1 ATOM 70 C CD2 . TYR A 1 10 ? -5.234 4.267 -9.768 1.00 0.00 ? 10 TYR A CD2 1 ATOM 71 C CE1 . TYR A 1 10 ? -2.825 5.337 -10.683 1.00 0.00 ? 10 TYR A CE1 1 ATOM 72 C CE2 . TYR A 1 10 ? -4.861 5.624 -9.466 1.00 0.00 ? 10 TYR A CE2 1 ATOM 73 C CZ . TYR A 1 10 ? -3.676 6.092 -9.937 1.00 0.00 ? 10 TYR A CZ 1 ATOM 74 O OH . TYR A 1 10 ? -3.322 7.374 -9.651 1.00 0.00 ? 10 TYR A OH 1 ATOM 75 N N . ASP A 1 11 ? -5.225 -0.481 -11.496 1.00 0.00 ? 11 ASP A N 1 ATOM 76 C CA . ASP A 1 11 ? -5.258 -1.932 -11.581 1.00 0.00 ? 11 ASP A CA 1 ATOM 77 C C . ASP A 1 11 ? -4.812 -2.527 -10.245 1.00 0.00 ? 11 ASP A C 1 ATOM 78 O O . ASP A 1 11 ? -3.630 -2.807 -10.048 1.00 0.00 ? 11 ASP A O 1 ATOM 79 C CB . ASP A 1 11 ? -4.308 -2.442 -12.667 1.00 0.00 ? 11 ASP A CB 1 ATOM 80 C CG . ASP A 1 11 ? -4.984 -2.846 -13.979 1.00 0.00 ? 11 ASP A CG 1 ATOM 81 O OD1 . ASP A 1 11 ? -5.914 -3.666 -13.990 1.00 0.00 ? 11 ASP A OD1 1 ATOM 82 O OD2 . ASP A 1 11 ? -4.509 -2.276 -15.034 1.00 0.00 ? 11 ASP A OD2 1 ATOM 83 N N . GLY A 1 12 ? -5.781 -2.706 -9.359 1.00 0.00 ? 12 GLY A N 1 ATOM 84 C CA . GLY A 1 12 ? -5.504 -3.265 -8.047 1.00 0.00 ? 12 GLY A CA 1 ATOM 85 C C . GLY A 1 12 ? -4.232 -2.657 -7.452 1.00 0.00 ? 12 GLY A C 1 ATOM 86 O O . GLY A 1 12 ? -3.373 -3.379 -6.944 1.00 0.00 ? 12 GLY A O 1 ATOM 87 N N . TYR A 1 13 ? -4.150 -1.337 -7.534 1.00 0.00 ? 13 TYR A N 1 ATOM 88 C CA . TYR A 1 13 ? -2.997 -0.625 -7.008 1.00 0.00 ? 13 TYR A CA 1 ATOM 89 C C . TYR A 1 13 ? -2.455 -1.310 -5.753 1.00 0.00 ? 13 TYR A C 1 ATOM 90 O O . TYR A 1 13 ? -1.246 -1.323 -5.521 1.00 0.00 ? 13 TYR A O 1 ATOM 91 C CB . TYR A 1 13 ? -3.498 0.773 -6.637 1.00 0.00 ? 13 TYR A CB 1 ATOM 92 C CG . TYR A 1 13 ? -2.483 1.886 -6.899 1.00 0.00 ? 13 TYR A CG 1 ATOM 93 C CD1 . TYR A 1 13 ? -2.423 2.488 -8.140 1.00 0.00 ? 13 TYR A CD1 1 ATOM 94 C CD2 . TYR A 1 13 ? -1.629 2.292 -5.895 1.00 0.00 ? 13 TYR A CD2 1 ATOM 95 C CE1 . TYR A 1 13 ? -1.466 3.536 -8.386 1.00 0.00 ? 13 TYR A CE1 1 ATOM 96 C CE2 . TYR A 1 13 ? -0.673 3.341 -6.140 1.00 0.00 ? 13 TYR A CE2 1 ATOM 97 C CZ . TYR A 1 13 ? -0.640 3.911 -7.375 1.00 0.00 ? 13 TYR A CZ 1 ATOM 98 O OH . TYR A 1 13 ? 0.263 4.902 -7.608 1.00 0.00 ? 13 TYR A OH 1 ATOM 99 N N . CYS A 1 14 ? -3.375 -1.861 -4.975 1.00 0.00 ? 14 CYS A N 1 ATOM 100 C CA . CYS A 1 14 ? -3.003 -2.545 -3.747 1.00 0.00 ? 14 CYS A CA 1 ATOM 101 C C . CYS A 1 14 ? -3.093 -4.053 -3.992 1.00 0.00 ? 14 CYS A C 1 ATOM 102 O O . CYS A 1 14 ? -4.148 -4.564 -4.364 1.00 0.00 ? 14 CYS A O 1 ATOM 103 C CB . CYS A 1 14 ? -3.874 -2.107 -2.569 1.00 0.00 ? 14 CYS A CB 1 ATOM 104 S SG . CYS A 1 14 ? -4.528 -0.402 -2.692 1.00 0.00 ? 14 CYS A SG 1 ATOM 105 N N . LEU A 1 15 ? -1.971 -4.725 -3.775 1.00 0.00 ? 15 LEU A N 1 ATOM 106 C CA . LEU A 1 15 ? -1.910 -6.164 -3.967 1.00 0.00 ? 15 LEU A CA 1 ATOM 107 C C . LEU A 1 15 ? -1.356 -6.821 -2.702 1.00 0.00 ? 15 LEU A C 1 ATOM 108 O O . LEU A 1 15 ? -0.814 -6.140 -1.831 1.00 0.00 ? 15 LEU A O 1 ATOM 109 C CB . LEU A 1 15 ? -1.120 -6.501 -5.233 1.00 0.00 ? 15 LEU A CB 1 ATOM 110 C CG . LEU A 1 15 ? -0.852 -5.337 -6.189 1.00 0.00 ? 15 LEU A CG 1 ATOM 111 C CD1 . LEU A 1 15 ? 0.487 -4.666 -5.874 1.00 0.00 ? 15 LEU A CD1 1 ATOM 112 C CD2 . LEU A 1 15 ? -0.936 -5.793 -7.646 1.00 0.00 ? 15 LEU A CD2 1 ATOM 113 N N . ASN A 1 16 ? -1.509 -8.134 -2.639 1.00 0.00 ? 16 ASN A N 1 ATOM 114 C CA . ASN A 1 16 ? -1.030 -8.890 -1.494 1.00 0.00 ? 16 ASN A CA 1 ATOM 115 C C . ASN A 1 16 ? -2.039 -8.771 -0.352 1.00 0.00 ? 16 ASN A C 1 ATOM 116 O O . ASN A 1 16 ? -2.457 -9.777 0.221 1.00 0.00 ? 16 ASN A O 1 ATOM 117 C CB . ASN A 1 16 ? 0.312 -8.348 -0.998 1.00 0.00 ? 16 ASN A CB 1 ATOM 118 C CG . ASN A 1 16 ? 1.224 -7.985 -2.171 1.00 0.00 ? 16 ASN A CG 1 ATOM 119 O OD1 . ASN A 1 16 ? 1.364 -6.833 -2.551 1.00 0.00 ? 16 ASN A OD1 1 ATOM 120 N ND2 . ASN A 1 16 ? 1.836 -9.028 -2.725 1.00 0.00 ? 16 ASN A ND2 1 ATOM 121 N N . GLY A 1 17 ? -2.404 -7.533 -0.053 1.00 0.00 ? 17 GLY A N 1 ATOM 122 C CA . GLY A 1 17 ? -3.357 -7.270 1.012 1.00 0.00 ? 17 GLY A CA 1 ATOM 123 C C . GLY A 1 17 ? -3.145 -5.875 1.603 1.00 0.00 ? 17 GLY A C 1 ATOM 124 O O . GLY A 1 17 ? -2.528 -5.733 2.660 1.00 0.00 ? 17 GLY A O 1 ATOM 125 N N . GLY A 1 18 ? -3.669 -4.881 0.901 1.00 0.00 ? 18 GLY A N 1 ATOM 126 C CA . GLY A 1 18 ? -3.545 -3.503 1.346 1.00 0.00 ? 18 GLY A CA 1 ATOM 127 C C . GLY A 1 18 ? -4.718 -2.658 0.847 1.00 0.00 ? 18 GLY A C 1 ATOM 128 O O . GLY A 1 18 ? -5.360 -3.004 -0.145 1.00 0.00 ? 18 GLY A O 1 ATOM 129 N N . VAL A 1 19 ? -4.964 -1.568 1.558 1.00 0.00 ? 19 VAL A N 1 ATOM 130 C CA . VAL A 1 19 ? -6.050 -0.670 1.200 1.00 0.00 ? 19 VAL A CA 1 ATOM 131 C C . VAL A 1 19 ? -5.553 0.334 0.159 1.00 0.00 ? 19 VAL A C 1 ATOM 132 O O . VAL A 1 19 ? -4.350 0.478 -0.045 1.00 0.00 ? 19 VAL A O 1 ATOM 133 C CB . VAL A 1 19 ? -6.612 0.000 2.455 1.00 0.00 ? 19 VAL A CB 1 ATOM 134 C CG1 . VAL A 1 19 ? -8.048 0.474 2.228 1.00 0.00 ? 19 VAL A CG1 1 ATOM 135 C CG2 . VAL A 1 19 ? -6.528 -0.940 3.660 1.00 0.00 ? 19 VAL A CG2 1 ATOM 136 N N . CYS A 1 20 ? -6.507 1.001 -0.476 1.00 0.00 ? 20 CYS A N 1 ATOM 137 C CA . CYS A 1 20 ? -6.182 1.988 -1.492 1.00 0.00 ? 20 CYS A CA 1 ATOM 138 C C . CYS A 1 20 ? -6.595 3.367 -0.973 1.00 0.00 ? 20 CYS A C 1 ATOM 139 O O . CYS A 1 20 ? -7.674 3.521 -0.405 1.00 0.00 ? 20 CYS A O 1 ATOM 140 C CB . CYS A 1 20 ? -6.845 1.660 -2.832 1.00 0.00 ? 20 CYS A CB 1 ATOM 141 S SG . CYS A 1 20 ? -5.933 2.252 -4.303 1.00 0.00 ? 20 CYS A SG 1 ATOM 142 N N . MET A 1 21 ? -5.713 4.332 -1.186 1.00 0.00 ? 21 MET A N 1 ATOM 143 C CA . MET A 1 21 ? -5.973 5.692 -0.746 1.00 0.00 ? 21 MET A CA 1 ATOM 144 C C . MET A 1 21 ? -5.380 6.706 -1.725 1.00 0.00 ? 21 MET A C 1 ATOM 145 O O . MET A 1 21 ? -4.267 6.524 -2.215 1.00 0.00 ? 21 MET A O 1 ATOM 146 C CB . MET A 1 21 ? -5.364 5.905 0.641 1.00 0.00 ? 21 MET A CB 1 ATOM 147 C CG . MET A 1 21 ? -3.893 6.313 0.539 1.00 0.00 ? 21 MET A CG 1 ATOM 148 S SD . MET A 1 21 ? -3.764 8.083 0.343 1.00 0.00 ? 21 MET A SD 1 ATOM 149 C CE . MET A 1 21 ? -4.741 8.621 1.737 1.00 0.00 ? 21 MET A CE 1 ATOM 150 N N . HIS A 1 22 ? -6.151 7.754 -1.981 1.00 0.00 ? 22 HIS A N 1 ATOM 151 C CA . HIS A 1 22 ? -5.715 8.798 -2.893 1.00 0.00 ? 22 HIS A CA 1 ATOM 152 C C . HIS A 1 22 ? -4.961 9.878 -2.114 1.00 0.00 ? 22 HIS A C 1 ATOM 153 O O . HIS A 1 22 ? -5.278 10.150 -0.957 1.00 0.00 ? 22 HIS A O 1 ATOM 154 C CB . HIS A 1 22 ? -6.900 9.356 -3.684 1.00 0.00 ? 22 HIS A CB 1 ATOM 155 C CG . HIS A 1 22 ? -6.503 10.259 -4.829 1.00 0.00 ? 22 HIS A CG 1 ATOM 156 N ND1 . HIS A 1 22 ? -7.230 11.381 -5.185 1.00 0.00 ? 22 HIS A ND1 1 ATOM 157 C CD2 . HIS A 1 22 ? -5.449 10.191 -5.692 1.00 0.00 ? 22 HIS A CD2 1 ATOM 158 C CE1 . HIS A 1 22 ? -6.631 11.957 -6.217 1.00 0.00 ? 22 HIS A CE1 1 ATOM 159 N NE2 . HIS A 1 22 ? -5.528 11.217 -6.531 1.00 0.00 ? 22 HIS A NE2 1 ATOM 160 N N . ILE A 1 23 ? -3.977 10.465 -2.781 1.00 0.00 ? 23 ILE A N 1 ATOM 161 C CA . ILE A 1 23 ? -3.175 11.509 -2.165 1.00 0.00 ? 23 ILE A CA 1 ATOM 162 C C . ILE A 1 23 ? -3.497 12.851 -2.827 1.00 0.00 ? 23 ILE A C 1 ATOM 163 O O . ILE A 1 23 ? -3.940 12.889 -3.976 1.00 0.00 ? 23 ILE A O 1 ATOM 164 C CB . ILE A 1 23 ? -1.692 11.142 -2.211 1.00 0.00 ? 23 ILE A CB 1 ATOM 165 C CG1 . ILE A 1 23 ? -1.505 9.638 -2.422 1.00 0.00 ? 23 ILE A CG1 1 ATOM 166 C CG2 . ILE A 1 23 ? -0.964 11.638 -0.962 1.00 0.00 ? 23 ILE A CG2 1 ATOM 167 C CD1 . ILE A 1 23 ? -0.035 9.298 -2.674 1.00 0.00 ? 23 ILE A CD1 1 ATOM 168 N N . GLU A 1 24 ? -3.264 13.916 -2.077 1.00 0.00 ? 24 GLU A N 1 ATOM 169 C CA . GLU A 1 24 ? -3.523 15.255 -2.578 1.00 0.00 ? 24 GLU A CA 1 ATOM 170 C C . GLU A 1 24 ? -2.208 16.015 -2.768 1.00 0.00 ? 24 GLU A C 1 ATOM 171 O O . GLU A 1 24 ? -2.201 17.127 -3.291 1.00 0.00 ? 24 GLU A O 1 ATOM 172 C CB . GLU A 1 24 ? -4.466 16.016 -1.641 1.00 0.00 ? 24 GLU A CB 1 ATOM 173 C CG . GLU A 1 24 ? -5.918 15.895 -2.109 1.00 0.00 ? 24 GLU A CG 1 ATOM 174 C CD . GLU A 1 24 ? -6.861 16.650 -1.170 1.00 0.00 ? 24 GLU A CD 1 ATOM 175 O OE1 . GLU A 1 24 ? -7.296 16.094 -0.150 1.00 0.00 ? 24 GLU A OE1 1 ATOM 176 O OE2 . GLU A 1 24 ? -7.136 17.857 -1.529 1.00 0.00 ? 24 GLU A OE2 1 ATOM 177 N N . SER A 1 25 ? -1.129 15.382 -2.332 1.00 0.00 ? 25 SER A N 1 ATOM 178 C CA . SER A 1 25 ? 0.188 15.984 -2.449 1.00 0.00 ? 25 SER A CA 1 ATOM 179 C C . SER A 1 25 ? 0.500 16.282 -3.917 1.00 0.00 ? 25 SER A C 1 ATOM 180 O O . SER A 1 25 ? 1.243 17.214 -4.222 1.00 0.00 ? 25 SER A O 1 ATOM 181 C CB . SER A 1 25 ? 1.265 15.075 -1.852 1.00 0.00 ? 25 SER A CB 1 ATOM 182 O OG . SER A 1 25 ? 2.555 15.680 -1.887 1.00 0.00 ? 25 SER A OG 1 ATOM 183 N N . LEU A 1 26 ? -0.084 15.473 -4.788 1.00 0.00 ? 26 LEU A N 1 ATOM 184 C CA . LEU A 1 26 ? 0.121 15.638 -6.217 1.00 0.00 ? 26 LEU A CA 1 ATOM 185 C C . LEU A 1 26 ? -1.034 14.981 -6.973 1.00 0.00 ? 26 LEU A C 1 ATOM 186 O O . LEU A 1 26 ? -0.886 14.602 -8.134 1.00 0.00 ? 26 LEU A O 1 ATOM 187 C CB . LEU A 1 26 ? 1.499 15.113 -6.623 1.00 0.00 ? 26 LEU A CB 1 ATOM 188 C CG . LEU A 1 26 ? 2.484 16.156 -7.160 1.00 0.00 ? 26 LEU A CG 1 ATOM 189 C CD1 . LEU A 1 26 ? 3.884 15.561 -7.313 1.00 0.00 ? 26 LEU A CD1 1 ATOM 190 C CD2 . LEU A 1 26 ? 1.974 16.767 -8.467 1.00 0.00 ? 26 LEU A CD2 1 ATOM 191 N N . ASP A 1 27 ? -2.160 14.865 -6.285 1.00 0.00 ? 27 ASP A N 1 ATOM 192 C CA . ASP A 1 27 ? -3.341 14.261 -6.877 1.00 0.00 ? 27 ASP A CA 1 ATOM 193 C C . ASP A 1 27 ? -3.007 12.837 -7.331 1.00 0.00 ? 27 ASP A C 1 ATOM 194 O O . ASP A 1 27 ? -3.592 12.334 -8.289 1.00 0.00 ? 27 ASP A O 1 ATOM 195 C CB . ASP A 1 27 ? -3.808 15.049 -8.104 1.00 0.00 ? 27 ASP A CB 1 ATOM 196 C CG . ASP A 1 27 ? -5.320 15.260 -8.198 1.00 0.00 ? 27 ASP A CG 1 ATOM 197 O OD1 . ASP A 1 27 ? -5.776 16.251 -7.510 1.00 0.00 ? 27 ASP A OD1 1 ATOM 198 O OD2 . ASP A 1 27 ? -6.026 14.514 -8.894 1.00 0.00 ? 27 ASP A OD2 1 ATOM 199 N N . SER A 1 28 ? -2.070 12.230 -6.619 1.00 0.00 ? 28 SER A N 1 ATOM 200 C CA . SER A 1 28 ? -1.650 10.874 -6.936 1.00 0.00 ? 28 SER A CA 1 ATOM 201 C C . SER A 1 28 ? -2.348 9.880 -6.005 1.00 0.00 ? 28 SER A C 1 ATOM 202 O O . SER A 1 28 ? -2.821 10.255 -4.934 1.00 0.00 ? 28 SER A O 1 ATOM 203 C CB . SER A 1 28 ? -0.132 10.728 -6.827 1.00 0.00 ? 28 SER A CB 1 ATOM 204 O OG . SER A 1 28 ? 0.318 9.459 -7.295 1.00 0.00 ? 28 SER A OG 1 ATOM 205 N N . TYR A 1 29 ? -2.387 8.632 -6.449 1.00 0.00 ? 29 TYR A N 1 ATOM 206 C CA . TYR A 1 29 ? -3.019 7.582 -5.668 1.00 0.00 ? 29 TYR A CA 1 ATOM 207 C C . TYR A 1 29 ? -1.977 6.604 -5.121 1.00 0.00 ? 29 TYR A C 1 ATOM 208 O O . TYR A 1 29 ? -1.080 6.176 -5.845 1.00 0.00 ? 29 TYR A O 1 ATOM 209 C CB . TYR A 1 29 ? -3.942 6.837 -6.634 1.00 0.00 ? 29 TYR A CB 1 ATOM 210 C CG . TYR A 1 29 ? -5.247 7.574 -6.943 1.00 0.00 ? 29 TYR A CG 1 ATOM 211 C CD1 . TYR A 1 29 ? -5.262 8.584 -7.882 1.00 0.00 ? 29 TYR A CD1 1 ATOM 212 C CD2 . TYR A 1 29 ? -6.408 7.230 -6.280 1.00 0.00 ? 29 TYR A CD2 1 ATOM 213 C CE1 . TYR A 1 29 ? -6.489 9.280 -8.173 1.00 0.00 ? 29 TYR A CE1 1 ATOM 214 C CE2 . TYR A 1 29 ? -7.635 7.925 -6.570 1.00 0.00 ? 29 TYR A CE2 1 ATOM 215 C CZ . TYR A 1 29 ? -7.615 8.916 -7.503 1.00 0.00 ? 29 TYR A CZ 1 ATOM 216 O OH . TYR A 1 29 ? -8.774 9.572 -7.777 1.00 0.00 ? 29 TYR A OH 1 ATOM 217 N N . THR A 1 30 ? -2.130 6.278 -3.846 1.00 0.00 ? 30 THR A N 1 ATOM 218 C CA . THR A 1 30 ? -1.213 5.358 -3.193 1.00 0.00 ? 30 THR A CA 1 ATOM 219 C C . THR A 1 30 ? -1.978 4.168 -2.609 1.00 0.00 ? 30 THR A C 1 ATOM 220 O O . THR A 1 30 ? -3.183 4.035 -2.822 1.00 0.00 ? 30 THR A O 1 ATOM 221 C CB . THR A 1 30 ? -0.421 6.144 -2.147 1.00 0.00 ? 30 THR A CB 1 ATOM 222 O OG1 . THR A 1 30 ? 0.374 5.155 -1.498 1.00 0.00 ? 30 THR A OG1 1 ATOM 223 C CG2 . THR A 1 30 ? -1.312 6.696 -1.032 1.00 0.00 ? 30 THR A CG2 1 ATOM 224 N N . CYS A 1 31 ? -1.246 3.334 -1.885 1.00 0.00 ? 31 CYS A N 1 ATOM 225 C CA . CYS A 1 31 ? -1.840 2.160 -1.269 1.00 0.00 ? 31 CYS A CA 1 ATOM 226 C C . CYS A 1 31 ? -1.061 1.841 0.009 1.00 0.00 ? 31 CYS A C 1 ATOM 227 O O . CYS A 1 31 ? 0.101 2.219 0.141 1.00 0.00 ? 31 CYS A O 1 ATOM 228 C CB . CYS A 1 31 ? -1.869 0.971 -2.230 1.00 0.00 ? 31 CYS A CB 1 ATOM 229 S SG . CYS A 1 31 ? -3.485 0.669 -3.032 1.00 0.00 ? 31 CYS A SG 1 ATOM 230 N N . ASN A 1 32 ? -1.736 1.151 0.917 1.00 0.00 ? 32 ASN A N 1 ATOM 231 C CA . ASN A 1 32 ? -1.121 0.779 2.181 1.00 0.00 ? 32 ASN A CA 1 ATOM 232 C C . ASN A 1 32 ? -1.258 -0.732 2.384 1.00 0.00 ? 32 ASN A C 1 ATOM 233 O O . ASN A 1 32 ? -2.330 -1.295 2.171 1.00 0.00 ? 32 ASN A O 1 ATOM 234 C CB . ASN A 1 32 ? -1.809 1.478 3.354 1.00 0.00 ? 32 ASN A CB 1 ATOM 235 C CG . ASN A 1 32 ? -3.313 1.200 3.353 1.00 0.00 ? 32 ASN A CG 1 ATOM 236 O OD1 . ASN A 1 32 ? -3.851 0.559 2.465 1.00 0.00 ? 32 ASN A OD1 1 ATOM 237 N ND2 . ASN A 1 32 ? -3.961 1.718 4.393 1.00 0.00 ? 32 ASN A ND2 1 ATOM 238 N N . CYS A 1 33 ? -0.156 -1.343 2.791 1.00 0.00 ? 33 CYS A N 1 ATOM 239 C CA . CYS A 1 33 ? -0.139 -2.778 3.025 1.00 0.00 ? 33 CYS A CA 1 ATOM 240 C C . CYS A 1 33 ? 0.014 -3.017 4.529 1.00 0.00 ? 33 CYS A C 1 ATOM 241 O O . CYS A 1 33 ? -0.520 -2.261 5.339 1.00 0.00 ? 33 CYS A O 1 ATOM 242 C CB . CYS A 1 33 ? 0.965 -3.468 2.221 1.00 0.00 ? 33 CYS A CB 1 ATOM 243 S SG . CYS A 1 33 ? 0.459 -5.026 1.406 1.00 0.00 ? 33 CYS A SG 1 ATOM 244 N N . VAL A 1 34 ? 0.744 -4.073 4.855 1.00 0.00 ? 34 VAL A N 1 ATOM 245 C CA . VAL A 1 34 ? 0.975 -4.422 6.247 1.00 0.00 ? 34 VAL A CA 1 ATOM 246 C C . VAL A 1 34 ? 2.396 -4.966 6.404 1.00 0.00 ? 34 VAL A C 1 ATOM 247 O O . VAL A 1 34 ? 3.134 -5.075 5.426 1.00 0.00 ? 34 VAL A O 1 ATOM 248 C CB . VAL A 1 34 ? -0.098 -5.403 6.724 1.00 0.00 ? 34 VAL A CB 1 ATOM 249 C CG1 . VAL A 1 34 ? -1.502 -4.853 6.461 1.00 0.00 ? 34 VAL A CG1 1 ATOM 250 C CG2 . VAL A 1 34 ? 0.085 -6.775 6.070 1.00 0.00 ? 34 VAL A CG2 1 ATOM 251 N N . ILE A 1 35 ? 2.737 -5.293 7.641 1.00 0.00 ? 35 ILE A N 1 ATOM 252 C CA . ILE A 1 35 ? 4.055 -5.825 7.939 1.00 0.00 ? 35 ILE A CA 1 ATOM 253 C C . ILE A 1 35 ? 4.492 -6.758 6.808 1.00 0.00 ? 35 ILE A C 1 ATOM 254 O O . ILE A 1 35 ? 3.726 -7.618 6.378 1.00 0.00 ? 35 ILE A O 1 ATOM 255 C CB . ILE A 1 35 ? 4.069 -6.483 9.320 1.00 0.00 ? 35 ILE A CB 1 ATOM 256 C CG1 . ILE A 1 35 ? 3.543 -5.525 10.390 1.00 0.00 ? 35 ILE A CG1 1 ATOM 257 C CG2 . ILE A 1 35 ? 5.463 -7.014 9.661 1.00 0.00 ? 35 ILE A CG2 1 ATOM 258 C CD1 . ILE A 1 35 ? 4.014 -5.947 11.784 1.00 0.00 ? 35 ILE A CD1 1 ATOM 259 N N . GLY A 1 36 ? 5.723 -6.556 6.360 1.00 0.00 ? 36 GLY A N 1 ATOM 260 C CA . GLY A 1 36 ? 6.272 -7.368 5.287 1.00 0.00 ? 36 GLY A CA 1 ATOM 261 C C . GLY A 1 36 ? 5.786 -6.873 3.922 1.00 0.00 ? 36 GLY A C 1 ATOM 262 O O . GLY A 1 36 ? 6.020 -7.522 2.904 1.00 0.00 ? 36 GLY A O 1 ATOM 263 N N . TYR A 1 37 ? 5.120 -5.728 3.946 1.00 0.00 ? 37 TYR A N 1 ATOM 264 C CA . TYR A 1 37 ? 4.602 -5.140 2.723 1.00 0.00 ? 37 TYR A CA 1 ATOM 265 C C . TYR A 1 37 ? 4.184 -3.685 2.948 1.00 0.00 ? 37 TYR A C 1 ATOM 266 O O . TYR A 1 37 ? 3.530 -3.370 3.941 1.00 0.00 ? 37 TYR A O 1 ATOM 267 C CB . TYR A 1 37 ? 3.364 -5.960 2.351 1.00 0.00 ? 37 TYR A CB 1 ATOM 268 C CG . TYR A 1 37 ? 3.649 -7.445 2.120 1.00 0.00 ? 37 TYR A CG 1 ATOM 269 C CD1 . TYR A 1 37 ? 4.062 -7.883 0.878 1.00 0.00 ? 37 TYR A CD1 1 ATOM 270 C CD2 . TYR A 1 37 ? 3.494 -8.348 3.152 1.00 0.00 ? 37 TYR A CD2 1 ATOM 271 C CE1 . TYR A 1 37 ? 4.330 -9.281 0.659 1.00 0.00 ? 37 TYR A CE1 1 ATOM 272 C CE2 . TYR A 1 37 ? 3.761 -9.745 2.935 1.00 0.00 ? 37 TYR A CE2 1 ATOM 273 C CZ . TYR A 1 37 ? 4.167 -10.142 1.699 1.00 0.00 ? 37 TYR A CZ 1 ATOM 274 O OH . TYR A 1 37 ? 4.421 -11.463 1.492 1.00 0.00 ? 37 TYR A OH 1 ATOM 275 N N . SER A 1 38 ? 4.582 -2.837 2.012 1.00 0.00 ? 38 SER A N 1 ATOM 276 C CA . SER A 1 38 ? 4.257 -1.423 2.096 1.00 0.00 ? 38 SER A CA 1 ATOM 277 C C . SER A 1 38 ? 4.840 -0.680 0.892 1.00 0.00 ? 38 SER A C 1 ATOM 278 O O . SER A 1 38 ? 5.228 -1.300 -0.098 1.00 0.00 ? 38 SER A O 1 ATOM 279 C CB . SER A 1 38 ? 4.782 -0.814 3.398 1.00 0.00 ? 38 SER A CB 1 ATOM 280 O OG . SER A 1 38 ? 5.849 0.101 3.168 1.00 0.00 ? 38 SER A OG 1 ATOM 281 N N . GLY A 1 39 ? 4.883 0.638 1.014 1.00 0.00 ? 39 GLY A N 1 ATOM 282 C CA . GLY A 1 39 ? 5.410 1.473 -0.052 1.00 0.00 ? 39 GLY A CA 1 ATOM 283 C C . GLY A 1 39 ? 4.280 2.166 -0.817 1.00 0.00 ? 39 GLY A C 1 ATOM 284 O O . GLY A 1 39 ? 3.371 2.731 -0.209 1.00 0.00 ? 39 GLY A O 1 ATOM 285 N N . ASP A 1 40 ? 4.372 2.102 -2.136 1.00 0.00 ? 40 ASP A N 1 ATOM 286 C CA . ASP A 1 40 ? 3.370 2.717 -2.990 1.00 0.00 ? 40 ASP A CA 1 ATOM 287 C C . ASP A 1 40 ? 2.087 1.885 -2.941 1.00 0.00 ? 40 ASP A C 1 ATOM 288 O O . ASP A 1 40 ? 1.028 2.344 -3.367 1.00 0.00 ? 40 ASP A O 1 ATOM 289 C CB . ASP A 1 40 ? 3.844 2.774 -4.444 1.00 0.00 ? 40 ASP A CB 1 ATOM 290 C CG . ASP A 1 40 ? 2.831 3.358 -5.429 1.00 0.00 ? 40 ASP A CG 1 ATOM 291 O OD1 . ASP A 1 40 ? 1.943 2.651 -5.927 1.00 0.00 ? 40 ASP A OD1 1 ATOM 292 O OD2 . ASP A 1 40 ? 2.983 4.613 -5.688 1.00 0.00 ? 40 ASP A OD2 1 ATOM 293 N N . ARG A 1 41 ? 2.225 0.674 -2.421 1.00 0.00 ? 41 ARG A N 1 ATOM 294 C CA . ARG A 1 41 ? 1.090 -0.226 -2.313 1.00 0.00 ? 41 ARG A CA 1 ATOM 295 C C . ARG A 1 41 ? 1.429 -1.401 -1.391 1.00 0.00 ? 41 ARG A C 1 ATOM 296 O O . ARG A 1 41 ? 1.172 -1.346 -0.191 1.00 0.00 ? 41 ARG A O 1 ATOM 297 C CB . ARG A 1 41 ? 0.681 -0.765 -3.685 1.00 0.00 ? 41 ARG A CB 1 ATOM 298 C CG . ARG A 1 41 ? 1.836 -0.654 -4.683 1.00 0.00 ? 41 ARG A CG 1 ATOM 299 C CD . ARG A 1 41 ? 1.436 -1.221 -6.048 1.00 0.00 ? 41 ARG A CD 1 ATOM 300 N NE . ARG A 1 41 ? 2.645 -1.625 -6.801 1.00 0.00 ? 41 ARG A NE 1 ATOM 301 C CZ . ARG A 1 41 ? 3.349 -0.797 -7.602 1.00 0.00 ? 41 ARG A CZ 1 ATOM 302 N NH1 . ARG A 1 41 ? 4.337 -0.030 -7.094 1.00 0.00 ? 41 ARG A NH1 1 ATOM 303 N NH2 . ARG A 1 41 ? 3.058 -0.750 -8.890 1.00 0.00 ? 41 ARG A NH2 1 ATOM 304 N N . CYS A 1 42 ? 2.002 -2.435 -1.991 1.00 0.00 ? 42 CYS A N 1 ATOM 305 C CA . CYS A 1 42 ? 2.380 -3.620 -1.239 1.00 0.00 ? 42 CYS A CA 1 ATOM 306 C C . CYS A 1 42 ? 3.613 -4.235 -1.902 1.00 0.00 ? 42 CYS A C 1 ATOM 307 O O . CYS A 1 42 ? 3.930 -5.401 -1.673 1.00 0.00 ? 42 CYS A O 1 ATOM 308 C CB . CYS A 1 42 ? 1.225 -4.619 -1.142 1.00 0.00 ? 42 CYS A CB 1 ATOM 309 S SG . CYS A 1 42 ? -0.160 -4.090 -0.071 1.00 0.00 ? 42 CYS A SG 1 ATOM 310 N N . GLN A 1 43 ? 4.278 -3.424 -2.711 1.00 0.00 ? 43 GLN A N 1 ATOM 311 C CA . GLN A 1 43 ? 5.471 -3.874 -3.410 1.00 0.00 ? 43 GLN A CA 1 ATOM 312 C C . GLN A 1 43 ? 6.595 -4.153 -2.411 1.00 0.00 ? 43 GLN A C 1 ATOM 313 O O . GLN A 1 43 ? 7.232 -5.204 -2.465 1.00 0.00 ? 43 GLN A O 1 ATOM 314 C CB . GLN A 1 43 ? 5.910 -2.853 -4.459 1.00 0.00 ? 43 GLN A CB 1 ATOM 315 C CG . GLN A 1 43 ? 6.938 -3.458 -5.418 1.00 0.00 ? 43 GLN A CG 1 ATOM 316 C CD . GLN A 1 43 ? 7.279 -2.483 -6.545 1.00 0.00 ? 43 GLN A CD 1 ATOM 317 O OE1 . GLN A 1 43 ? 6.555 -2.343 -7.519 1.00 0.00 ? 43 GLN A OE1 1 ATOM 318 N NE2 . GLN A 1 43 ? 8.415 -1.818 -6.362 1.00 0.00 ? 43 GLN A NE2 1 ATOM 319 N N . THR A 1 44 ? 6.806 -3.192 -1.524 1.00 0.00 ? 44 THR A N 1 ATOM 320 C CA . THR A 1 44 ? 7.844 -3.323 -0.514 1.00 0.00 ? 44 THR A CA 1 ATOM 321 C C . THR A 1 44 ? 7.504 -4.451 0.459 1.00 0.00 ? 44 THR A C 1 ATOM 322 O O . THR A 1 44 ? 7.197 -4.201 1.624 1.00 0.00 ? 44 THR A O 1 ATOM 323 C CB . THR A 1 44 ? 8.014 -1.962 0.168 1.00 0.00 ? 44 THR A CB 1 ATOM 324 O OG1 . THR A 1 44 ? 8.215 -1.056 -0.913 1.00 0.00 ? 44 THR A OG1 1 ATOM 325 C CG2 . THR A 1 44 ? 9.309 -1.871 0.978 1.00 0.00 ? 44 THR A CG2 1 ATOM 326 N N . ARG A 1 45 ? 7.569 -5.671 -0.052 1.00 0.00 ? 45 ARG A N 1 ATOM 327 C CA . ARG A 1 45 ? 7.272 -6.840 0.756 1.00 0.00 ? 45 ARG A CA 1 ATOM 328 C C . ARG A 1 45 ? 8.354 -7.039 1.821 1.00 0.00 ? 45 ARG A C 1 ATOM 329 O O . ARG A 1 45 ? 8.967 -8.104 1.896 1.00 0.00 ? 45 ARG A O 1 ATOM 330 C CB . ARG A 1 45 ? 7.177 -8.099 -0.106 1.00 0.00 ? 45 ARG A CB 1 ATOM 331 C CG . ARG A 1 45 ? 8.449 -8.297 -0.929 1.00 0.00 ? 45 ARG A CG 1 ATOM 332 C CD . ARG A 1 45 ? 8.431 -9.644 -1.655 1.00 0.00 ? 45 ARG A CD 1 ATOM 333 N NE . ARG A 1 45 ? 8.686 -10.739 -0.692 1.00 0.00 ? 45 ARG A NE 1 ATOM 334 C CZ . ARG A 1 45 ? 8.505 -12.048 -0.970 1.00 0.00 ? 45 ARG A CZ 1 ATOM 335 N NH1 . ARG A 1 45 ? 9.332 -12.646 -1.808 1.00 0.00 ? 45 ARG A NH1 1 ATOM 336 N NH2 . ARG A 1 45 ? 7.493 -12.736 -0.402 1.00 0.00 ? 45 ARG A NH2 1 ATOM 337 N N . ASP A 1 46 ? 8.556 -5.998 2.614 1.00 0.00 ? 46 ASP A N 1 ATOM 338 C CA . ASP A 1 46 ? 9.554 -6.047 3.670 1.00 0.00 ? 46 ASP A CA 1 ATOM 339 C C . ASP A 1 46 ? 8.920 -5.598 4.988 1.00 0.00 ? 46 ASP A C 1 ATOM 340 O O . ASP A 1 46 ? 7.740 -5.258 5.027 1.00 0.00 ? 46 ASP A O 1 ATOM 341 C CB . ASP A 1 46 ? 10.723 -5.107 3.365 1.00 0.00 ? 46 ASP A CB 1 ATOM 342 C CG . ASP A 1 46 ? 11.990 -5.364 4.184 1.00 0.00 ? 46 ASP A CG 1 ATOM 343 O OD1 . ASP A 1 46 ? 12.153 -4.830 5.290 1.00 0.00 ? 46 ASP A OD1 1 ATOM 344 O OD2 . ASP A 1 46 ? 12.842 -6.162 3.633 1.00 0.00 ? 46 ASP A OD2 1 ATOM 345 N N . LEU A 1 47 ? 9.732 -5.611 6.035 1.00 0.00 ? 47 LEU A N 1 ATOM 346 C CA . LEU A 1 47 ? 9.263 -5.210 7.349 1.00 0.00 ? 47 LEU A CA 1 ATOM 347 C C . LEU A 1 47 ? 9.315 -3.686 7.461 1.00 0.00 ? 47 LEU A C 1 ATOM 348 O O . LEU A 1 47 ? 8.590 -2.984 6.757 1.00 0.00 ? 47 LEU A O 1 ATOM 349 C CB . LEU A 1 47 ? 10.055 -5.933 8.442 1.00 0.00 ? 47 LEU A CB 1 ATOM 350 C CG . LEU A 1 47 ? 9.761 -7.426 8.609 1.00 0.00 ? 47 LEU A CG 1 ATOM 351 C CD1 . LEU A 1 47 ? 8.322 -7.651 9.076 1.00 0.00 ? 47 LEU A CD1 1 ATOM 352 C CD2 . LEU A 1 47 ? 10.072 -8.190 7.320 1.00 0.00 ? 47 LEU A CD2 1 ATOM 353 N N . ARG A 1 48 ? 10.176 -3.217 8.352 1.00 0.00 ? 48 ARG A N 1 ATOM 354 C CA . ARG A 1 48 ? 10.329 -1.788 8.564 1.00 0.00 ? 48 ARG A CA 1 ATOM 355 C C . ARG A 1 48 ? 9.100 -1.221 9.276 1.00 0.00 ? 48 ARG A C 1 ATOM 356 O O . ARG A 1 48 ? 8.156 -0.768 8.629 1.00 0.00 ? 48 ARG A O 1 ATOM 357 C CB . ARG A 1 48 ? 10.527 -1.051 7.237 1.00 0.00 ? 48 ARG A CB 1 ATOM 358 C CG . ARG A 1 48 ? 11.967 -0.560 7.090 1.00 0.00 ? 48 ARG A CG 1 ATOM 359 C CD . ARG A 1 48 ? 12.104 0.889 7.567 1.00 0.00 ? 48 ARG A CD 1 ATOM 360 N NE . ARG A 1 48 ? 13.528 1.291 7.562 1.00 0.00 ? 48 ARG A NE 1 ATOM 361 C CZ . ARG A 1 48 ? 14.114 1.984 6.563 1.00 0.00 ? 48 ARG A CZ 1 ATOM 362 N NH1 . ARG A 1 48 ? 14.084 3.334 6.555 1.00 0.00 ? 48 ARG A NH1 1 ATOM 363 N NH2 . ARG A 1 48 ? 14.716 1.322 5.593 1.00 0.00 ? 48 ARG A NH2 1 ATOM 364 N N . TRP A 1 49 ? 9.149 -1.265 10.599 1.00 0.00 ? 49 TRP A N 1 ATOM 365 C CA . TRP A 1 49 ? 8.052 -0.762 11.407 1.00 0.00 ? 49 TRP A CA 1 ATOM 366 C C . TRP A 1 49 ? 7.584 0.562 10.796 1.00 0.00 ? 49 TRP A C 1 ATOM 367 O O . TRP A 1 49 ? 8.196 1.605 11.023 1.00 0.00 ? 49 TRP A O 1 ATOM 368 C CB . TRP A 1 49 ? 8.465 -0.630 12.874 1.00 0.00 ? 49 TRP A CB 1 ATOM 369 C CG . TRP A 1 49 ? 7.631 -1.485 13.832 1.00 0.00 ? 49 TRP A CG 1 ATOM 370 C CD1 . TRP A 1 49 ? 6.296 -1.575 13.909 1.00 0.00 ? 49 TRP A CD1 1 ATOM 371 C CD2 . TRP A 1 49 ? 8.136 -2.369 14.855 1.00 0.00 ? 49 TRP A CD2 1 ATOM 372 N NE1 . TRP A 1 49 ? 5.904 -2.449 14.902 1.00 0.00 ? 49 TRP A NE1 1 ATOM 373 C CE2 . TRP A 1 49 ? 7.059 -2.949 15.495 1.00 0.00 ? 49 TRP A CE2 1 ATOM 374 C CE3 . TRP A 1 49 ? 9.458 -2.671 15.225 1.00 0.00 ? 49 TRP A CE3 1 ATOM 375 C CZ2 . TRP A 1 49 ? 7.194 -3.865 16.545 1.00 0.00 ? 49 TRP A CZ2 1 ATOM 376 C CZ3 . TRP A 1 49 ? 9.575 -3.588 16.277 1.00 0.00 ? 49 TRP A CZ3 1 ATOM 377 C CH2 . TRP A 1 49 ? 8.502 -4.180 16.933 1.00 0.00 ? 49 TRP A CH2 1 ATOM 378 N N . TRP A 1 50 ? 6.503 0.477 10.036 1.00 0.00 ? 50 TRP A N 1 ATOM 379 C CA . TRP A 1 50 ? 5.947 1.655 9.393 1.00 0.00 ? 50 TRP A CA 1 ATOM 380 C C . TRP A 1 50 ? 4.628 1.996 10.089 1.00 0.00 ? 50 TRP A C 1 ATOM 381 O O . TRP A 1 50 ? 3.563 1.924 9.480 1.00 0.00 ? 50 TRP A O 1 ATOM 382 C CB . TRP A 1 50 ? 5.787 1.432 7.887 1.00 0.00 ? 50 TRP A CB 1 ATOM 383 C CG . TRP A 1 50 ? 5.691 -0.040 7.481 1.00 0.00 ? 50 TRP A CG 1 ATOM 384 C CD1 . TRP A 1 50 ? 4.985 -1.013 8.071 1.00 0.00 ? 50 TRP A CD1 1 ATOM 385 C CD2 . TRP A 1 50 ? 6.356 -0.668 6.365 1.00 0.00 ? 50 TRP A CD2 1 ATOM 386 N NE1 . TRP A 1 50 ? 5.145 -2.219 7.421 1.00 0.00 ? 50 TRP A NE1 1 ATOM 387 C CE2 . TRP A 1 50 ? 6.004 -2.003 6.350 1.00 0.00 ? 50 TRP A CE2 1 ATOM 388 C CE3 . TRP A 1 50 ? 7.222 -0.128 5.400 1.00 0.00 ? 50 TRP A CE3 1 ATOM 389 C CZ2 . TRP A 1 50 ? 6.476 -2.909 5.392 1.00 0.00 ? 50 TRP A CZ2 1 ATOM 390 C CZ3 . TRP A 1 50 ? 7.684 -1.046 4.449 1.00 0.00 ? 50 TRP A CZ3 1 ATOM 391 C CH2 . TRP A 1 50 ? 7.340 -2.392 4.420 1.00 0.00 ? 50 TRP A CH2 1 ATOM 392 N N . GLU A 1 51 ? 4.743 2.362 11.358 1.00 0.00 ? 51 GLU A N 1 ATOM 393 C CA . GLU A 1 51 ? 3.575 2.714 12.146 1.00 0.00 ? 51 GLU A CA 1 ATOM 394 C C . GLU A 1 51 ? 3.993 3.460 13.413 1.00 0.00 ? 51 GLU A C 1 ATOM 395 O O . GLU A 1 51 ? 5.074 3.221 13.949 1.00 0.00 ? 51 GLU A O 1 ATOM 396 C CB . GLU A 1 51 ? 2.748 1.472 12.487 1.00 0.00 ? 51 GLU A CB 1 ATOM 397 C CG . GLU A 1 51 ? 3.650 0.322 12.937 1.00 0.00 ? 51 GLU A CG 1 ATOM 398 C CD . GLU A 1 51 ? 2.819 -0.887 13.369 1.00 0.00 ? 51 GLU A CD 1 ATOM 399 O OE1 . GLU A 1 51 ? 2.441 -0.993 14.546 1.00 0.00 ? 51 GLU A OE1 1 ATOM 400 O OE2 . GLU A 1 51 ? 2.567 -1.739 12.433 1.00 0.00 ? 51 GLU A OE2 1 ATOM 401 N N . LEU A 1 52 ? 3.117 4.350 13.855 1.00 0.00 ? 52 LEU A N 1 ATOM 402 C CA . LEU A 1 52 ? 3.382 5.133 15.050 1.00 0.00 ? 52 LEU A CA 1 ATOM 403 C C . LEU A 1 52 ? 2.213 4.980 16.026 1.00 0.00 ? 52 LEU A C 1 ATOM 404 O O . LEU A 1 52 ? 1.073 4.772 15.607 1.00 0.00 ? 52 LEU A O 1 ATOM 405 C CB . LEU A 1 52 ? 3.690 6.586 14.681 1.00 0.00 ? 52 LEU A CB 1 ATOM 406 C CG . LEU A 1 52 ? 2.560 7.357 13.997 1.00 0.00 ? 52 LEU A CG 1 ATOM 407 C CD1 . LEU A 1 52 ? 2.367 8.732 14.641 1.00 0.00 ? 52 LEU A CD1 1 ATOM 408 C CD2 . LEU A 1 52 ? 2.799 7.459 12.490 1.00 0.00 ? 52 LEU A CD2 1 ATOM 409 N N . ARG A 1 53 ? 2.534 5.088 17.306 1.00 0.00 ? 53 ARG A N 1 ATOM 410 C CA . ARG A 1 53 ? 1.523 4.965 18.344 1.00 0.00 ? 53 ARG A CA 1 ATOM 411 C C . ARG A 1 53 ? 0.848 3.593 18.266 1.00 0.00 ? 53 ARG A C 1 ATOM 412 O O . ARG A 1 53 ? -0.025 3.282 19.073 1.00 0.00 ? 53 ARG A O 1 ATOM 413 C CB . ARG A 1 53 ? 0.460 6.057 18.211 1.00 0.00 ? 53 ARG A CB 1 ATOM 414 C CG . ARG A 1 53 ? 0.360 6.883 19.494 1.00 0.00 ? 53 ARG A CG 1 ATOM 415 C CD . ARG A 1 53 ? -0.518 6.180 20.531 1.00 0.00 ? 53 ARG A CD 1 ATOM 416 N NE . ARG A 1 53 ? -0.716 7.058 21.706 1.00 0.00 ? 53 ARG A NE 1 ATOM 417 C CZ . ARG A 1 53 ? 0.008 6.976 22.843 1.00 0.00 ? 53 ARG A CZ 1 ATOM 418 N NH1 . ARG A 1 53 ? 1.173 7.650 22.962 1.00 0.00 ? 53 ARG A NH1 1 ATOM 419 N NH2 . ARG A 1 53 ? -0.438 6.230 23.835 1.00 0.00 ? 53 ARG A NH2 1 ATOM 420 O OXT . ARG A 1 53 ? 1.267 2.833 17.314 1.00 0.00 ? 53 ARG A OXT 1 ATOM 421 N N . ASN A 1 1 ? -2.425 13.261 4.571 1.00 0.00 ? 1 ASN A N 2 ATOM 422 C CA . ASN A 1 1 ? -3.463 13.390 3.561 1.00 0.00 ? 1 ASN A CA 2 ATOM 423 C C . ASN A 1 1 ? -3.619 12.058 2.823 1.00 0.00 ? 1 ASN A C 2 ATOM 424 O O . ASN A 1 1 ? -2.633 11.472 2.378 1.00 0.00 ? 1 ASN A O 2 ATOM 425 C CB . ASN A 1 1 ? -3.098 14.461 2.530 1.00 0.00 ? 1 ASN A CB 2 ATOM 426 C CG . ASN A 1 1 ? -3.095 15.853 3.163 1.00 0.00 ? 1 ASN A CG 2 ATOM 427 O OD1 . ASN A 1 1 ? -2.134 16.282 3.781 1.00 0.00 ? 1 ASN A OD1 2 ATOM 428 N ND2 . ASN A 1 1 ? -4.224 16.534 2.977 1.00 0.00 ? 1 ASN A ND2 2 ATOM 429 N N . SER A 1 2 ? -4.865 11.620 2.718 1.00 0.00 ? 2 SER A N 2 ATOM 430 C CA . SER A 1 2 ? -5.161 10.367 2.042 1.00 0.00 ? 2 SER A CA 2 ATOM 431 C C . SER A 1 2 ? -6.650 10.304 1.690 1.00 0.00 ? 2 SER A C 2 ATOM 432 O O . SER A 1 2 ? -7.492 10.788 2.445 1.00 0.00 ? 2 SER A O 2 ATOM 433 C CB . SER A 1 2 ? -4.769 9.169 2.907 1.00 0.00 ? 2 SER A CB 2 ATOM 434 O OG . SER A 1 2 ? -3.372 9.143 3.182 1.00 0.00 ? 2 SER A OG 2 ATOM 435 N N . TYR A 1 3 ? -6.928 9.704 0.542 1.00 0.00 ? 3 TYR A N 2 ATOM 436 C CA . TYR A 1 3 ? -8.299 9.570 0.080 1.00 0.00 ? 3 TYR A CA 2 ATOM 437 C C . TYR A 1 3 ? -8.512 8.232 -0.628 1.00 0.00 ? 3 TYR A C 2 ATOM 438 O O . TYR A 1 3 ? -7.703 7.830 -1.461 1.00 0.00 ? 3 TYR A O 2 ATOM 439 C CB . TYR A 1 3 ? -8.518 10.704 -0.924 1.00 0.00 ? 3 TYR A CB 2 ATOM 440 C CG . TYR A 1 3 ? -8.160 12.090 -0.384 1.00 0.00 ? 3 TYR A CG 2 ATOM 441 C CD1 . TYR A 1 3 ? -6.849 12.395 -0.078 1.00 0.00 ? 3 TYR A CD1 2 ATOM 442 C CD2 . TYR A 1 3 ? -9.148 13.037 -0.204 1.00 0.00 ? 3 TYR A CD2 2 ATOM 443 C CE1 . TYR A 1 3 ? -6.512 13.699 0.430 1.00 0.00 ? 3 TYR A CE1 2 ATOM 444 C CE2 . TYR A 1 3 ? -8.811 14.341 0.303 1.00 0.00 ? 3 TYR A CE2 2 ATOM 445 C CZ . TYR A 1 3 ? -7.509 14.608 0.595 1.00 0.00 ? 3 TYR A CZ 2 ATOM 446 O OH . TYR A 1 3 ? -7.191 15.841 1.075 1.00 0.00 ? 3 TYR A OH 2 ATOM 447 N N . PRO A 1 4 ? -9.636 7.558 -0.259 1.00 0.00 ? 4 PRO A N 2 ATOM 448 C CA . PRO A 1 4 ? -9.965 6.272 -0.850 1.00 0.00 ? 4 PRO A CA 2 ATOM 449 C C . PRO A 1 4 ? -10.493 6.443 -2.275 1.00 0.00 ? 4 PRO A C 2 ATOM 450 O O . PRO A 1 4 ? -11.686 6.661 -2.477 1.00 0.00 ? 4 PRO A O 2 ATOM 451 C CB . PRO A 1 4 ? -10.986 5.658 0.092 1.00 0.00 ? 4 PRO A CB 2 ATOM 452 C CG . PRO A 1 4 ? -11.537 6.809 0.920 1.00 0.00 ? 4 PRO A CG 2 ATOM 453 C CD . PRO A 1 4 ? -10.617 8.003 0.725 1.00 0.00 ? 4 PRO A CD 2 ATOM 454 N N . GLY A 1 5 ? -9.578 6.336 -3.228 1.00 0.00 ? 5 GLY A N 2 ATOM 455 C CA . GLY A 1 5 ? -9.936 6.475 -4.629 1.00 0.00 ? 5 GLY A CA 2 ATOM 456 C C . GLY A 1 5 ? -9.011 5.639 -5.516 1.00 0.00 ? 5 GLY A C 2 ATOM 457 O O . GLY A 1 5 ? -7.821 5.512 -5.233 1.00 0.00 ? 5 GLY A O 2 ATOM 458 N N . CYS A 1 6 ? -9.594 5.092 -6.573 1.00 0.00 ? 6 CYS A N 2 ATOM 459 C CA . CYS A 1 6 ? -8.837 4.274 -7.506 1.00 0.00 ? 6 CYS A CA 2 ATOM 460 C C . CYS A 1 6 ? -9.701 4.033 -8.745 1.00 0.00 ? 6 CYS A C 2 ATOM 461 O O . CYS A 1 6 ? -10.516 3.112 -8.768 1.00 0.00 ? 6 CYS A O 2 ATOM 462 C CB . CYS A 1 6 ? -8.382 2.961 -6.863 1.00 0.00 ? 6 CYS A CB 2 ATOM 463 S SG . CYS A 1 6 ? -6.605 2.893 -6.435 1.00 0.00 ? 6 CYS A SG 2 ATOM 464 N N . PRO A 1 7 ? -9.488 4.900 -9.770 1.00 0.00 ? 7 PRO A N 2 ATOM 465 C CA . PRO A 1 7 ? -10.238 4.791 -11.010 1.00 0.00 ? 7 PRO A CA 2 ATOM 466 C C . PRO A 1 7 ? -9.736 3.616 -11.854 1.00 0.00 ? 7 PRO A C 2 ATOM 467 O O . PRO A 1 7 ? -8.848 2.879 -11.430 1.00 0.00 ? 7 PRO A O 2 ATOM 468 C CB . PRO A 1 7 ? -10.058 6.135 -11.698 1.00 0.00 ? 7 PRO A CB 2 ATOM 469 C CG . PRO A 1 7 ? -8.843 6.777 -11.048 1.00 0.00 ? 7 PRO A CG 2 ATOM 470 C CD . PRO A 1 7 ? -8.532 6.002 -9.778 1.00 0.00 ? 7 PRO A CD 2 ATOM 471 N N . SER A 1 8 ? -10.328 3.480 -13.031 1.00 0.00 ? 8 SER A N 2 ATOM 472 C CA . SER A 1 8 ? -9.954 2.407 -13.936 1.00 0.00 ? 8 SER A CA 2 ATOM 473 C C . SER A 1 8 ? -8.443 2.436 -14.185 1.00 0.00 ? 8 SER A C 2 ATOM 474 O O . SER A 1 8 ? -7.859 1.436 -14.600 1.00 0.00 ? 8 SER A O 2 ATOM 475 C CB . SER A 1 8 ? -10.711 2.512 -15.261 1.00 0.00 ? 8 SER A CB 2 ATOM 476 O OG . SER A 1 8 ? -10.434 3.735 -15.938 1.00 0.00 ? 8 SER A OG 2 ATOM 477 N N . SER A 1 9 ? -7.855 3.594 -13.922 1.00 0.00 ? 9 SER A N 2 ATOM 478 C CA . SER A 1 9 ? -6.425 3.767 -14.112 1.00 0.00 ? 9 SER A CA 2 ATOM 479 C C . SER A 1 9 ? -5.668 2.588 -13.497 1.00 0.00 ? 9 SER A C 2 ATOM 480 O O . SER A 1 9 ? -5.094 1.771 -14.215 1.00 0.00 ? 9 SER A O 2 ATOM 481 C CB . SER A 1 9 ? -5.944 5.083 -13.501 1.00 0.00 ? 9 SER A CB 2 ATOM 482 O OG . SER A 1 9 ? -6.596 6.211 -14.080 1.00 0.00 ? 9 SER A OG 2 ATOM 483 N N . TYR A 1 10 ? -5.693 2.537 -12.173 1.00 0.00 ? 10 TYR A N 2 ATOM 484 C CA . TYR A 1 10 ? -5.017 1.473 -11.453 1.00 0.00 ? 10 TYR A CA 2 ATOM 485 C C . TYR A 1 10 ? -6.018 0.443 -10.926 1.00 0.00 ? 10 TYR A C 2 ATOM 486 O O . TYR A 1 10 ? -5.936 -0.738 -11.264 1.00 0.00 ? 10 TYR A O 2 ATOM 487 C CB . TYR A 1 10 ? -4.320 2.142 -10.265 1.00 0.00 ? 10 TYR A CB 2 ATOM 488 C CG . TYR A 1 10 ? -4.010 3.624 -10.480 1.00 0.00 ? 10 TYR A CG 2 ATOM 489 C CD1 . TYR A 1 10 ? -2.844 4.000 -11.114 1.00 0.00 ? 10 TYR A CD1 2 ATOM 490 C CD2 . TYR A 1 10 ? -4.898 4.585 -10.041 1.00 0.00 ? 10 TYR A CD2 2 ATOM 491 C CE1 . TYR A 1 10 ? -2.553 5.395 -11.317 1.00 0.00 ? 10 TYR A CE1 2 ATOM 492 C CE2 . TYR A 1 10 ? -4.607 5.981 -10.243 1.00 0.00 ? 10 TYR A CE2 2 ATOM 493 C CZ . TYR A 1 10 ? -3.449 6.317 -10.871 1.00 0.00 ? 10 TYR A CZ 2 ATOM 494 O OH . TYR A 1 10 ? -3.173 7.636 -11.064 1.00 0.00 ? 10 TYR A OH 2 ATOM 495 N N . ASP A 1 11 ? -6.943 0.927 -10.110 1.00 0.00 ? 11 ASP A N 2 ATOM 496 C CA . ASP A 1 11 ? -7.960 0.064 -9.534 1.00 0.00 ? 11 ASP A CA 2 ATOM 497 C C . ASP A 1 11 ? -7.284 -1.055 -8.741 1.00 0.00 ? 11 ASP A C 2 ATOM 498 O O . ASP A 1 11 ? -7.145 -2.173 -9.233 1.00 0.00 ? 11 ASP A O 2 ATOM 499 C CB . ASP A 1 11 ? -8.817 -0.582 -10.627 1.00 0.00 ? 11 ASP A CB 2 ATOM 500 C CG . ASP A 1 11 ? -10.013 -1.387 -10.117 1.00 0.00 ? 11 ASP A CG 2 ATOM 501 O OD1 . ASP A 1 11 ? -9.712 -2.409 -9.390 1.00 0.00 ? 11 ASP A OD1 2 ATOM 502 O OD2 . ASP A 1 11 ? -11.173 -1.056 -10.401 1.00 0.00 ? 11 ASP A OD2 2 ATOM 503 N N . GLY A 1 12 ? -6.879 -0.716 -7.525 1.00 0.00 ? 12 GLY A N 2 ATOM 504 C CA . GLY A 1 12 ? -6.221 -1.678 -6.659 1.00 0.00 ? 12 GLY A CA 2 ATOM 505 C C . GLY A 1 12 ? -4.727 -1.373 -6.536 1.00 0.00 ? 12 GLY A C 2 ATOM 506 O O . GLY A 1 12 ? -3.901 -2.284 -6.536 1.00 0.00 ? 12 GLY A O 2 ATOM 507 N N . TYR A 1 13 ? -4.425 -0.087 -6.435 1.00 0.00 ? 13 TYR A N 2 ATOM 508 C CA . TYR A 1 13 ? -3.045 0.350 -6.311 1.00 0.00 ? 13 TYR A CA 2 ATOM 509 C C . TYR A 1 13 ? -2.262 -0.563 -5.366 1.00 0.00 ? 13 TYR A C 2 ATOM 510 O O . TYR A 1 13 ? -1.045 -0.688 -5.483 1.00 0.00 ? 13 TYR A O 2 ATOM 511 C CB . TYR A 1 13 ? -3.100 1.757 -5.712 1.00 0.00 ? 13 TYR A CB 2 ATOM 512 C CG . TYR A 1 13 ? -2.120 2.744 -6.350 1.00 0.00 ? 13 TYR A CG 2 ATOM 513 C CD1 . TYR A 1 13 ? -2.172 2.987 -7.710 1.00 0.00 ? 13 TYR A CD1 2 ATOM 514 C CD2 . TYR A 1 13 ? -1.185 3.392 -5.570 1.00 0.00 ? 13 TYR A CD2 2 ATOM 515 C CE1 . TYR A 1 13 ? -1.250 3.916 -8.310 1.00 0.00 ? 13 TYR A CE1 2 ATOM 516 C CE2 . TYR A 1 13 ? -0.265 4.321 -6.171 1.00 0.00 ? 13 TYR A CE2 2 ATOM 517 C CZ . TYR A 1 13 ? -0.342 4.538 -7.513 1.00 0.00 ? 13 TYR A CZ 2 ATOM 518 O OH . TYR A 1 13 ? 0.528 5.414 -8.080 1.00 0.00 ? 13 TYR A OH 2 ATOM 519 N N . CYS A 1 14 ? -2.995 -1.177 -4.449 1.00 0.00 ? 14 CYS A N 2 ATOM 520 C CA . CYS A 1 14 ? -2.386 -2.075 -3.482 1.00 0.00 ? 14 CYS A CA 2 ATOM 521 C C . CYS A 1 14 ? -2.825 -3.505 -3.810 1.00 0.00 ? 14 CYS A C 2 ATOM 522 O O . CYS A 1 14 ? -3.859 -3.709 -4.445 1.00 0.00 ? 14 CYS A O 2 ATOM 523 C CB . CYS A 1 14 ? -2.738 -1.686 -2.045 1.00 0.00 ? 14 CYS A CB 2 ATOM 524 S SG . CYS A 1 14 ? -2.385 0.058 -1.615 1.00 0.00 ? 14 CYS A SG 2 ATOM 525 N N . LEU A 1 15 ? -2.019 -4.455 -3.362 1.00 0.00 ? 15 LEU A N 2 ATOM 526 C CA . LEU A 1 15 ? -2.313 -5.859 -3.599 1.00 0.00 ? 15 LEU A CA 2 ATOM 527 C C . LEU A 1 15 ? -1.862 -6.681 -2.391 1.00 0.00 ? 15 LEU A C 2 ATOM 528 O O . LEU A 1 15 ? -0.792 -6.439 -1.836 1.00 0.00 ? 15 LEU A O 2 ATOM 529 C CB . LEU A 1 15 ? -1.697 -6.320 -4.921 1.00 0.00 ? 15 LEU A CB 2 ATOM 530 C CG . LEU A 1 15 ? -0.991 -5.239 -5.744 1.00 0.00 ? 15 LEU A CG 2 ATOM 531 C CD1 . LEU A 1 15 ? 0.424 -4.987 -5.221 1.00 0.00 ? 15 LEU A CD1 2 ATOM 532 C CD2 . LEU A 1 15 ? -0.999 -5.592 -7.233 1.00 0.00 ? 15 LEU A CD2 2 ATOM 533 N N . ASN A 1 16 ? -2.700 -7.636 -2.020 1.00 0.00 ? 16 ASN A N 2 ATOM 534 C CA . ASN A 1 16 ? -2.401 -8.497 -0.886 1.00 0.00 ? 16 ASN A CA 2 ATOM 535 C C . ASN A 1 16 ? -1.389 -7.799 0.025 1.00 0.00 ? 16 ASN A C 2 ATOM 536 O O . ASN A 1 16 ? -0.322 -8.344 0.304 1.00 0.00 ? 16 ASN A O 2 ATOM 537 C CB . ASN A 1 16 ? -1.789 -9.821 -1.348 1.00 0.00 ? 16 ASN A CB 2 ATOM 538 C CG . ASN A 1 16 ? -1.865 -9.960 -2.869 1.00 0.00 ? 16 ASN A CG 2 ATOM 539 O OD1 . ASN A 1 16 ? -2.924 -9.899 -3.473 1.00 0.00 ? 16 ASN A OD1 2 ATOM 540 N ND2 . ASN A 1 16 ? -0.686 -10.150 -3.455 1.00 0.00 ? 16 ASN A ND2 2 ATOM 541 N N . GLY A 1 17 ? -1.759 -6.606 0.462 1.00 0.00 ? 17 GLY A N 2 ATOM 542 C CA . GLY A 1 17 ? -0.898 -5.827 1.337 1.00 0.00 ? 17 GLY A CA 2 ATOM 543 C C . GLY A 1 17 ? -1.702 -4.778 2.107 1.00 0.00 ? 17 GLY A C 2 ATOM 544 O O . GLY A 1 17 ? -2.184 -5.044 3.205 1.00 0.00 ? 17 GLY A O 2 ATOM 545 N N . GLY A 1 18 ? -1.819 -3.606 1.498 1.00 0.00 ? 18 GLY A N 2 ATOM 546 C CA . GLY A 1 18 ? -2.556 -2.514 2.113 1.00 0.00 ? 18 GLY A CA 2 ATOM 547 C C . GLY A 1 18 ? -3.801 -2.165 1.296 1.00 0.00 ? 18 GLY A C 2 ATOM 548 O O . GLY A 1 18 ? -4.302 -2.992 0.534 1.00 0.00 ? 18 GLY A O 2 ATOM 549 N N . VAL A 1 19 ? -4.267 -0.939 1.481 1.00 0.00 ? 19 VAL A N 2 ATOM 550 C CA . VAL A 1 19 ? -5.445 -0.469 0.773 1.00 0.00 ? 19 VAL A CA 2 ATOM 551 C C . VAL A 1 19 ? -5.054 0.694 -0.143 1.00 0.00 ? 19 VAL A C 2 ATOM 552 O O . VAL A 1 19 ? -4.068 1.383 0.111 1.00 0.00 ? 19 VAL A O 2 ATOM 553 C CB . VAL A 1 19 ? -6.546 -0.101 1.770 1.00 0.00 ? 19 VAL A CB 2 ATOM 554 C CG1 . VAL A 1 19 ? -7.873 0.146 1.052 1.00 0.00 ? 19 VAL A CG1 2 ATOM 555 C CG2 . VAL A 1 19 ? -6.696 -1.181 2.842 1.00 0.00 ? 19 VAL A CG2 2 ATOM 556 N N . CYS A 1 20 ? -5.849 0.874 -1.189 1.00 0.00 ? 20 CYS A N 2 ATOM 557 C CA . CYS A 1 20 ? -5.597 1.941 -2.142 1.00 0.00 ? 20 CYS A CA 2 ATOM 558 C C . CYS A 1 20 ? -5.925 3.276 -1.467 1.00 0.00 ? 20 CYS A C 2 ATOM 559 O O . CYS A 1 20 ? -6.931 3.391 -0.768 1.00 0.00 ? 20 CYS A O 2 ATOM 560 C CB . CYS A 1 20 ? -6.392 1.745 -3.433 1.00 0.00 ? 20 CYS A CB 2 ATOM 561 S SG . CYS A 1 20 ? -6.434 3.202 -4.540 1.00 0.00 ? 20 CYS A SG 2 ATOM 562 N N . MET A 1 21 ? -5.058 4.249 -1.700 1.00 0.00 ? 21 MET A N 2 ATOM 563 C CA . MET A 1 21 ? -5.244 5.571 -1.124 1.00 0.00 ? 21 MET A CA 2 ATOM 564 C C . MET A 1 21 ? -4.724 6.658 -2.067 1.00 0.00 ? 21 MET A C 2 ATOM 565 O O . MET A 1 21 ? -3.525 6.729 -2.336 1.00 0.00 ? 21 MET A O 2 ATOM 566 C CB . MET A 1 21 ? -4.503 5.654 0.211 1.00 0.00 ? 21 MET A CB 2 ATOM 567 C CG . MET A 1 21 ? -5.481 5.860 1.369 1.00 0.00 ? 21 MET A CG 2 ATOM 568 S SD . MET A 1 21 ? -4.615 5.753 2.926 1.00 0.00 ? 21 MET A SD 2 ATOM 569 C CE . MET A 1 21 ? -3.123 6.640 2.513 1.00 0.00 ? 21 MET A CE 2 ATOM 570 N N . HIS A 1 22 ? -5.649 7.477 -2.544 1.00 0.00 ? 22 HIS A N 2 ATOM 571 C CA . HIS A 1 22 ? -5.298 8.557 -3.450 1.00 0.00 ? 22 HIS A CA 2 ATOM 572 C C . HIS A 1 22 ? -5.025 9.830 -2.649 1.00 0.00 ? 22 HIS A C 2 ATOM 573 O O . HIS A 1 22 ? -5.790 10.178 -1.749 1.00 0.00 ? 22 HIS A O 2 ATOM 574 C CB . HIS A 1 22 ? -6.381 8.746 -4.514 1.00 0.00 ? 22 HIS A CB 2 ATOM 575 C CG . HIS A 1 22 ? -6.123 9.899 -5.454 1.00 0.00 ? 22 HIS A CG 2 ATOM 576 N ND1 . HIS A 1 22 ? -7.027 10.933 -5.639 1.00 0.00 ? 22 HIS A ND1 2 ATOM 577 C CD2 . HIS A 1 22 ? -5.055 10.172 -6.258 1.00 0.00 ? 22 HIS A CD2 2 ATOM 578 C CE1 . HIS A 1 22 ? -6.515 11.782 -6.519 1.00 0.00 ? 22 HIS A CE1 2 ATOM 579 N NE2 . HIS A 1 22 ? -5.293 11.309 -6.901 1.00 0.00 ? 22 HIS A NE2 2 ATOM 580 N N . ILE A 1 23 ? -3.933 10.491 -3.002 1.00 0.00 ? 23 ILE A N 2 ATOM 581 C CA . ILE A 1 23 ? -3.549 11.720 -2.328 1.00 0.00 ? 23 ILE A CA 2 ATOM 582 C C . ILE A 1 23 ? -4.204 12.910 -3.032 1.00 0.00 ? 23 ILE A C 2 ATOM 583 O O . ILE A 1 23 ? -4.661 12.789 -4.168 1.00 0.00 ? 23 ILE A O 2 ATOM 584 C CB . ILE A 1 23 ? -2.025 11.825 -2.232 1.00 0.00 ? 23 ILE A CB 2 ATOM 585 C CG1 . ILE A 1 23 ? -1.362 10.483 -2.547 1.00 0.00 ? 23 ILE A CG1 2 ATOM 586 C CG2 . ILE A 1 23 ? -1.599 12.369 -0.867 1.00 0.00 ? 23 ILE A CG2 2 ATOM 587 C CD1 . ILE A 1 23 ? 0.084 10.457 -2.050 1.00 0.00 ? 23 ILE A CD1 2 ATOM 588 N N . GLU A 1 24 ? -4.230 14.033 -2.329 1.00 0.00 ? 24 GLU A N 2 ATOM 589 C CA . GLU A 1 24 ? -4.822 15.243 -2.872 1.00 0.00 ? 24 GLU A CA 2 ATOM 590 C C . GLU A 1 24 ? -3.806 16.387 -2.850 1.00 0.00 ? 24 GLU A C 2 ATOM 591 O O . GLU A 1 24 ? -4.090 17.485 -3.327 1.00 0.00 ? 24 GLU A O 2 ATOM 592 C CB . GLU A 1 24 ? -6.092 15.623 -2.107 1.00 0.00 ? 24 GLU A CB 2 ATOM 593 C CG . GLU A 1 24 ? -7.308 14.878 -2.661 1.00 0.00 ? 24 GLU A CG 2 ATOM 594 C CD . GLU A 1 24 ? -7.919 15.630 -3.848 1.00 0.00 ? 24 GLU A CD 2 ATOM 595 O OE1 . GLU A 1 24 ? -8.821 16.498 -3.534 1.00 0.00 ? 24 GLU A OE1 2 ATOM 596 O OE2 . GLU A 1 24 ? -7.539 15.382 -5.001 1.00 0.00 ? 24 GLU A OE2 2 ATOM 597 N N . SER A 1 25 ? -2.642 16.091 -2.290 1.00 0.00 ? 25 SER A N 2 ATOM 598 C CA . SER A 1 25 ? -1.581 17.080 -2.201 1.00 0.00 ? 25 SER A CA 2 ATOM 599 C C . SER A 1 25 ? -1.121 17.484 -3.602 1.00 0.00 ? 25 SER A C 2 ATOM 600 O O . SER A 1 25 ? -0.648 18.602 -3.804 1.00 0.00 ? 25 SER A O 2 ATOM 601 C CB . SER A 1 25 ? -0.399 16.548 -1.385 1.00 0.00 ? 25 SER A CB 2 ATOM 602 O OG . SER A 1 25 ? 0.168 15.379 -1.970 1.00 0.00 ? 25 SER A OG 2 ATOM 603 N N . LEU A 1 26 ? -1.277 16.556 -4.532 1.00 0.00 ? 26 LEU A N 2 ATOM 604 C CA . LEU A 1 26 ? -0.885 16.801 -5.908 1.00 0.00 ? 26 LEU A CA 2 ATOM 605 C C . LEU A 1 26 ? -1.708 15.906 -6.838 1.00 0.00 ? 26 LEU A C 2 ATOM 606 O O . LEU A 1 26 ? -1.295 15.625 -7.962 1.00 0.00 ? 26 LEU A O 2 ATOM 607 C CB . LEU A 1 26 ? 0.627 16.632 -6.073 1.00 0.00 ? 26 LEU A CB 2 ATOM 608 C CG . LEU A 1 26 ? 1.403 17.888 -6.474 1.00 0.00 ? 26 LEU A CG 2 ATOM 609 C CD1 . LEU A 1 26 ? 2.911 17.652 -6.388 1.00 0.00 ? 26 LEU A CD1 2 ATOM 610 C CD2 . LEU A 1 26 ? 0.978 18.376 -7.861 1.00 0.00 ? 26 LEU A CD2 2 ATOM 611 N N . ASP A 1 27 ? -2.859 15.484 -6.335 1.00 0.00 ? 27 ASP A N 2 ATOM 612 C CA . ASP A 1 27 ? -3.743 14.626 -7.102 1.00 0.00 ? 27 ASP A CA 2 ATOM 613 C C . ASP A 1 27 ? -3.017 13.323 -7.440 1.00 0.00 ? 27 ASP A C 2 ATOM 614 O O . ASP A 1 27 ? -3.299 12.696 -8.461 1.00 0.00 ? 27 ASP A O 2 ATOM 615 C CB . ASP A 1 27 ? -4.150 15.294 -8.419 1.00 0.00 ? 27 ASP A CB 2 ATOM 616 C CG . ASP A 1 27 ? -5.651 15.282 -8.713 1.00 0.00 ? 27 ASP A CG 2 ATOM 617 O OD1 . ASP A 1 27 ? -6.422 16.064 -8.136 1.00 0.00 ? 27 ASP A OD1 2 ATOM 618 O OD2 . ASP A 1 27 ? -6.029 14.412 -9.587 1.00 0.00 ? 27 ASP A OD2 2 ATOM 619 N N . SER A 1 28 ? -2.096 12.951 -6.563 1.00 0.00 ? 28 SER A N 2 ATOM 620 C CA . SER A 1 28 ? -1.328 11.733 -6.754 1.00 0.00 ? 28 SER A CA 2 ATOM 621 C C . SER A 1 28 ? -2.009 10.567 -6.037 1.00 0.00 ? 28 SER A C 2 ATOM 622 O O . SER A 1 28 ? -2.831 10.775 -5.146 1.00 0.00 ? 28 SER A O 2 ATOM 623 C CB . SER A 1 28 ? 0.106 11.902 -6.249 1.00 0.00 ? 28 SER A CB 2 ATOM 624 O OG . SER A 1 28 ? 0.843 10.684 -6.313 1.00 0.00 ? 28 SER A OG 2 ATOM 625 N N . TYR A 1 29 ? -1.642 9.364 -6.451 1.00 0.00 ? 29 TYR A N 2 ATOM 626 C CA . TYR A 1 29 ? -2.207 8.163 -5.860 1.00 0.00 ? 29 TYR A CA 2 ATOM 627 C C . TYR A 1 29 ? -1.160 7.411 -5.036 1.00 0.00 ? 29 TYR A C 2 ATOM 628 O O . TYR A 1 29 ? -0.009 7.289 -5.452 1.00 0.00 ? 29 TYR A O 2 ATOM 629 C CB . TYR A 1 29 ? -2.646 7.282 -7.031 1.00 0.00 ? 29 TYR A CB 2 ATOM 630 C CG . TYR A 1 29 ? -4.020 7.642 -7.600 1.00 0.00 ? 29 TYR A CG 2 ATOM 631 C CD1 . TYR A 1 29 ? -4.137 8.656 -8.530 1.00 0.00 ? 29 TYR A CD1 2 ATOM 632 C CD2 . TYR A 1 29 ? -5.141 6.952 -7.186 1.00 0.00 ? 29 TYR A CD2 2 ATOM 633 C CE1 . TYR A 1 29 ? -5.430 8.996 -9.065 1.00 0.00 ? 29 TYR A CE1 2 ATOM 634 C CE2 . TYR A 1 29 ? -6.434 7.293 -7.722 1.00 0.00 ? 29 TYR A CE2 2 ATOM 635 C CZ . TYR A 1 29 ? -6.514 8.296 -8.636 1.00 0.00 ? 29 TYR A CZ 2 ATOM 636 O OH . TYR A 1 29 ? -7.736 8.617 -9.141 1.00 0.00 ? 29 TYR A OH 2 ATOM 637 N N . THR A 1 30 ? -1.597 6.926 -3.883 1.00 0.00 ? 30 THR A N 2 ATOM 638 C CA . THR A 1 30 ? -0.711 6.191 -2.997 1.00 0.00 ? 30 THR A CA 2 ATOM 639 C C . THR A 1 30 ? -1.355 4.868 -2.577 1.00 0.00 ? 30 THR A C 2 ATOM 640 O O . THR A 1 30 ? -2.348 4.441 -3.167 1.00 0.00 ? 30 THR A O 2 ATOM 641 C CB . THR A 1 30 ? -0.362 7.098 -1.817 1.00 0.00 ? 30 THR A CB 2 ATOM 642 O OG1 . THR A 1 30 ? 0.650 6.380 -1.114 1.00 0.00 ? 30 THR A OG1 2 ATOM 643 C CG2 . THR A 1 30 ? -1.506 7.212 -0.808 1.00 0.00 ? 30 THR A CG2 2 ATOM 644 N N . CYS A 1 31 ? -0.765 4.255 -1.562 1.00 0.00 ? 31 CYS A N 2 ATOM 645 C CA . CYS A 1 31 ? -1.269 2.989 -1.057 1.00 0.00 ? 31 CYS A CA 2 ATOM 646 C C . CYS A 1 31 ? -0.723 2.785 0.359 1.00 0.00 ? 31 CYS A C 2 ATOM 647 O O . CYS A 1 31 ? 0.488 2.805 0.570 1.00 0.00 ? 31 CYS A O 2 ATOM 648 C CB . CYS A 1 31 ? -0.905 1.826 -1.981 1.00 0.00 ? 31 CYS A CB 2 ATOM 649 S SG . CYS A 1 31 ? -2.292 0.703 -2.383 1.00 0.00 ? 31 CYS A SG 2 ATOM 650 N N . ASN A 1 32 ? -1.644 2.595 1.292 1.00 0.00 ? 32 ASN A N 2 ATOM 651 C CA . ASN A 1 32 ? -1.272 2.387 2.680 1.00 0.00 ? 32 ASN A CA 2 ATOM 652 C C . ASN A 1 32 ? -0.983 0.903 2.912 1.00 0.00 ? 32 ASN A C 2 ATOM 653 O O . ASN A 1 32 ? -1.867 0.152 3.321 1.00 0.00 ? 32 ASN A O 2 ATOM 654 C CB . ASN A 1 32 ? -2.403 2.802 3.622 1.00 0.00 ? 32 ASN A CB 2 ATOM 655 C CG . ASN A 1 32 ? -3.745 2.242 3.146 1.00 0.00 ? 32 ASN A CG 2 ATOM 656 O OD1 . ASN A 1 32 ? -3.819 1.241 2.453 1.00 0.00 ? 32 ASN A OD1 2 ATOM 657 N ND2 . ASN A 1 32 ? -4.799 2.943 3.553 1.00 0.00 ? 32 ASN A ND2 2 ATOM 658 N N . CYS A 1 33 ? 0.256 0.525 2.636 1.00 0.00 ? 33 CYS A N 2 ATOM 659 C CA . CYS A 1 33 ? 0.673 -0.856 2.808 1.00 0.00 ? 33 CYS A CA 2 ATOM 660 C C . CYS A 1 33 ? 0.590 -1.202 4.297 1.00 0.00 ? 33 CYS A C 2 ATOM 661 O O . CYS A 1 33 ? -0.091 -0.518 5.060 1.00 0.00 ? 33 CYS A O 2 ATOM 662 C CB . CYS A 1 33 ? 2.072 -1.101 2.242 1.00 0.00 ? 33 CYS A CB 2 ATOM 663 S SG . CYS A 1 33 ? 2.262 -2.664 1.310 1.00 0.00 ? 33 CYS A SG 2 ATOM 664 N N . VAL A 1 34 ? 1.295 -2.262 4.667 1.00 0.00 ? 34 VAL A N 2 ATOM 665 C CA . VAL A 1 34 ? 1.310 -2.705 6.049 1.00 0.00 ? 34 VAL A CA 2 ATOM 666 C C . VAL A 1 34 ? 2.721 -3.168 6.416 1.00 0.00 ? 34 VAL A C 2 ATOM 667 O O . VAL A 1 34 ? 3.663 -2.965 5.653 1.00 0.00 ? 34 VAL A O 2 ATOM 668 C CB . VAL A 1 34 ? 0.250 -3.787 6.263 1.00 0.00 ? 34 VAL A CB 2 ATOM 669 C CG1 . VAL A 1 34 ? -1.112 -3.167 6.582 1.00 0.00 ? 34 VAL A CG1 2 ATOM 670 C CG2 . VAL A 1 34 ? 0.159 -4.713 5.049 1.00 0.00 ? 34 VAL A CG2 2 ATOM 671 N N . ILE A 1 35 ? 2.822 -3.782 7.586 1.00 0.00 ? 35 ILE A N 2 ATOM 672 C CA . ILE A 1 35 ? 4.102 -4.276 8.063 1.00 0.00 ? 35 ILE A CA 2 ATOM 673 C C . ILE A 1 35 ? 4.658 -5.292 7.063 1.00 0.00 ? 35 ILE A C 2 ATOM 674 O O . ILE A 1 35 ? 3.896 -5.974 6.378 1.00 0.00 ? 35 ILE A O 2 ATOM 675 C CB . ILE A 1 35 ? 3.968 -4.824 9.485 1.00 0.00 ? 35 ILE A CB 2 ATOM 676 C CG1 . ILE A 1 35 ? 2.962 -4.004 10.296 1.00 0.00 ? 35 ILE A CG1 2 ATOM 677 C CG2 . ILE A 1 35 ? 5.333 -4.901 10.174 1.00 0.00 ? 35 ILE A CG2 2 ATOM 678 C CD1 . ILE A 1 35 ? 3.258 -4.098 11.794 1.00 0.00 ? 35 ILE A CD1 2 ATOM 679 N N . GLY A 1 36 ? 5.979 -5.361 7.011 1.00 0.00 ? 36 GLY A N 2 ATOM 680 C CA . GLY A 1 36 ? 6.645 -6.283 6.105 1.00 0.00 ? 36 GLY A CA 2 ATOM 681 C C . GLY A 1 36 ? 6.014 -6.234 4.712 1.00 0.00 ? 36 GLY A C 2 ATOM 682 O O . GLY A 1 36 ? 6.102 -7.199 3.953 1.00 0.00 ? 36 GLY A O 2 ATOM 683 N N . TYR A 1 37 ? 5.391 -5.102 4.418 1.00 0.00 ? 37 TYR A N 2 ATOM 684 C CA . TYR A 1 37 ? 4.746 -4.915 3.130 1.00 0.00 ? 37 TYR A CA 2 ATOM 685 C C . TYR A 1 37 ? 4.763 -3.443 2.716 1.00 0.00 ? 37 TYR A C 2 ATOM 686 O O . TYR A 1 37 ? 4.199 -2.595 3.405 1.00 0.00 ? 37 TYR A O 2 ATOM 687 C CB . TYR A 1 37 ? 3.296 -5.364 3.317 1.00 0.00 ? 37 TYR A CB 2 ATOM 688 C CG . TYR A 1 37 ? 3.064 -6.853 3.045 1.00 0.00 ? 37 TYR A CG 2 ATOM 689 C CD1 . TYR A 1 37 ? 3.032 -7.319 1.747 1.00 0.00 ? 37 TYR A CD1 2 ATOM 690 C CD2 . TYR A 1 37 ? 2.889 -7.726 4.098 1.00 0.00 ? 37 TYR A CD2 2 ATOM 691 C CE1 . TYR A 1 37 ? 2.814 -8.720 1.493 1.00 0.00 ? 37 TYR A CE1 2 ATOM 692 C CE2 . TYR A 1 37 ? 2.671 -9.126 3.842 1.00 0.00 ? 37 TYR A CE2 2 ATOM 693 C CZ . TYR A 1 37 ? 2.644 -9.554 2.552 1.00 0.00 ? 37 TYR A CZ 2 ATOM 694 O OH . TYR A 1 37 ? 2.439 -10.876 2.312 1.00 0.00 ? 37 TYR A OH 2 ATOM 695 N N . SER A 1 38 ? 5.416 -3.184 1.593 1.00 0.00 ? 38 SER A N 2 ATOM 696 C CA . SER A 1 38 ? 5.514 -1.829 1.080 1.00 0.00 ? 38 SER A CA 2 ATOM 697 C C . SER A 1 38 ? 5.954 -1.854 -0.385 1.00 0.00 ? 38 SER A C 2 ATOM 698 O O . SER A 1 38 ? 6.117 -2.925 -0.970 1.00 0.00 ? 38 SER A O 2 ATOM 699 C CB . SER A 1 38 ? 6.489 -0.993 1.912 1.00 0.00 ? 38 SER A CB 2 ATOM 700 O OG . SER A 1 38 ? 6.474 0.380 1.533 1.00 0.00 ? 38 SER A OG 2 ATOM 701 N N . GLY A 1 39 ? 6.133 -0.664 -0.938 1.00 0.00 ? 39 GLY A N 2 ATOM 702 C CA . GLY A 1 39 ? 6.551 -0.537 -2.323 1.00 0.00 ? 39 GLY A CA 2 ATOM 703 C C . GLY A 1 39 ? 5.413 0.004 -3.191 1.00 0.00 ? 39 GLY A C 2 ATOM 704 O O . GLY A 1 39 ? 5.014 -0.633 -4.165 1.00 0.00 ? 39 GLY A O 2 ATOM 705 N N . ASP A 1 40 ? 4.923 1.174 -2.807 1.00 0.00 ? 40 ASP A N 2 ATOM 706 C CA . ASP A 1 40 ? 3.838 1.806 -3.538 1.00 0.00 ? 40 ASP A CA 2 ATOM 707 C C . ASP A 1 40 ? 2.548 1.015 -3.314 1.00 0.00 ? 40 ASP A C 2 ATOM 708 O O . ASP A 1 40 ? 1.566 1.552 -2.802 1.00 0.00 ? 40 ASP A O 2 ATOM 709 C CB . ASP A 1 40 ? 4.125 1.827 -5.041 1.00 0.00 ? 40 ASP A CB 2 ATOM 710 C CG . ASP A 1 40 ? 3.321 2.856 -5.839 1.00 0.00 ? 40 ASP A CG 2 ATOM 711 O OD1 . ASP A 1 40 ? 2.107 2.704 -6.038 1.00 0.00 ? 40 ASP A OD1 2 ATOM 712 O OD2 . ASP A 1 40 ? 4.003 3.864 -6.269 1.00 0.00 ? 40 ASP A OD2 2 ATOM 713 N N . ARG A 1 41 ? 2.589 -0.249 -3.710 1.00 0.00 ? 41 ARG A N 2 ATOM 714 C CA . ARG A 1 41 ? 1.436 -1.119 -3.559 1.00 0.00 ? 41 ARG A CA 2 ATOM 715 C C . ARG A 1 41 ? 1.603 -2.014 -2.330 1.00 0.00 ? 41 ARG A C 2 ATOM 716 O O . ARG A 1 41 ? 0.922 -1.827 -1.323 1.00 0.00 ? 41 ARG A O 2 ATOM 717 C CB . ARG A 1 41 ? 1.242 -1.997 -4.798 1.00 0.00 ? 41 ARG A CB 2 ATOM 718 C CG . ARG A 1 41 ? 1.443 -1.187 -6.080 1.00 0.00 ? 41 ARG A CG 2 ATOM 719 C CD . ARG A 1 41 ? 0.774 -1.875 -7.272 1.00 0.00 ? 41 ARG A CD 2 ATOM 720 N NE . ARG A 1 41 ? 1.777 -2.651 -8.035 1.00 0.00 ? 41 ARG A NE 2 ATOM 721 C CZ . ARG A 1 41 ? 1.583 -3.915 -8.471 1.00 0.00 ? 41 ARG A CZ 2 ATOM 722 N NH1 . ARG A 1 41 ? 1.889 -4.966 -7.683 1.00 0.00 ? 41 ARG A NH1 2 ATOM 723 N NH2 . ARG A 1 41 ? 1.087 -4.106 -9.680 1.00 0.00 ? 41 ARG A NH2 2 ATOM 724 N N . CYS A 1 42 ? 2.516 -2.967 -2.451 1.00 0.00 ? 42 CYS A N 2 ATOM 725 C CA . CYS A 1 42 ? 2.781 -3.892 -1.362 1.00 0.00 ? 42 CYS A CA 2 ATOM 726 C C . CYS A 1 42 ? 3.410 -5.158 -1.949 1.00 0.00 ? 42 CYS A C 2 ATOM 727 O O . CYS A 1 42 ? 3.052 -6.269 -1.560 1.00 0.00 ? 42 CYS A O 2 ATOM 728 C CB . CYS A 1 42 ? 1.515 -4.201 -0.559 1.00 0.00 ? 42 CYS A CB 2 ATOM 729 S SG . CYS A 1 42 ? 1.353 -3.270 1.006 1.00 0.00 ? 42 CYS A SG 2 ATOM 730 N N . GLN A 1 43 ? 4.332 -4.948 -2.875 1.00 0.00 ? 43 GLN A N 2 ATOM 731 C CA . GLN A 1 43 ? 5.012 -6.058 -3.520 1.00 0.00 ? 43 GLN A CA 2 ATOM 732 C C . GLN A 1 43 ? 6.268 -6.439 -2.734 1.00 0.00 ? 43 GLN A C 2 ATOM 733 O O . GLN A 1 43 ? 6.660 -7.606 -2.710 1.00 0.00 ? 43 GLN A O 2 ATOM 734 C CB . GLN A 1 43 ? 5.355 -5.722 -4.973 1.00 0.00 ? 43 GLN A CB 2 ATOM 735 C CG . GLN A 1 43 ? 4.148 -5.124 -5.697 1.00 0.00 ? 43 GLN A CG 2 ATOM 736 C CD . GLN A 1 43 ? 4.585 -4.051 -6.697 1.00 0.00 ? 43 GLN A CD 2 ATOM 737 O OE1 . GLN A 1 43 ? 4.318 -4.127 -7.885 1.00 0.00 ? 43 GLN A OE1 2 ATOM 738 N NE2 . GLN A 1 43 ? 5.268 -3.050 -6.150 1.00 0.00 ? 43 GLN A NE2 2 ATOM 739 N N . THR A 1 44 ? 6.866 -5.434 -2.110 1.00 0.00 ? 44 THR A N 2 ATOM 740 C CA . THR A 1 44 ? 8.069 -5.650 -1.325 1.00 0.00 ? 44 THR A CA 2 ATOM 741 C C . THR A 1 44 ? 7.712 -6.175 0.065 1.00 0.00 ? 44 THR A C 2 ATOM 742 O O . THR A 1 44 ? 7.377 -5.400 0.961 1.00 0.00 ? 44 THR A O 2 ATOM 743 C CB . THR A 1 44 ? 8.854 -4.337 -1.296 1.00 0.00 ? 44 THR A CB 2 ATOM 744 O OG1 . THR A 1 44 ? 9.382 -4.216 -2.613 1.00 0.00 ? 44 THR A OG1 2 ATOM 745 C CG2 . THR A 1 44 ? 10.095 -4.416 -0.402 1.00 0.00 ? 44 THR A CG2 2 ATOM 746 N N . ARG A 1 45 ? 7.795 -7.490 0.206 1.00 0.00 ? 45 ARG A N 2 ATOM 747 C CA . ARG A 1 45 ? 7.484 -8.130 1.472 1.00 0.00 ? 45 ARG A CA 2 ATOM 748 C C . ARG A 1 45 ? 8.683 -8.043 2.420 1.00 0.00 ? 45 ARG A C 2 ATOM 749 O O . ARG A 1 45 ? 9.546 -8.918 2.415 1.00 0.00 ? 45 ARG A O 2 ATOM 750 C CB . ARG A 1 45 ? 7.107 -9.599 1.272 1.00 0.00 ? 45 ARG A CB 2 ATOM 751 C CG . ARG A 1 45 ? 5.730 -9.897 1.866 1.00 0.00 ? 45 ARG A CG 2 ATOM 752 C CD . ARG A 1 45 ? 5.530 -11.402 2.059 1.00 0.00 ? 45 ARG A CD 2 ATOM 753 N NE . ARG A 1 45 ? 6.486 -11.915 3.066 1.00 0.00 ? 45 ARG A NE 2 ATOM 754 C CZ . ARG A 1 45 ? 6.208 -12.032 4.382 1.00 0.00 ? 45 ARG A CZ 2 ATOM 755 N NH1 . ARG A 1 45 ? 6.417 -10.995 5.221 1.00 0.00 ? 45 ARG A NH1 2 ATOM 756 N NH2 . ARG A 1 45 ? 5.728 -13.176 4.835 1.00 0.00 ? 45 ARG A NH2 2 ATOM 757 N N . ASP A 1 46 ? 8.699 -6.977 3.207 1.00 0.00 ? 46 ASP A N 2 ATOM 758 C CA . ASP A 1 46 ? 9.778 -6.764 4.157 1.00 0.00 ? 46 ASP A CA 2 ATOM 759 C C . ASP A 1 46 ? 9.522 -7.604 5.410 1.00 0.00 ? 46 ASP A C 2 ATOM 760 O O . ASP A 1 46 ? 8.944 -8.688 5.328 1.00 0.00 ? 46 ASP A O 2 ATOM 761 C CB . ASP A 1 46 ? 9.858 -5.296 4.580 1.00 0.00 ? 46 ASP A CB 2 ATOM 762 C CG . ASP A 1 46 ? 11.275 -4.757 4.780 1.00 0.00 ? 46 ASP A CG 2 ATOM 763 O OD1 . ASP A 1 46 ? 11.845 -4.314 3.710 1.00 0.00 ? 46 ASP A OD1 2 ATOM 764 O OD2 . ASP A 1 46 ? 11.809 -4.761 5.899 1.00 0.00 ? 46 ASP A OD2 2 ATOM 765 N N . LEU A 1 47 ? 9.966 -7.075 6.539 1.00 0.00 ? 47 LEU A N 2 ATOM 766 C CA . LEU A 1 47 ? 9.792 -7.763 7.808 1.00 0.00 ? 47 LEU A CA 2 ATOM 767 C C . LEU A 1 47 ? 9.230 -6.784 8.841 1.00 0.00 ? 47 LEU A C 2 ATOM 768 O O . LEU A 1 47 ? 8.019 -6.581 8.915 1.00 0.00 ? 47 LEU A O 2 ATOM 769 C CB . LEU A 1 47 ? 11.099 -8.430 8.239 1.00 0.00 ? 47 LEU A CB 2 ATOM 770 C CG . LEU A 1 47 ? 11.398 -9.790 7.607 1.00 0.00 ? 47 LEU A CG 2 ATOM 771 C CD1 . LEU A 1 47 ? 10.177 -10.708 7.679 1.00 0.00 ? 47 LEU A CD1 2 ATOM 772 C CD2 . LEU A 1 47 ? 11.911 -9.627 6.173 1.00 0.00 ? 47 LEU A CD2 2 ATOM 773 N N . ARG A 1 48 ? 10.138 -6.201 9.613 1.00 0.00 ? 48 ARG A N 2 ATOM 774 C CA . ARG A 1 48 ? 9.749 -5.248 10.637 1.00 0.00 ? 48 ARG A CA 2 ATOM 775 C C . ARG A 1 48 ? 9.197 -5.983 11.863 1.00 0.00 ? 48 ARG A C 2 ATOM 776 O O . ARG A 1 48 ? 7.989 -6.000 12.087 1.00 0.00 ? 48 ARG A O 2 ATOM 777 C CB . ARG A 1 48 ? 8.689 -4.278 10.114 1.00 0.00 ? 48 ARG A CB 2 ATOM 778 C CG . ARG A 1 48 ? 8.888 -2.879 10.702 1.00 0.00 ? 48 ARG A CG 2 ATOM 779 C CD . ARG A 1 48 ? 8.647 -1.800 9.643 1.00 0.00 ? 48 ARG A CD 2 ATOM 780 N NE . ARG A 1 48 ? 9.872 -1.601 8.836 1.00 0.00 ? 48 ARG A NE 2 ATOM 781 C CZ . ARG A 1 48 ? 10.640 -0.493 8.888 1.00 0.00 ? 48 ARG A CZ 2 ATOM 782 N NH1 . ARG A 1 48 ? 10.365 0.515 8.081 1.00 0.00 ? 48 ARG A NH1 2 ATOM 783 N NH2 . ARG A 1 48 ? 11.674 -0.416 9.752 1.00 0.00 ? 48 ARG A NH2 2 ATOM 784 N N . TRP A 1 49 ? 10.112 -6.572 12.620 1.00 0.00 ? 49 TRP A N 2 ATOM 785 C CA . TRP A 1 49 ? 9.731 -7.305 13.816 1.00 0.00 ? 49 TRP A CA 2 ATOM 786 C C . TRP A 1 49 ? 8.481 -8.125 13.491 1.00 0.00 ? 49 TRP A C 2 ATOM 787 O O . TRP A 1 49 ? 7.364 -7.620 13.582 1.00 0.00 ? 49 TRP A O 2 ATOM 788 C CB . TRP A 1 49 ? 9.534 -6.358 15.000 1.00 0.00 ? 49 TRP A CB 2 ATOM 789 C CG . TRP A 1 49 ? 8.077 -6.203 15.437 1.00 0.00 ? 49 TRP A CG 2 ATOM 790 C CD1 . TRP A 1 49 ? 7.099 -5.522 14.824 1.00 0.00 ? 49 TRP A CD1 2 ATOM 791 C CD2 . TRP A 1 49 ? 7.466 -6.773 16.615 1.00 0.00 ? 49 TRP A CD2 2 ATOM 792 N NE1 . TRP A 1 49 ? 5.908 -5.609 15.517 1.00 0.00 ? 49 TRP A NE1 2 ATOM 793 C CE2 . TRP A 1 49 ? 6.139 -6.395 16.640 1.00 0.00 ? 49 TRP A CE2 2 ATOM 794 C CE3 . TRP A 1 49 ? 8.018 -7.580 17.624 1.00 0.00 ? 49 TRP A CE3 2 ATOM 795 C CZ2 . TRP A 1 49 ? 5.253 -6.778 17.655 1.00 0.00 ? 49 TRP A CZ2 2 ATOM 796 C CZ3 . TRP A 1 49 ? 7.119 -7.955 18.630 1.00 0.00 ? 49 TRP A CZ3 2 ATOM 797 C CH2 . TRP A 1 49 ? 5.781 -7.583 18.671 1.00 0.00 ? 49 TRP A CH2 2 ATOM 798 N N . TRP A 1 50 ? 8.712 -9.374 13.118 1.00 0.00 ? 50 TRP A N 2 ATOM 799 C CA . TRP A 1 50 ? 7.618 -10.268 12.780 1.00 0.00 ? 50 TRP A CA 2 ATOM 800 C C . TRP A 1 50 ? 7.693 -11.481 13.709 1.00 0.00 ? 50 TRP A C 2 ATOM 801 O O . TRP A 1 50 ? 8.560 -11.548 14.579 1.00 0.00 ? 50 TRP A O 2 ATOM 802 C CB . TRP A 1 50 ? 7.661 -10.648 11.299 1.00 0.00 ? 50 TRP A CB 2 ATOM 803 C CG . TRP A 1 50 ? 6.744 -9.801 10.413 1.00 0.00 ? 50 TRP A CG 2 ATOM 804 C CD1 . TRP A 1 50 ? 6.432 -8.506 10.550 1.00 0.00 ? 50 TRP A CD1 2 ATOM 805 C CD2 . TRP A 1 50 ? 6.031 -10.246 9.239 1.00 0.00 ? 50 TRP A CD2 2 ATOM 806 N NE1 . TRP A 1 50 ? 5.573 -8.085 9.555 1.00 0.00 ? 50 TRP A NE1 2 ATOM 807 C CE2 . TRP A 1 50 ? 5.321 -9.175 8.732 1.00 0.00 ? 50 TRP A CE2 2 ATOM 808 C CE3 . TRP A 1 50 ? 5.986 -11.511 8.626 1.00 0.00 ? 50 TRP A CE3 2 ATOM 809 C CZ2 . TRP A 1 50 ? 4.516 -9.262 7.592 1.00 0.00 ? 50 TRP A CZ2 2 ATOM 810 C CZ3 . TRP A 1 50 ? 5.176 -11.581 7.487 1.00 0.00 ? 50 TRP A CZ3 2 ATOM 811 C CH2 . TRP A 1 50 ? 4.456 -10.512 6.964 1.00 0.00 ? 50 TRP A CH2 2 ATOM 812 N N . GLU A 1 51 ? 6.772 -12.410 13.494 1.00 0.00 ? 51 GLU A N 2 ATOM 813 C CA . GLU A 1 51 ? 6.724 -13.616 14.304 1.00 0.00 ? 51 GLU A CA 2 ATOM 814 C C . GLU A 1 51 ? 6.716 -14.855 13.407 1.00 0.00 ? 51 GLU A C 2 ATOM 815 O O . GLU A 1 51 ? 6.208 -14.814 12.286 1.00 0.00 ? 51 GLU A O 2 ATOM 816 C CB . GLU A 1 51 ? 5.507 -13.604 15.232 1.00 0.00 ? 51 GLU A CB 2 ATOM 817 C CG . GLU A 1 51 ? 4.384 -12.741 14.655 1.00 0.00 ? 51 GLU A CG 2 ATOM 818 C CD . GLU A 1 51 ? 3.064 -12.997 15.386 1.00 0.00 ? 51 GLU A CD 2 ATOM 819 O OE1 . GLU A 1 51 ? 2.322 -13.919 15.022 1.00 0.00 ? 51 GLU A OE1 2 ATOM 820 O OE2 . GLU A 1 51 ? 2.823 -12.195 16.369 1.00 0.00 ? 51 GLU A OE2 2 ATOM 821 N N . LEU A 1 52 ? 7.283 -15.931 13.933 1.00 0.00 ? 52 LEU A N 2 ATOM 822 C CA . LEU A 1 52 ? 7.349 -17.181 13.195 1.00 0.00 ? 52 LEU A CA 2 ATOM 823 C C . LEU A 1 52 ? 6.775 -18.308 14.057 1.00 0.00 ? 52 LEU A C 2 ATOM 824 O O . LEU A 1 52 ? 6.892 -18.277 15.280 1.00 0.00 ? 52 LEU A O 2 ATOM 825 C CB . LEU A 1 52 ? 8.775 -17.442 12.709 1.00 0.00 ? 52 LEU A CB 2 ATOM 826 C CG . LEU A 1 52 ? 9.785 -17.852 13.783 1.00 0.00 ? 52 LEU A CG 2 ATOM 827 C CD1 . LEU A 1 52 ? 10.067 -19.355 13.727 1.00 0.00 ? 52 LEU A CD1 2 ATOM 828 C CD2 . LEU A 1 52 ? 11.067 -17.024 13.675 1.00 0.00 ? 52 LEU A CD2 2 ATOM 829 N N . ARG A 1 53 ? 6.170 -19.275 13.384 1.00 0.00 ? 53 ARG A N 2 ATOM 830 C CA . ARG A 1 53 ? 5.580 -20.409 14.071 1.00 0.00 ? 53 ARG A CA 2 ATOM 831 C C . ARG A 1 53 ? 5.646 -21.659 13.192 1.00 0.00 ? 53 ARG A C 2 ATOM 832 O O . ARG A 1 53 ? 5.853 -21.560 11.983 1.00 0.00 ? 53 ARG A O 2 ATOM 833 C CB . ARG A 1 53 ? 4.121 -20.132 14.440 1.00 0.00 ? 53 ARG A CB 2 ATOM 834 C CG . ARG A 1 53 ? 3.585 -21.192 15.403 1.00 0.00 ? 53 ARG A CG 2 ATOM 835 C CD . ARG A 1 53 ? 2.516 -22.054 14.729 1.00 0.00 ? 53 ARG A CD 2 ATOM 836 N NE . ARG A 1 53 ? 2.060 -23.114 15.659 1.00 0.00 ? 53 ARG A NE 2 ATOM 837 C CZ . ARG A 1 53 ? 0.952 -23.023 16.422 1.00 0.00 ? 53 ARG A CZ 2 ATOM 838 N NH1 . ARG A 1 53 ? 1.009 -22.464 17.650 1.00 0.00 ? 53 ARG A NH1 2 ATOM 839 N NH2 . ARG A 1 53 ? -0.189 -23.494 15.954 1.00 0.00 ? 53 ARG A NH2 2 ATOM 840 O OXT . ARG A 1 53 ? 5.474 -22.774 13.815 1.00 0.00 ? 53 ARG A OXT 2 ATOM 841 N N . ASN A 1 1 ? -2.536 16.219 2.199 1.00 0.00 ? 1 ASN A N 3 ATOM 842 C CA . ASN A 1 1 ? -3.788 15.684 2.707 1.00 0.00 ? 1 ASN A CA 3 ATOM 843 C C . ASN A 1 1 ? -4.069 14.336 2.039 1.00 0.00 ? 1 ASN A C 3 ATOM 844 O O . ASN A 1 1 ? -3.703 14.123 0.884 1.00 0.00 ? 1 ASN A O 3 ATOM 845 C CB . ASN A 1 1 ? -4.956 16.621 2.389 1.00 0.00 ? 1 ASN A CB 3 ATOM 846 C CG . ASN A 1 1 ? -4.799 17.958 3.118 1.00 0.00 ? 1 ASN A CG 3 ATOM 847 O OD1 . ASN A 1 1 ? -4.096 18.854 2.679 1.00 0.00 ? 1 ASN A OD1 3 ATOM 848 N ND2 . ASN A 1 1 ? -5.491 18.042 4.249 1.00 0.00 ? 1 ASN A ND2 3 ATOM 849 N N . SER A 1 2 ? -4.717 13.461 2.795 1.00 0.00 ? 2 SER A N 3 ATOM 850 C CA . SER A 1 2 ? -5.052 12.140 2.290 1.00 0.00 ? 2 SER A CA 3 ATOM 851 C C . SER A 1 2 ? -6.540 12.073 1.946 1.00 0.00 ? 2 SER A C 3 ATOM 852 O O . SER A 1 2 ? -7.384 12.507 2.731 1.00 0.00 ? 2 SER A O 3 ATOM 853 C CB . SER A 1 2 ? -4.694 11.056 3.310 1.00 0.00 ? 2 SER A CB 3 ATOM 854 O OG . SER A 1 2 ? -4.902 9.745 2.788 1.00 0.00 ? 2 SER A OG 3 ATOM 855 N N . TYR A 1 3 ? -6.821 11.526 0.773 1.00 0.00 ? 3 TYR A N 3 ATOM 856 C CA . TYR A 1 3 ? -8.194 11.396 0.316 1.00 0.00 ? 3 TYR A CA 3 ATOM 857 C C . TYR A 1 3 ? -8.481 9.970 -0.159 1.00 0.00 ? 3 TYR A C 3 ATOM 858 O O . TYR A 1 3 ? -7.672 9.373 -0.869 1.00 0.00 ? 3 TYR A O 3 ATOM 859 C CB . TYR A 1 3 ? -8.335 12.354 -0.870 1.00 0.00 ? 3 TYR A CB 3 ATOM 860 C CG . TYR A 1 3 ? -9.662 12.223 -1.620 1.00 0.00 ? 3 TYR A CG 3 ATOM 861 C CD1 . TYR A 1 3 ? -10.749 12.984 -1.237 1.00 0.00 ? 3 TYR A CD1 3 ATOM 862 C CD2 . TYR A 1 3 ? -9.773 11.346 -2.679 1.00 0.00 ? 3 TYR A CD2 3 ATOM 863 C CE1 . TYR A 1 3 ? -11.998 12.861 -1.943 1.00 0.00 ? 3 TYR A CE1 3 ATOM 864 C CE2 . TYR A 1 3 ? -11.022 11.224 -3.384 1.00 0.00 ? 3 TYR A CE2 3 ATOM 865 C CZ . TYR A 1 3 ? -12.073 11.988 -2.982 1.00 0.00 ? 3 TYR A CZ 3 ATOM 866 O OH . TYR A 1 3 ? -13.253 11.873 -3.649 1.00 0.00 ? 3 TYR A OH 3 ATOM 867 N N . PRO A 1 4 ? -9.667 9.452 0.261 1.00 0.00 ? 4 PRO A N 3 ATOM 868 C CA . PRO A 1 4 ? -10.070 8.108 -0.113 1.00 0.00 ? 4 PRO A CA 3 ATOM 869 C C . PRO A 1 4 ? -10.528 8.059 -1.571 1.00 0.00 ? 4 PRO A C 3 ATOM 870 O O . PRO A 1 4 ? -11.548 8.647 -1.927 1.00 0.00 ? 4 PRO A O 3 ATOM 871 C CB . PRO A 1 4 ? -11.174 7.741 0.868 1.00 0.00 ? 4 PRO A CB 3 ATOM 872 C CG . PRO A 1 4 ? -11.664 9.056 1.452 1.00 0.00 ? 4 PRO A CG 3 ATOM 873 C CD . PRO A 1 4 ? -10.650 10.132 1.102 1.00 0.00 ? 4 PRO A CD 3 ATOM 874 N N . GLY A 1 5 ? -9.750 7.353 -2.379 1.00 0.00 ? 5 GLY A N 3 ATOM 875 C CA . GLY A 1 5 ? -10.062 7.219 -3.792 1.00 0.00 ? 5 GLY A CA 3 ATOM 876 C C . GLY A 1 5 ? -9.122 6.221 -4.469 1.00 0.00 ? 5 GLY A C 3 ATOM 877 O O . GLY A 1 5 ? -8.011 5.988 -3.995 1.00 0.00 ? 5 GLY A O 3 ATOM 878 N N . CYS A 1 6 ? -9.600 5.659 -5.570 1.00 0.00 ? 6 CYS A N 3 ATOM 879 C CA . CYS A 1 6 ? -8.816 4.692 -6.318 1.00 0.00 ? 6 CYS A CA 3 ATOM 880 C C . CYS A 1 6 ? -9.636 4.240 -7.528 1.00 0.00 ? 6 CYS A C 3 ATOM 881 O O . CYS A 1 6 ? -10.537 3.413 -7.396 1.00 0.00 ? 6 CYS A O 3 ATOM 882 C CB . CYS A 1 6 ? -8.391 3.511 -5.443 1.00 0.00 ? 6 CYS A CB 3 ATOM 883 S SG . CYS A 1 6 ? -6.856 2.671 -5.980 1.00 0.00 ? 6 CYS A SG 3 ATOM 884 N N . PRO A 1 7 ? -9.286 4.817 -8.708 1.00 0.00 ? 7 PRO A N 3 ATOM 885 C CA . PRO A 1 7 ? -9.980 4.483 -9.940 1.00 0.00 ? 7 PRO A CA 3 ATOM 886 C C . PRO A 1 7 ? -9.558 3.104 -10.450 1.00 0.00 ? 7 PRO A C 3 ATOM 887 O O . PRO A 1 7 ? -8.785 2.405 -9.795 1.00 0.00 ? 7 PRO A O 3 ATOM 888 C CB . PRO A 1 7 ? -9.631 5.605 -10.905 1.00 0.00 ? 7 PRO A CB 3 ATOM 889 C CG . PRO A 1 7 ? -8.392 6.276 -10.334 1.00 0.00 ? 7 PRO A CG 3 ATOM 890 C CD . PRO A 1 7 ? -8.224 5.800 -8.900 1.00 0.00 ? 7 PRO A CD 3 ATOM 891 N N . SER A 1 8 ? -10.084 2.752 -11.614 1.00 0.00 ? 8 SER A N 3 ATOM 892 C CA . SER A 1 8 ? -9.772 1.469 -12.218 1.00 0.00 ? 8 SER A CA 3 ATOM 893 C C . SER A 1 8 ? -8.527 1.594 -13.098 1.00 0.00 ? 8 SER A C 3 ATOM 894 O O . SER A 1 8 ? -8.265 0.733 -13.938 1.00 0.00 ? 8 SER A O 3 ATOM 895 C CB . SER A 1 8 ? -10.951 0.946 -13.040 1.00 0.00 ? 8 SER A CB 3 ATOM 896 O OG . SER A 1 8 ? -11.255 1.797 -14.142 1.00 0.00 ? 8 SER A OG 3 ATOM 897 N N . SER A 1 9 ? -7.791 2.673 -12.877 1.00 0.00 ? 9 SER A N 3 ATOM 898 C CA . SER A 1 9 ? -6.579 2.922 -13.640 1.00 0.00 ? 9 SER A CA 3 ATOM 899 C C . SER A 1 9 ? -5.423 2.101 -13.067 1.00 0.00 ? 9 SER A C 3 ATOM 900 O O . SER A 1 9 ? -4.641 1.519 -13.815 1.00 0.00 ? 9 SER A O 3 ATOM 901 C CB . SER A 1 9 ? -6.225 4.411 -13.640 1.00 0.00 ? 9 SER A CB 3 ATOM 902 O OG . SER A 1 9 ? -5.104 4.694 -14.472 1.00 0.00 ? 9 SER A OG 3 ATOM 903 N N . TYR A 1 10 ? -5.351 2.084 -11.744 1.00 0.00 ? 10 TYR A N 3 ATOM 904 C CA . TYR A 1 10 ? -4.302 1.343 -11.061 1.00 0.00 ? 10 TYR A CA 3 ATOM 905 C C . TYR A 1 10 ? -4.827 0.004 -10.540 1.00 0.00 ? 10 TYR A C 3 ATOM 906 O O . TYR A 1 10 ? -4.175 -0.649 -9.728 1.00 0.00 ? 10 TYR A O 3 ATOM 907 C CB . TYR A 1 10 ? -3.880 2.209 -9.874 1.00 0.00 ? 10 TYR A CB 3 ATOM 908 C CG . TYR A 1 10 ? -3.921 3.713 -10.152 1.00 0.00 ? 10 TYR A CG 3 ATOM 909 C CD1 . TYR A 1 10 ? -2.859 4.326 -10.784 1.00 0.00 ? 10 TYR A CD1 3 ATOM 910 C CD2 . TYR A 1 10 ? -5.021 4.454 -9.773 1.00 0.00 ? 10 TYR A CD2 3 ATOM 911 C CE1 . TYR A 1 10 ? -2.899 5.742 -11.048 1.00 0.00 ? 10 TYR A CE1 3 ATOM 912 C CE2 . TYR A 1 10 ? -5.060 5.869 -10.035 1.00 0.00 ? 10 TYR A CE2 3 ATOM 913 C CZ . TYR A 1 10 ? -3.997 6.444 -10.660 1.00 0.00 ? 10 TYR A CZ 3 ATOM 914 O OH . TYR A 1 10 ? -4.033 7.781 -10.908 1.00 0.00 ? 10 TYR A OH 3 ATOM 915 N N . ASP A 1 11 ? -6.000 -0.369 -11.033 1.00 0.00 ? 11 ASP A N 3 ATOM 916 C CA . ASP A 1 11 ? -6.619 -1.618 -10.627 1.00 0.00 ? 11 ASP A CA 3 ATOM 917 C C . ASP A 1 11 ? -6.495 -1.775 -9.110 1.00 0.00 ? 11 ASP A C 3 ATOM 918 O O . ASP A 1 11 ? -6.015 -2.799 -8.626 1.00 0.00 ? 11 ASP A O 3 ATOM 919 C CB . ASP A 1 11 ? -5.926 -2.814 -11.284 1.00 0.00 ? 11 ASP A CB 3 ATOM 920 C CG . ASP A 1 11 ? -4.464 -3.013 -10.886 1.00 0.00 ? 11 ASP A CG 3 ATOM 921 O OD1 . ASP A 1 11 ? -3.551 -2.424 -11.486 1.00 0.00 ? 11 ASP A OD1 3 ATOM 922 O OD2 . ASP A 1 11 ? -4.273 -3.823 -9.901 1.00 0.00 ? 11 ASP A OD2 3 ATOM 923 N N . GLY A 1 12 ? -6.937 -0.746 -8.403 1.00 0.00 ? 12 GLY A N 3 ATOM 924 C CA . GLY A 1 12 ? -6.882 -0.757 -6.950 1.00 0.00 ? 12 GLY A CA 3 ATOM 925 C C . GLY A 1 12 ? -5.547 -0.203 -6.449 1.00 0.00 ? 12 GLY A C 3 ATOM 926 O O . GLY A 1 12 ? -5.470 0.337 -5.345 1.00 0.00 ? 12 GLY A O 3 ATOM 927 N N . TYR A 1 13 ? -4.529 -0.356 -7.283 1.00 0.00 ? 13 TYR A N 3 ATOM 928 C CA . TYR A 1 13 ? -3.200 0.124 -6.936 1.00 0.00 ? 13 TYR A CA 3 ATOM 929 C C . TYR A 1 13 ? -2.686 -0.558 -5.668 1.00 0.00 ? 13 TYR A C 3 ATOM 930 O O . TYR A 1 13 ? -1.675 -0.143 -5.102 1.00 0.00 ? 13 TYR A O 3 ATOM 931 C CB . TYR A 1 13 ? -3.348 1.623 -6.672 1.00 0.00 ? 13 TYR A CB 3 ATOM 932 C CG . TYR A 1 13 ? -2.259 2.479 -7.318 1.00 0.00 ? 13 TYR A CG 3 ATOM 933 C CD1 . TYR A 1 13 ? -0.964 2.004 -7.400 1.00 0.00 ? 13 TYR A CD1 3 ATOM 934 C CD2 . TYR A 1 13 ? -2.568 3.728 -7.819 1.00 0.00 ? 13 TYR A CD2 3 ATOM 935 C CE1 . TYR A 1 13 ? 0.061 2.810 -8.009 1.00 0.00 ? 13 TYR A CE1 3 ATOM 936 C CE2 . TYR A 1 13 ? -1.540 4.533 -8.428 1.00 0.00 ? 13 TYR A CE2 3 ATOM 937 C CZ . TYR A 1 13 ? -0.278 4.035 -8.492 1.00 0.00 ? 13 TYR A CZ 3 ATOM 938 O OH . TYR A 1 13 ? 0.693 4.796 -9.066 1.00 0.00 ? 13 TYR A OH 3 ATOM 939 N N . CYS A 1 14 ? -3.402 -1.595 -5.256 1.00 0.00 ? 14 CYS A N 3 ATOM 940 C CA . CYS A 1 14 ? -3.030 -2.338 -4.066 1.00 0.00 ? 14 CYS A CA 3 ATOM 941 C C . CYS A 1 14 ? -3.088 -3.831 -4.394 1.00 0.00 ? 14 CYS A C 3 ATOM 942 O O . CYS A 1 14 ? -4.118 -4.333 -4.838 1.00 0.00 ? 14 CYS A O 3 ATOM 943 C CB . CYS A 1 14 ? -3.922 -1.980 -2.875 1.00 0.00 ? 14 CYS A CB 3 ATOM 944 S SG . CYS A 1 14 ? -4.467 -0.235 -2.820 1.00 0.00 ? 14 CYS A SG 3 ATOM 945 N N . LEU A 1 15 ? -1.966 -4.499 -4.161 1.00 0.00 ? 15 LEU A N 3 ATOM 946 C CA . LEU A 1 15 ? -1.875 -5.923 -4.425 1.00 0.00 ? 15 LEU A CA 3 ATOM 947 C C . LEU A 1 15 ? -1.491 -6.654 -3.139 1.00 0.00 ? 15 LEU A C 3 ATOM 948 O O . LEU A 1 15 ? -1.251 -6.023 -2.109 1.00 0.00 ? 15 LEU A O 3 ATOM 949 C CB . LEU A 1 15 ? -0.924 -6.192 -5.593 1.00 0.00 ? 15 LEU A CB 3 ATOM 950 C CG . LEU A 1 15 ? 0.078 -5.080 -5.911 1.00 0.00 ? 15 LEU A CG 3 ATOM 951 C CD1 . LEU A 1 15 ? 1.274 -5.130 -4.957 1.00 0.00 ? 15 LEU A CD1 3 ATOM 952 C CD2 . LEU A 1 15 ? 0.512 -5.136 -7.377 1.00 0.00 ? 15 LEU A CD2 3 ATOM 953 N N . ASN A 1 16 ? -1.444 -7.976 -3.236 1.00 0.00 ? 16 ASN A N 3 ATOM 954 C CA . ASN A 1 16 ? -1.093 -8.798 -2.091 1.00 0.00 ? 16 ASN A CA 3 ATOM 955 C C . ASN A 1 16 ? -2.227 -8.751 -1.068 1.00 0.00 ? 16 ASN A C 3 ATOM 956 O O . ASN A 1 16 ? -2.759 -9.788 -0.674 1.00 0.00 ? 16 ASN A O 3 ATOM 957 C CB . ASN A 1 16 ? 0.178 -8.284 -1.413 1.00 0.00 ? 16 ASN A CB 3 ATOM 958 C CG . ASN A 1 16 ? 1.377 -9.174 -1.748 1.00 0.00 ? 16 ASN A CG 3 ATOM 959 O OD1 . ASN A 1 16 ? 1.286 -10.389 -1.803 1.00 0.00 ? 16 ASN A OD1 3 ATOM 960 N ND2 . ASN A 1 16 ? 2.503 -8.502 -1.968 1.00 0.00 ? 16 ASN A ND2 3 ATOM 961 N N . GLY A 1 17 ? -2.566 -7.536 -0.664 1.00 0.00 ? 17 GLY A N 3 ATOM 962 C CA . GLY A 1 17 ? -3.629 -7.339 0.309 1.00 0.00 ? 17 GLY A CA 3 ATOM 963 C C . GLY A 1 17 ? -3.463 -6.006 1.041 1.00 0.00 ? 17 GLY A C 3 ATOM 964 O O . GLY A 1 17 ? -2.945 -5.967 2.157 1.00 0.00 ? 17 GLY A O 3 ATOM 965 N N . GLY A 1 18 ? -3.909 -4.947 0.385 1.00 0.00 ? 18 GLY A N 3 ATOM 966 C CA . GLY A 1 18 ? -3.817 -3.615 0.960 1.00 0.00 ? 18 GLY A CA 3 ATOM 967 C C . GLY A 1 18 ? -4.952 -2.721 0.458 1.00 0.00 ? 18 GLY A C 3 ATOM 968 O O . GLY A 1 18 ? -5.600 -3.034 -0.538 1.00 0.00 ? 18 GLY A O 3 ATOM 969 N N . VAL A 1 19 ? -5.161 -1.625 1.175 1.00 0.00 ? 19 VAL A N 3 ATOM 970 C CA . VAL A 1 19 ? -6.207 -0.683 0.815 1.00 0.00 ? 19 VAL A CA 3 ATOM 971 C C . VAL A 1 19 ? -5.617 0.410 -0.080 1.00 0.00 ? 19 VAL A C 3 ATOM 972 O O . VAL A 1 19 ? -4.400 0.561 -0.161 1.00 0.00 ? 19 VAL A O 3 ATOM 973 C CB . VAL A 1 19 ? -6.869 -0.130 2.078 1.00 0.00 ? 19 VAL A CB 3 ATOM 974 C CG1 . VAL A 1 19 ? -8.185 0.575 1.742 1.00 0.00 ? 19 VAL A CG1 3 ATOM 975 C CG2 . VAL A 1 19 ? -7.087 -1.235 3.111 1.00 0.00 ? 19 VAL A CG2 3 ATOM 976 N N . CYS A 1 20 ? -6.510 1.145 -0.727 1.00 0.00 ? 20 CYS A N 3 ATOM 977 C CA . CYS A 1 20 ? -6.093 2.219 -1.612 1.00 0.00 ? 20 CYS A CA 3 ATOM 978 C C . CYS A 1 20 ? -6.415 3.551 -0.934 1.00 0.00 ? 20 CYS A C 3 ATOM 979 O O . CYS A 1 20 ? -7.419 3.670 -0.233 1.00 0.00 ? 20 CYS A O 3 ATOM 980 C CB . CYS A 1 20 ? -6.752 2.106 -2.989 1.00 0.00 ? 20 CYS A CB 3 ATOM 981 S SG . CYS A 1 20 ? -5.841 2.929 -4.345 1.00 0.00 ? 20 CYS A SG 3 ATOM 982 N N . MET A 1 21 ? -5.543 4.522 -1.165 1.00 0.00 ? 21 MET A N 3 ATOM 983 C CA . MET A 1 21 ? -5.722 5.843 -0.584 1.00 0.00 ? 21 MET A CA 3 ATOM 984 C C . MET A 1 21 ? -5.102 6.922 -1.475 1.00 0.00 ? 21 MET A C 3 ATOM 985 O O . MET A 1 21 ? -3.976 6.772 -1.947 1.00 0.00 ? 21 MET A O 3 ATOM 986 C CB . MET A 1 21 ? -5.067 5.884 0.798 1.00 0.00 ? 21 MET A CB 3 ATOM 987 C CG . MET A 1 21 ? -6.038 5.405 1.879 1.00 0.00 ? 21 MET A CG 3 ATOM 988 S SD . MET A 1 21 ? -5.617 6.142 3.449 1.00 0.00 ? 21 MET A SD 3 ATOM 989 C CE . MET A 1 21 ? -6.724 7.542 3.443 1.00 0.00 ? 21 MET A CE 3 ATOM 990 N N . HIS A 1 22 ? -5.867 7.985 -1.679 1.00 0.00 ? 22 HIS A N 3 ATOM 991 C CA . HIS A 1 22 ? -5.407 9.089 -2.506 1.00 0.00 ? 22 HIS A CA 3 ATOM 992 C C . HIS A 1 22 ? -4.556 10.042 -1.662 1.00 0.00 ? 22 HIS A C 3 ATOM 993 O O . HIS A 1 22 ? -4.725 10.118 -0.446 1.00 0.00 ? 22 HIS A O 3 ATOM 994 C CB . HIS A 1 22 ? -6.586 9.787 -3.183 1.00 0.00 ? 22 HIS A CB 3 ATOM 995 C CG . HIS A 1 22 ? -6.235 10.456 -4.491 1.00 0.00 ? 22 HIS A CG 3 ATOM 996 N ND1 . HIS A 1 22 ? -6.899 11.575 -4.963 1.00 0.00 ? 22 HIS A ND1 3 ATOM 997 C CD2 . HIS A 1 22 ? -5.284 10.154 -5.419 1.00 0.00 ? 22 HIS A CD2 3 ATOM 998 C CE1 . HIS A 1 22 ? -6.364 11.922 -6.124 1.00 0.00 ? 22 HIS A CE1 3 ATOM 999 N NE2 . HIS A 1 22 ? -5.364 11.038 -6.406 1.00 0.00 ? 22 HIS A NE2 3 ATOM 1000 N N . ILE A 1 23 ? -3.664 10.746 -2.342 1.00 0.00 ? 23 ILE A N 3 ATOM 1001 C CA . ILE A 1 23 ? -2.789 11.692 -1.671 1.00 0.00 ? 23 ILE A CA 3 ATOM 1002 C C . ILE A 1 23 ? -3.199 13.117 -2.049 1.00 0.00 ? 23 ILE A C 3 ATOM 1003 O O . ILE A 1 23 ? -2.854 14.070 -1.354 1.00 0.00 ? 23 ILE A O 3 ATOM 1004 C CB . ILE A 1 23 ? -1.323 11.372 -1.973 1.00 0.00 ? 23 ILE A CB 3 ATOM 1005 C CG1 . ILE A 1 23 ? -1.158 9.915 -2.406 1.00 0.00 ? 23 ILE A CG1 3 ATOM 1006 C CG2 . ILE A 1 23 ? -0.429 11.722 -0.783 1.00 0.00 ? 23 ILE A CG2 3 ATOM 1007 C CD1 . ILE A 1 23 ? 0.271 9.427 -2.156 1.00 0.00 ? 23 ILE A CD1 3 ATOM 1008 N N . GLU A 1 24 ? -3.927 13.216 -3.151 1.00 0.00 ? 24 GLU A N 3 ATOM 1009 C CA . GLU A 1 24 ? -4.388 14.509 -3.628 1.00 0.00 ? 24 GLU A CA 3 ATOM 1010 C C . GLU A 1 24 ? -3.242 15.521 -3.609 1.00 0.00 ? 24 GLU A C 3 ATOM 1011 O O . GLU A 1 24 ? -2.101 15.166 -3.320 1.00 0.00 ? 24 GLU A O 3 ATOM 1012 C CB . GLU A 1 24 ? -5.575 15.008 -2.801 1.00 0.00 ? 24 GLU A CB 3 ATOM 1013 C CG . GLU A 1 24 ? -5.172 15.232 -1.343 1.00 0.00 ? 24 GLU A CG 3 ATOM 1014 C CD . GLU A 1 24 ? -6.242 16.026 -0.593 1.00 0.00 ? 24 GLU A CD 3 ATOM 1015 O OE1 . GLU A 1 24 ? -7.189 15.434 -0.054 1.00 0.00 ? 24 GLU A OE1 3 ATOM 1016 O OE2 . GLU A 1 24 ? -6.067 17.304 -0.582 1.00 0.00 ? 24 GLU A OE2 3 ATOM 1017 N N . SER A 1 25 ? -3.585 16.761 -3.923 1.00 0.00 ? 25 SER A N 3 ATOM 1018 C CA . SER A 1 25 ? -2.598 17.828 -3.945 1.00 0.00 ? 25 SER A CA 3 ATOM 1019 C C . SER A 1 25 ? -1.863 17.832 -5.287 1.00 0.00 ? 25 SER A C 3 ATOM 1020 O O . SER A 1 25 ? -1.481 18.889 -5.787 1.00 0.00 ? 25 SER A O 3 ATOM 1021 C CB . SER A 1 25 ? -1.601 17.680 -2.795 1.00 0.00 ? 25 SER A CB 3 ATOM 1022 O OG . SER A 1 25 ? -0.365 17.117 -3.226 1.00 0.00 ? 25 SER A OG 3 ATOM 1023 N N . LEU A 1 26 ? -1.686 16.637 -5.831 1.00 0.00 ? 26 LEU A N 3 ATOM 1024 C CA . LEU A 1 26 ? -1.002 16.490 -7.107 1.00 0.00 ? 26 LEU A CA 3 ATOM 1025 C C . LEU A 1 26 ? -1.625 15.328 -7.883 1.00 0.00 ? 26 LEU A C 3 ATOM 1026 O O . LEU A 1 26 ? -1.063 14.869 -8.875 1.00 0.00 ? 26 LEU A O 3 ATOM 1027 C CB . LEU A 1 26 ? 0.505 16.348 -6.893 1.00 0.00 ? 26 LEU A CB 3 ATOM 1028 C CG . LEU A 1 26 ? 1.366 17.517 -7.377 1.00 0.00 ? 26 LEU A CG 3 ATOM 1029 C CD1 . LEU A 1 26 ? 2.727 17.525 -6.680 1.00 0.00 ? 26 LEU A CD1 3 ATOM 1030 C CD2 . LEU A 1 26 ? 1.503 17.503 -8.902 1.00 0.00 ? 26 LEU A CD2 3 ATOM 1031 N N . ASP A 1 27 ? -2.777 14.887 -7.401 1.00 0.00 ? 27 ASP A N 3 ATOM 1032 C CA . ASP A 1 27 ? -3.483 13.788 -8.038 1.00 0.00 ? 27 ASP A CA 3 ATOM 1033 C C . ASP A 1 27 ? -2.653 12.508 -7.903 1.00 0.00 ? 27 ASP A C 3 ATOM 1034 O O . ASP A 1 27 ? -2.609 11.694 -8.823 1.00 0.00 ? 27 ASP A O 3 ATOM 1035 C CB . ASP A 1 27 ? -3.695 14.058 -9.527 1.00 0.00 ? 27 ASP A CB 3 ATOM 1036 C CG . ASP A 1 27 ? -5.077 13.679 -10.064 1.00 0.00 ? 27 ASP A CG 3 ATOM 1037 O OD1 . ASP A 1 27 ? -6.075 14.370 -9.806 1.00 0.00 ? 27 ASP A OD1 3 ATOM 1038 O OD2 . ASP A 1 27 ? -5.108 12.610 -10.783 1.00 0.00 ? 27 ASP A OD2 3 ATOM 1039 N N . SER A 1 28 ? -2.015 12.375 -6.750 1.00 0.00 ? 28 SER A N 3 ATOM 1040 C CA . SER A 1 28 ? -1.189 11.209 -6.483 1.00 0.00 ? 28 SER A CA 3 ATOM 1041 C C . SER A 1 28 ? -1.999 10.155 -5.726 1.00 0.00 ? 28 SER A C 3 ATOM 1042 O O . SER A 1 28 ? -2.826 10.492 -4.881 1.00 0.00 ? 28 SER A O 3 ATOM 1043 C CB . SER A 1 28 ? 0.061 11.590 -5.689 1.00 0.00 ? 28 SER A CB 3 ATOM 1044 O OG . SER A 1 28 ? 0.605 10.477 -4.984 1.00 0.00 ? 28 SER A OG 3 ATOM 1045 N N . TYR A 1 29 ? -1.733 8.900 -6.058 1.00 0.00 ? 29 TYR A N 3 ATOM 1046 C CA . TYR A 1 29 ? -2.427 7.794 -5.419 1.00 0.00 ? 29 TYR A CA 3 ATOM 1047 C C . TYR A 1 29 ? -1.440 6.850 -4.732 1.00 0.00 ? 29 TYR A C 3 ATOM 1048 O O . TYR A 1 29 ? -0.349 6.605 -5.247 1.00 0.00 ? 29 TYR A O 3 ATOM 1049 C CB . TYR A 1 29 ? -3.138 7.039 -6.543 1.00 0.00 ? 29 TYR A CB 3 ATOM 1050 C CG . TYR A 1 29 ? -4.506 7.617 -6.915 1.00 0.00 ? 29 TYR A CG 3 ATOM 1051 C CD1 . TYR A 1 29 ? -4.597 8.608 -7.871 1.00 0.00 ? 29 TYR A CD1 3 ATOM 1052 C CD2 . TYR A 1 29 ? -5.646 7.148 -6.297 1.00 0.00 ? 29 TYR A CD2 3 ATOM 1053 C CE1 . TYR A 1 29 ? -5.884 9.155 -8.221 1.00 0.00 ? 29 TYR A CE1 3 ATOM 1054 C CE2 . TYR A 1 29 ? -6.932 7.694 -6.646 1.00 0.00 ? 29 TYR A CE2 3 ATOM 1055 C CZ . TYR A 1 29 ? -6.987 8.670 -7.592 1.00 0.00 ? 29 TYR A CZ 3 ATOM 1056 O OH . TYR A 1 29 ? -8.201 9.185 -7.921 1.00 0.00 ? 29 TYR A OH 3 ATOM 1057 N N . THR A 1 30 ? -1.857 6.346 -3.580 1.00 0.00 ? 30 THR A N 3 ATOM 1058 C CA . THR A 1 30 ? -1.022 5.434 -2.817 1.00 0.00 ? 30 THR A CA 3 ATOM 1059 C C . THR A 1 30 ? -1.819 4.192 -2.412 1.00 0.00 ? 30 THR A C 3 ATOM 1060 O O . THR A 1 30 ? -2.985 4.054 -2.777 1.00 0.00 ? 30 THR A O 3 ATOM 1061 C CB . THR A 1 30 ? -0.449 6.202 -1.626 1.00 0.00 ? 30 THR A CB 3 ATOM 1062 O OG1 . THR A 1 30 ? 0.286 5.220 -0.900 1.00 0.00 ? 30 THR A OG1 3 ATOM 1063 C CG2 . THR A 1 30 ? -1.531 6.659 -0.646 1.00 0.00 ? 30 THR A CG2 3 ATOM 1064 N N . CYS A 1 31 ? -1.158 3.322 -1.661 1.00 0.00 ? 31 CYS A N 3 ATOM 1065 C CA . CYS A 1 31 ? -1.792 2.097 -1.203 1.00 0.00 ? 31 CYS A CA 3 ATOM 1066 C C . CYS A 1 31 ? -1.069 1.627 0.060 1.00 0.00 ? 31 CYS A C 3 ATOM 1067 O O . CYS A 1 31 ? 0.137 1.825 0.201 1.00 0.00 ? 31 CYS A O 3 ATOM 1068 C CB . CYS A 1 31 ? -1.797 1.021 -2.291 1.00 0.00 ? 31 CYS A CB 3 ATOM 1069 S SG . CYS A 1 31 ? -3.409 0.778 -3.122 1.00 0.00 ? 31 CYS A SG 3 ATOM 1070 N N . ASN A 1 32 ? -1.837 1.012 0.948 1.00 0.00 ? 32 ASN A N 3 ATOM 1071 C CA . ASN A 1 32 ? -1.284 0.512 2.196 1.00 0.00 ? 32 ASN A CA 3 ATOM 1072 C C . ASN A 1 32 ? -1.478 -1.004 2.262 1.00 0.00 ? 32 ASN A C 3 ATOM 1073 O O . ASN A 1 32 ? -2.609 -1.490 2.253 1.00 0.00 ? 32 ASN A O 3 ATOM 1074 C CB . ASN A 1 32 ? -1.995 1.133 3.401 1.00 0.00 ? 32 ASN A CB 3 ATOM 1075 C CG . ASN A 1 32 ? -3.515 1.035 3.251 1.00 0.00 ? 32 ASN A CG 3 ATOM 1076 O OD1 . ASN A 1 32 ? -4.048 0.832 2.172 1.00 0.00 ? 32 ASN A OD1 3 ATOM 1077 N ND2 . ASN A 1 32 ? -4.180 1.190 4.392 1.00 0.00 ? 32 ASN A ND2 3 ATOM 1078 N N . CYS A 1 33 ? -0.359 -1.709 2.329 1.00 0.00 ? 33 CYS A N 3 ATOM 1079 C CA . CYS A 1 33 ? -0.391 -3.160 2.398 1.00 0.00 ? 33 CYS A CA 3 ATOM 1080 C C . CYS A 1 33 ? -0.595 -3.568 3.858 1.00 0.00 ? 33 CYS A C 3 ATOM 1081 O O . CYS A 1 33 ? -1.691 -3.426 4.399 1.00 0.00 ? 33 CYS A O 3 ATOM 1082 C CB . CYS A 1 33 ? 0.874 -3.782 1.803 1.00 0.00 ? 33 CYS A CB 3 ATOM 1083 S SG . CYS A 1 33 ? 0.713 -5.542 1.327 1.00 0.00 ? 33 CYS A SG 3 ATOM 1084 N N . VAL A 1 34 ? 0.477 -4.067 4.455 1.00 0.00 ? 34 VAL A N 3 ATOM 1085 C CA . VAL A 1 34 ? 0.429 -4.496 5.843 1.00 0.00 ? 34 VAL A CA 3 ATOM 1086 C C . VAL A 1 34 ? 1.819 -4.347 6.466 1.00 0.00 ? 34 VAL A C 3 ATOM 1087 O O . VAL A 1 34 ? 2.713 -3.753 5.866 1.00 0.00 ? 34 VAL A O 3 ATOM 1088 C CB . VAL A 1 34 ? -0.116 -5.923 5.932 1.00 0.00 ? 34 VAL A CB 3 ATOM 1089 C CG1 . VAL A 1 34 ? -1.633 -5.916 6.134 1.00 0.00 ? 34 VAL A CG1 3 ATOM 1090 C CG2 . VAL A 1 34 ? 0.267 -6.734 4.692 1.00 0.00 ? 34 VAL A CG2 3 ATOM 1091 N N . ILE A 1 35 ? 1.958 -4.900 7.663 1.00 0.00 ? 35 ILE A N 3 ATOM 1092 C CA . ILE A 1 35 ? 3.222 -4.837 8.375 1.00 0.00 ? 35 ILE A CA 3 ATOM 1093 C C . ILE A 1 35 ? 4.347 -5.316 7.451 1.00 0.00 ? 35 ILE A C 3 ATOM 1094 O O . ILE A 1 35 ? 4.184 -6.299 6.729 1.00 0.00 ? 35 ILE A O 3 ATOM 1095 C CB . ILE A 1 35 ? 3.137 -5.612 9.689 1.00 0.00 ? 35 ILE A CB 3 ATOM 1096 C CG1 . ILE A 1 35 ? 1.796 -5.365 10.385 1.00 0.00 ? 35 ILE A CG1 3 ATOM 1097 C CG2 . ILE A 1 35 ? 4.322 -5.282 10.598 1.00 0.00 ? 35 ILE A CG2 3 ATOM 1098 C CD1 . ILE A 1 35 ? 1.908 -5.610 11.891 1.00 0.00 ? 35 ILE A CD1 3 ATOM 1099 N N . GLY A 1 36 ? 5.459 -4.599 7.505 1.00 0.00 ? 36 GLY A N 3 ATOM 1100 C CA . GLY A 1 36 ? 6.607 -4.938 6.683 1.00 0.00 ? 36 GLY A CA 3 ATOM 1101 C C . GLY A 1 36 ? 6.191 -5.178 5.230 1.00 0.00 ? 36 GLY A C 3 ATOM 1102 O O . GLY A 1 36 ? 6.786 -6.003 4.538 1.00 0.00 ? 36 GLY A O 3 ATOM 1103 N N . TYR A 1 37 ? 5.173 -4.443 4.811 1.00 0.00 ? 37 TYR A N 3 ATOM 1104 C CA . TYR A 1 37 ? 4.670 -4.565 3.454 1.00 0.00 ? 37 TYR A CA 3 ATOM 1105 C C . TYR A 1 37 ? 4.100 -3.234 2.958 1.00 0.00 ? 37 TYR A C 3 ATOM 1106 O O . TYR A 1 37 ? 3.180 -2.685 3.562 1.00 0.00 ? 37 TYR A O 3 ATOM 1107 C CB . TYR A 1 37 ? 3.543 -5.598 3.514 1.00 0.00 ? 37 TYR A CB 3 ATOM 1108 C CG . TYR A 1 37 ? 3.989 -7.026 3.193 1.00 0.00 ? 37 TYR A CG 3 ATOM 1109 C CD1 . TYR A 1 37 ? 4.770 -7.724 4.093 1.00 0.00 ? 37 TYR A CD1 3 ATOM 1110 C CD2 . TYR A 1 37 ? 3.614 -7.616 2.004 1.00 0.00 ? 37 TYR A CD2 3 ATOM 1111 C CE1 . TYR A 1 37 ? 5.192 -9.067 3.791 1.00 0.00 ? 37 TYR A CE1 3 ATOM 1112 C CE2 . TYR A 1 37 ? 4.035 -8.960 1.701 1.00 0.00 ? 37 TYR A CE2 3 ATOM 1113 C CZ . TYR A 1 37 ? 4.804 -9.618 2.611 1.00 0.00 ? 37 TYR A CZ 3 ATOM 1114 O OH . TYR A 1 37 ? 5.201 -10.888 2.326 1.00 0.00 ? 37 TYR A OH 3 ATOM 1115 N N . SER A 1 38 ? 4.670 -2.753 1.862 1.00 0.00 ? 38 SER A N 3 ATOM 1116 C CA . SER A 1 38 ? 4.229 -1.499 1.278 1.00 0.00 ? 38 SER A CA 3 ATOM 1117 C C . SER A 1 38 ? 5.014 -1.214 -0.004 1.00 0.00 ? 38 SER A C 3 ATOM 1118 O O . SER A 1 38 ? 5.290 -2.124 -0.782 1.00 0.00 ? 38 SER A O 3 ATOM 1119 C CB . SER A 1 38 ? 4.394 -0.344 2.268 1.00 0.00 ? 38 SER A CB 3 ATOM 1120 O OG . SER A 1 38 ? 3.742 0.841 1.819 1.00 0.00 ? 38 SER A OG 3 ATOM 1121 N N . GLY A 1 39 ? 5.353 0.055 -0.183 1.00 0.00 ? 39 GLY A N 3 ATOM 1122 C CA . GLY A 1 39 ? 6.102 0.470 -1.356 1.00 0.00 ? 39 GLY A CA 3 ATOM 1123 C C . GLY A 1 39 ? 5.174 1.078 -2.412 1.00 0.00 ? 39 GLY A C 3 ATOM 1124 O O . GLY A 1 39 ? 5.320 0.804 -3.602 1.00 0.00 ? 39 GLY A O 3 ATOM 1125 N N . ASP A 1 40 ? 4.240 1.887 -1.937 1.00 0.00 ? 40 ASP A N 3 ATOM 1126 C CA . ASP A 1 40 ? 3.288 2.534 -2.823 1.00 0.00 ? 40 ASP A CA 3 ATOM 1127 C C . ASP A 1 40 ? 2.082 1.616 -3.028 1.00 0.00 ? 40 ASP A C 3 ATOM 1128 O O . ASP A 1 40 ? 0.952 2.085 -3.146 1.00 0.00 ? 40 ASP A O 3 ATOM 1129 C CB . ASP A 1 40 ? 3.911 2.809 -4.193 1.00 0.00 ? 40 ASP A CB 3 ATOM 1130 C CG . ASP A 1 40 ? 3.278 3.961 -4.973 1.00 0.00 ? 40 ASP A CG 3 ATOM 1131 O OD1 . ASP A 1 40 ? 3.226 5.106 -4.494 1.00 0.00 ? 40 ASP A OD1 3 ATOM 1132 O OD2 . ASP A 1 40 ? 2.816 3.646 -6.136 1.00 0.00 ? 40 ASP A OD2 3 ATOM 1133 N N . ARG A 1 41 ? 2.365 0.322 -3.065 1.00 0.00 ? 41 ARG A N 3 ATOM 1134 C CA . ARG A 1 41 ? 1.316 -0.667 -3.253 1.00 0.00 ? 41 ARG A CA 3 ATOM 1135 C C . ARG A 1 41 ? 1.397 -1.740 -2.166 1.00 0.00 ? 41 ARG A C 3 ATOM 1136 O O . ARG A 1 41 ? 0.723 -1.641 -1.140 1.00 0.00 ? 41 ARG A O 3 ATOM 1137 C CB . ARG A 1 41 ? 1.429 -1.333 -4.626 1.00 0.00 ? 41 ARG A CB 3 ATOM 1138 C CG . ARG A 1 41 ? 1.245 -0.311 -5.749 1.00 0.00 ? 41 ARG A CG 3 ATOM 1139 C CD . ARG A 1 41 ? 1.000 -1.006 -7.090 1.00 0.00 ? 41 ARG A CD 3 ATOM 1140 N NE . ARG A 1 41 ? 1.255 -0.064 -8.203 1.00 0.00 ? 41 ARG A NE 3 ATOM 1141 C CZ . ARG A 1 41 ? 2.385 -0.051 -8.939 1.00 0.00 ? 41 ARG A CZ 3 ATOM 1142 N NH1 . ARG A 1 41 ? 2.511 -0.857 -10.015 1.00 0.00 ? 41 ARG A NH1 3 ATOM 1143 N NH2 . ARG A 1 41 ? 3.366 0.762 -8.594 1.00 0.00 ? 41 ARG A NH2 3 ATOM 1144 N N . CYS A 1 42 ? 2.227 -2.740 -2.425 1.00 0.00 ? 42 CYS A N 3 ATOM 1145 C CA . CYS A 1 42 ? 2.405 -3.830 -1.481 1.00 0.00 ? 42 CYS A CA 3 ATOM 1146 C C . CYS A 1 42 ? 3.358 -4.853 -2.102 1.00 0.00 ? 42 CYS A C 3 ATOM 1147 O O . CYS A 1 42 ? 3.200 -6.056 -1.898 1.00 0.00 ? 42 CYS A O 3 ATOM 1148 C CB . CYS A 1 42 ? 1.067 -4.461 -1.088 1.00 0.00 ? 42 CYS A CB 3 ATOM 1149 S SG . CYS A 1 42 ? 1.178 -5.752 0.206 1.00 0.00 ? 42 CYS A SG 3 ATOM 1150 N N . GLN A 1 43 ? 4.324 -4.338 -2.846 1.00 0.00 ? 43 GLN A N 3 ATOM 1151 C CA . GLN A 1 43 ? 5.302 -5.192 -3.499 1.00 0.00 ? 43 GLN A CA 3 ATOM 1152 C C . GLN A 1 43 ? 6.584 -5.264 -2.665 1.00 0.00 ? 43 GLN A C 3 ATOM 1153 O O . GLN A 1 43 ? 7.359 -6.209 -2.792 1.00 0.00 ? 43 GLN A O 3 ATOM 1154 C CB . GLN A 1 43 ? 5.598 -4.702 -4.918 1.00 0.00 ? 43 GLN A CB 3 ATOM 1155 C CG . GLN A 1 43 ? 6.779 -3.730 -4.928 1.00 0.00 ? 43 GLN A CG 3 ATOM 1156 C CD . GLN A 1 43 ? 6.571 -2.627 -5.968 1.00 0.00 ? 43 GLN A CD 3 ATOM 1157 O OE1 . GLN A 1 43 ? 6.814 -2.800 -7.151 1.00 0.00 ? 43 GLN A OE1 3 ATOM 1158 N NE2 . GLN A 1 43 ? 6.110 -1.486 -5.462 1.00 0.00 ? 43 GLN A NE2 3 ATOM 1159 N N . THR A 1 44 ? 6.766 -4.249 -1.832 1.00 0.00 ? 44 THR A N 3 ATOM 1160 C CA . THR A 1 44 ? 7.941 -4.185 -0.977 1.00 0.00 ? 44 THR A CA 3 ATOM 1161 C C . THR A 1 44 ? 7.618 -4.735 0.413 1.00 0.00 ? 44 THR A C 3 ATOM 1162 O O . THR A 1 44 ? 6.989 -4.055 1.222 1.00 0.00 ? 44 THR A O 3 ATOM 1163 C CB . THR A 1 44 ? 8.435 -2.738 -0.961 1.00 0.00 ? 44 THR A CB 3 ATOM 1164 O OG1 . THR A 1 44 ? 8.450 -2.360 -2.334 1.00 0.00 ? 44 THR A OG1 3 ATOM 1165 C CG2 . THR A 1 44 ? 9.896 -2.622 -0.524 1.00 0.00 ? 44 THR A CG2 3 ATOM 1166 N N . ARG A 1 45 ? 8.064 -5.960 0.650 1.00 0.00 ? 45 ARG A N 3 ATOM 1167 C CA . ARG A 1 45 ? 7.831 -6.607 1.929 1.00 0.00 ? 45 ARG A CA 3 ATOM 1168 C C . ARG A 1 45 ? 9.102 -6.573 2.782 1.00 0.00 ? 45 ARG A C 3 ATOM 1169 O O . ARG A 1 45 ? 10.056 -7.298 2.508 1.00 0.00 ? 45 ARG A O 3 ATOM 1170 C CB . ARG A 1 45 ? 7.393 -8.060 1.739 1.00 0.00 ? 45 ARG A CB 3 ATOM 1171 C CG . ARG A 1 45 ? 7.890 -8.614 0.402 1.00 0.00 ? 45 ARG A CG 3 ATOM 1172 C CD . ARG A 1 45 ? 7.728 -10.133 0.342 1.00 0.00 ? 45 ARG A CD 3 ATOM 1173 N NE . ARG A 1 45 ? 6.371 -10.479 -0.135 1.00 0.00 ? 45 ARG A NE 3 ATOM 1174 C CZ . ARG A 1 45 ? 6.103 -10.982 -1.360 1.00 0.00 ? 45 ARG A CZ 3 ATOM 1175 N NH1 . ARG A 1 45 ? 5.889 -10.158 -2.406 1.00 0.00 ? 45 ARG A NH1 3 ATOM 1176 N NH2 . ARG A 1 45 ? 6.056 -12.293 -1.517 1.00 0.00 ? 45 ARG A NH2 3 ATOM 1177 N N . ASP A 1 46 ? 9.073 -5.721 3.797 1.00 0.00 ? 46 ASP A N 3 ATOM 1178 C CA . ASP A 1 46 ? 10.210 -5.582 4.689 1.00 0.00 ? 46 ASP A CA 3 ATOM 1179 C C . ASP A 1 46 ? 10.800 -6.964 4.976 1.00 0.00 ? 46 ASP A C 3 ATOM 1180 O O . ASP A 1 46 ? 11.660 -7.442 4.238 1.00 0.00 ? 46 ASP A O 3 ATOM 1181 C CB . ASP A 1 46 ? 9.789 -4.962 6.023 1.00 0.00 ? 46 ASP A CB 3 ATOM 1182 C CG . ASP A 1 46 ? 10.859 -4.997 7.117 1.00 0.00 ? 46 ASP A CG 3 ATOM 1183 O OD1 . ASP A 1 46 ? 11.933 -4.394 6.981 1.00 0.00 ? 46 ASP A OD1 3 ATOM 1184 O OD2 . ASP A 1 46 ? 10.547 -5.690 8.161 1.00 0.00 ? 46 ASP A OD2 3 ATOM 1185 N N . LEU A 1 47 ? 10.313 -7.570 6.049 1.00 0.00 ? 47 LEU A N 3 ATOM 1186 C CA . LEU A 1 47 ? 10.783 -8.887 6.443 1.00 0.00 ? 47 LEU A CA 3 ATOM 1187 C C . LEU A 1 47 ? 9.580 -9.809 6.654 1.00 0.00 ? 47 LEU A C 3 ATOM 1188 O O . LEU A 1 47 ? 9.554 -10.928 6.143 1.00 0.00 ? 47 LEU A O 3 ATOM 1189 C CB . LEU A 1 47 ? 11.701 -8.788 7.661 1.00 0.00 ? 47 LEU A CB 3 ATOM 1190 C CG . LEU A 1 47 ? 12.774 -7.698 7.604 1.00 0.00 ? 47 LEU A CG 3 ATOM 1191 C CD1 . LEU A 1 47 ? 13.145 -7.219 9.009 1.00 0.00 ? 47 LEU A CD1 3 ATOM 1192 C CD2 . LEU A 1 47 ? 13.999 -8.174 6.820 1.00 0.00 ? 47 LEU A CD2 3 ATOM 1193 N N . ARG A 1 48 ? 8.613 -9.306 7.409 1.00 0.00 ? 48 ARG A N 3 ATOM 1194 C CA . ARG A 1 48 ? 7.411 -10.070 7.693 1.00 0.00 ? 48 ARG A CA 3 ATOM 1195 C C . ARG A 1 48 ? 7.639 -10.988 8.896 1.00 0.00 ? 48 ARG A C 3 ATOM 1196 O O . ARG A 1 48 ? 7.367 -12.185 8.827 1.00 0.00 ? 48 ARG A O 3 ATOM 1197 C CB . ARG A 1 48 ? 6.997 -10.915 6.487 1.00 0.00 ? 48 ARG A CB 3 ATOM 1198 C CG . ARG A 1 48 ? 5.489 -11.177 6.494 1.00 0.00 ? 48 ARG A CG 3 ATOM 1199 C CD . ARG A 1 48 ? 5.103 -12.178 5.403 1.00 0.00 ? 48 ARG A CD 3 ATOM 1200 N NE . ARG A 1 48 ? 3.632 -12.341 5.364 1.00 0.00 ? 48 ARG A NE 3 ATOM 1201 C CZ . ARG A 1 48 ? 2.937 -12.677 4.256 1.00 0.00 ? 48 ARG A CZ 3 ATOM 1202 N NH1 . ARG A 1 48 ? 2.740 -13.973 3.939 1.00 0.00 ? 48 ARG A NH1 3 ATOM 1203 N NH2 . ARG A 1 48 ? 2.452 -11.717 3.490 1.00 0.00 ? 48 ARG A NH2 3 ATOM 1204 N N . TRP A 1 49 ? 8.135 -10.391 9.970 1.00 0.00 ? 49 TRP A N 3 ATOM 1205 C CA . TRP A 1 49 ? 8.402 -11.140 11.186 1.00 0.00 ? 49 TRP A CA 3 ATOM 1206 C C . TRP A 1 49 ? 7.072 -11.695 11.700 1.00 0.00 ? 49 TRP A C 3 ATOM 1207 O O . TRP A 1 49 ? 7.054 -12.586 12.548 1.00 0.00 ? 49 TRP A O 3 ATOM 1208 C CB . TRP A 1 49 ? 9.126 -10.273 12.216 1.00 0.00 ? 49 TRP A CB 3 ATOM 1209 C CG . TRP A 1 49 ? 8.738 -8.793 12.167 1.00 0.00 ? 49 TRP A CG 3 ATOM 1210 C CD1 . TRP A 1 49 ? 7.512 -8.266 12.062 1.00 0.00 ? 49 TRP A CD1 3 ATOM 1211 C CD2 . TRP A 1 49 ? 9.638 -7.667 12.225 1.00 0.00 ? 49 TRP A CD2 3 ATOM 1212 N NE1 . TRP A 1 49 ? 7.554 -6.885 12.049 1.00 0.00 ? 49 TRP A NE1 3 ATOM 1213 C CE2 . TRP A 1 49 ? 8.889 -6.511 12.152 1.00 0.00 ? 49 TRP A CE2 3 ATOM 1214 C CE3 . TRP A 1 49 ? 11.039 -7.625 12.337 1.00 0.00 ? 49 TRP A CE3 3 ATOM 1215 C CZ2 . TRP A 1 49 ? 9.451 -5.229 12.181 1.00 0.00 ? 49 TRP A CZ2 3 ATOM 1216 C CZ3 . TRP A 1 49 ? 11.585 -6.337 12.366 1.00 0.00 ? 49 TRP A CZ3 3 ATOM 1217 C CH2 . TRP A 1 49 ? 10.845 -5.162 12.292 1.00 0.00 ? 49 TRP A CH2 3 ATOM 1218 N N . TRP A 1 50 ? 5.992 -11.146 11.166 1.00 0.00 ? 50 TRP A N 3 ATOM 1219 C CA . TRP A 1 50 ? 4.661 -11.575 11.561 1.00 0.00 ? 50 TRP A CA 3 ATOM 1220 C C . TRP A 1 50 ? 4.323 -12.848 10.780 1.00 0.00 ? 50 TRP A C 3 ATOM 1221 O O . TRP A 1 50 ? 3.635 -12.790 9.761 1.00 0.00 ? 50 TRP A O 3 ATOM 1222 C CB . TRP A 1 50 ? 3.640 -10.456 11.351 1.00 0.00 ? 50 TRP A CB 3 ATOM 1223 C CG . TRP A 1 50 ? 3.820 -9.685 10.042 1.00 0.00 ? 50 TRP A CG 3 ATOM 1224 C CD1 . TRP A 1 50 ? 4.683 -8.697 9.780 1.00 0.00 ? 50 TRP A CD1 3 ATOM 1225 C CD2 . TRP A 1 50 ? 3.080 -9.882 8.820 1.00 0.00 ? 50 TRP A CD2 3 ATOM 1226 N NE1 . TRP A 1 50 ? 4.556 -8.242 8.483 1.00 0.00 ? 50 TRP A NE1 3 ATOM 1227 C CE2 . TRP A 1 50 ? 3.550 -8.987 7.880 1.00 0.00 ? 50 TRP A CE2 3 ATOM 1228 C CE3 . TRP A 1 50 ? 2.047 -10.787 8.516 1.00 0.00 ? 50 TRP A CE3 3 ATOM 1229 C CZ2 . TRP A 1 50 ? 3.045 -8.909 6.576 1.00 0.00 ? 50 TRP A CZ2 3 ATOM 1230 C CZ3 . TRP A 1 50 ? 1.555 -10.697 7.209 1.00 0.00 ? 50 TRP A CZ3 3 ATOM 1231 C CH2 . TRP A 1 50 ? 2.017 -9.801 6.252 1.00 0.00 ? 50 TRP A CH2 3 ATOM 1232 N N . GLU A 1 51 ? 4.822 -13.965 11.287 1.00 0.00 ? 51 GLU A N 3 ATOM 1233 C CA . GLU A 1 51 ? 4.581 -15.249 10.650 1.00 0.00 ? 51 GLU A CA 3 ATOM 1234 C C . GLU A 1 51 ? 4.352 -16.331 11.707 1.00 0.00 ? 51 GLU A C 3 ATOM 1235 O O . GLU A 1 51 ? 3.328 -17.012 11.690 1.00 0.00 ? 51 GLU A O 3 ATOM 1236 C CB . GLU A 1 51 ? 5.737 -15.624 9.721 1.00 0.00 ? 51 GLU A CB 3 ATOM 1237 C CG . GLU A 1 51 ? 5.697 -14.797 8.434 1.00 0.00 ? 51 GLU A CG 3 ATOM 1238 C CD . GLU A 1 51 ? 4.879 -15.506 7.352 1.00 0.00 ? 51 GLU A CD 3 ATOM 1239 O OE1 . GLU A 1 51 ? 5.431 -16.313 6.588 1.00 0.00 ? 51 GLU A OE1 3 ATOM 1240 O OE2 . GLU A 1 51 ? 3.630 -15.194 7.323 1.00 0.00 ? 51 GLU A OE2 3 ATOM 1241 N N . LEU A 1 52 ? 5.323 -16.454 12.601 1.00 0.00 ? 52 LEU A N 3 ATOM 1242 C CA . LEU A 1 52 ? 5.240 -17.443 13.663 1.00 0.00 ? 52 LEU A CA 3 ATOM 1243 C C . LEU A 1 52 ? 5.258 -16.732 15.018 1.00 0.00 ? 52 LEU A C 3 ATOM 1244 O O . LEU A 1 52 ? 5.929 -15.713 15.178 1.00 0.00 ? 52 LEU A O 3 ATOM 1245 C CB . LEU A 1 52 ? 6.341 -18.494 13.504 1.00 0.00 ? 52 LEU A CB 3 ATOM 1246 C CG . LEU A 1 52 ? 6.174 -19.468 12.336 1.00 0.00 ? 52 LEU A CG 3 ATOM 1247 C CD1 . LEU A 1 52 ? 7.526 -19.791 11.696 1.00 0.00 ? 52 LEU A CD1 3 ATOM 1248 C CD2 . LEU A 1 52 ? 5.433 -20.731 12.779 1.00 0.00 ? 52 LEU A CD2 3 ATOM 1249 N N . ARG A 1 53 ? 4.516 -17.298 15.957 1.00 0.00 ? 53 ARG A N 3 ATOM 1250 C CA . ARG A 1 53 ? 4.438 -16.730 17.292 1.00 0.00 ? 53 ARG A CA 3 ATOM 1251 C C . ARG A 1 53 ? 4.176 -15.224 17.216 1.00 0.00 ? 53 ARG A C 3 ATOM 1252 O O . ARG A 1 53 ? 5.108 -14.425 17.291 1.00 0.00 ? 53 ARG A O 3 ATOM 1253 C CB . ARG A 1 53 ? 5.731 -16.977 18.071 1.00 0.00 ? 53 ARG A CB 3 ATOM 1254 C CG . ARG A 1 53 ? 5.906 -18.464 18.386 1.00 0.00 ? 53 ARG A CG 3 ATOM 1255 C CD . ARG A 1 53 ? 7.188 -18.709 19.181 1.00 0.00 ? 53 ARG A CD 3 ATOM 1256 N NE . ARG A 1 53 ? 7.016 -18.242 20.576 1.00 0.00 ? 53 ARG A NE 3 ATOM 1257 C CZ . ARG A 1 53 ? 6.643 -19.039 21.600 1.00 0.00 ? 53 ARG A CZ 3 ATOM 1258 N NH1 . ARG A 1 53 ? 7.567 -19.728 22.304 1.00 0.00 ? 53 ARG A NH1 3 ATOM 1259 N NH2 . ARG A 1 53 ? 5.363 -19.133 21.902 1.00 0.00 ? 53 ARG A NH2 3 ATOM 1260 O OXT . ARG A 1 53 ? 2.939 -14.892 17.069 1.00 0.00 ? 53 ARG A OXT 3 ATOM 1261 N N . ASN A 1 1 ? -2.871 16.824 1.441 1.00 0.00 ? 1 ASN A N 4 ATOM 1262 C CA . ASN A 1 1 ? -4.089 16.266 2.004 1.00 0.00 ? 1 ASN A CA 4 ATOM 1263 C C . ASN A 1 1 ? -4.246 14.818 1.535 1.00 0.00 ? 1 ASN A C 4 ATOM 1264 O O . ASN A 1 1 ? -3.668 14.425 0.522 1.00 0.00 ? 1 ASN A O 4 ATOM 1265 C CB . ASN A 1 1 ? -5.320 17.049 1.544 1.00 0.00 ? 1 ASN A CB 4 ATOM 1266 C CG . ASN A 1 1 ? -5.311 18.470 2.113 1.00 0.00 ? 1 ASN A CG 4 ATOM 1267 O OD1 . ASN A 1 1 ? -4.672 19.370 1.592 1.00 0.00 ? 1 ASN A OD1 4 ATOM 1268 N ND2 . ASN A 1 1 ? -6.051 18.618 3.206 1.00 0.00 ? 1 ASN A ND2 4 ATOM 1269 N N . SER A 1 2 ? -5.030 14.066 2.291 1.00 0.00 ? 2 SER A N 4 ATOM 1270 C CA . SER A 1 2 ? -5.271 12.671 1.964 1.00 0.00 ? 2 SER A CA 4 ATOM 1271 C C . SER A 1 2 ? -6.740 12.468 1.584 1.00 0.00 ? 2 SER A C 4 ATOM 1272 O O . SER A 1 2 ? -7.634 13.003 2.236 1.00 0.00 ? 2 SER A O 4 ATOM 1273 C CB . SER A 1 2 ? -4.896 11.758 3.134 1.00 0.00 ? 2 SER A CB 4 ATOM 1274 O OG . SER A 1 2 ? -4.576 10.439 2.702 1.00 0.00 ? 2 SER A OG 4 ATOM 1275 N N . TYR A 1 3 ? -6.942 11.694 0.528 1.00 0.00 ? 3 TYR A N 4 ATOM 1276 C CA . TYR A 1 3 ? -8.287 11.414 0.051 1.00 0.00 ? 3 TYR A CA 4 ATOM 1277 C C . TYR A 1 3 ? -8.396 9.978 -0.469 1.00 0.00 ? 3 TYR A C 4 ATOM 1278 O O . TYR A 1 3 ? -7.613 9.562 -1.321 1.00 0.00 ? 3 TYR A O 4 ATOM 1279 C CB . TYR A 1 3 ? -8.535 12.383 -1.107 1.00 0.00 ? 3 TYR A CB 4 ATOM 1280 C CG . TYR A 1 3 ? -9.816 12.101 -1.892 1.00 0.00 ? 3 TYR A CG 4 ATOM 1281 C CD1 . TYR A 1 3 ? -11.041 12.447 -1.359 1.00 0.00 ? 3 TYR A CD1 4 ATOM 1282 C CD2 . TYR A 1 3 ? -9.749 11.497 -3.130 1.00 0.00 ? 3 TYR A CD2 4 ATOM 1283 C CE1 . TYR A 1 3 ? -12.249 12.182 -2.098 1.00 0.00 ? 3 TYR A CE1 4 ATOM 1284 C CE2 . TYR A 1 3 ? -10.955 11.231 -3.868 1.00 0.00 ? 3 TYR A CE2 4 ATOM 1285 C CZ . TYR A 1 3 ? -12.146 11.587 -3.316 1.00 0.00 ? 3 TYR A CZ 4 ATOM 1286 O OH . TYR A 1 3 ? -13.286 11.335 -4.015 1.00 0.00 ? 3 TYR A OH 4 ATOM 1287 N N . PRO A 1 4 ? -9.398 9.244 0.082 1.00 0.00 ? 4 PRO A N 4 ATOM 1288 C CA . PRO A 1 4 ? -9.622 7.865 -0.316 1.00 0.00 ? 4 PRO A CA 4 ATOM 1289 C C . PRO A 1 4 ? -10.279 7.792 -1.696 1.00 0.00 ? 4 PRO A C 4 ATOM 1290 O O . PRO A 1 4 ? -11.482 8.009 -1.828 1.00 0.00 ? 4 PRO A O 4 ATOM 1291 C CB . PRO A 1 4 ? -10.485 7.270 0.784 1.00 0.00 ? 4 PRO A CB 4 ATOM 1292 C CG . PRO A 1 4 ? -11.098 8.453 1.516 1.00 0.00 ? 4 PRO A CG 4 ATOM 1293 C CD . PRO A 1 4 ? -10.345 9.704 1.095 1.00 0.00 ? 4 PRO A CD 4 ATOM 1294 N N . GLY A 1 5 ? -9.459 7.485 -2.692 1.00 0.00 ? 5 GLY A N 4 ATOM 1295 C CA . GLY A 1 5 ? -9.945 7.380 -4.058 1.00 0.00 ? 5 GLY A CA 4 ATOM 1296 C C . GLY A 1 5 ? -9.105 6.389 -4.864 1.00 0.00 ? 5 GLY A C 4 ATOM 1297 O O . GLY A 1 5 ? -7.955 6.123 -4.522 1.00 0.00 ? 5 GLY A O 4 ATOM 1298 N N . CYS A 1 6 ? -9.716 5.869 -5.920 1.00 0.00 ? 6 CYS A N 4 ATOM 1299 C CA . CYS A 1 6 ? -9.037 4.912 -6.778 1.00 0.00 ? 6 CYS A CA 4 ATOM 1300 C C . CYS A 1 6 ? -10.018 4.465 -7.866 1.00 0.00 ? 6 CYS A C 4 ATOM 1301 O O . CYS A 1 6 ? -10.840 3.580 -7.639 1.00 0.00 ? 6 CYS A O 4 ATOM 1302 C CB . CYS A 1 6 ? -8.489 3.725 -5.982 1.00 0.00 ? 6 CYS A CB 4 ATOM 1303 S SG . CYS A 1 6 ? -6.696 3.804 -5.624 1.00 0.00 ? 6 CYS A SG 4 ATOM 1304 N N . PRO A 1 7 ? -9.890 5.114 -9.055 1.00 0.00 ? 7 PRO A N 4 ATOM 1305 C CA . PRO A 1 7 ? -10.754 4.794 -10.179 1.00 0.00 ? 7 PRO A CA 4 ATOM 1306 C C . PRO A 1 7 ? -10.348 3.466 -10.821 1.00 0.00 ? 7 PRO A C 4 ATOM 1307 O O . PRO A 1 7 ? -9.329 2.882 -10.456 1.00 0.00 ? 7 PRO A O 4 ATOM 1308 C CB . PRO A 1 7 ? -10.625 5.978 -11.125 1.00 0.00 ? 7 PRO A CB 4 ATOM 1309 C CG . PRO A 1 7 ? -9.347 6.695 -10.721 1.00 0.00 ? 7 PRO A CG 4 ATOM 1310 C CD . PRO A 1 7 ? -8.926 6.168 -9.360 1.00 0.00 ? 7 PRO A CD 4 ATOM 1311 N N . SER A 1 8 ? -11.165 3.029 -11.768 1.00 0.00 ? 8 SER A N 4 ATOM 1312 C CA . SER A 1 8 ? -10.902 1.781 -12.464 1.00 0.00 ? 8 SER A CA 4 ATOM 1313 C C . SER A 1 8 ? -9.472 1.776 -13.008 1.00 0.00 ? 8 SER A C 4 ATOM 1314 O O . SER A 1 8 ? -8.870 0.715 -13.172 1.00 0.00 ? 8 SER A O 4 ATOM 1315 C CB . SER A 1 8 ? -11.901 1.567 -13.603 1.00 0.00 ? 8 SER A CB 4 ATOM 1316 O OG . SER A 1 8 ? -13.248 1.538 -13.134 1.00 0.00 ? 8 SER A OG 4 ATOM 1317 N N . SER A 1 9 ? -8.967 2.973 -13.271 1.00 0.00 ? 9 SER A N 4 ATOM 1318 C CA . SER A 1 9 ? -7.619 3.118 -13.790 1.00 0.00 ? 9 SER A CA 4 ATOM 1319 C C . SER A 1 9 ? -6.601 2.682 -12.735 1.00 0.00 ? 9 SER A C 4 ATOM 1320 O O . SER A 1 9 ? -5.446 2.406 -13.058 1.00 0.00 ? 9 SER A O 4 ATOM 1321 C CB . SER A 1 9 ? -7.348 4.561 -14.223 1.00 0.00 ? 9 SER A CB 4 ATOM 1322 O OG . SER A 1 9 ? -6.026 4.727 -14.730 1.00 0.00 ? 9 SER A OG 4 ATOM 1323 N N . TYR A 1 10 ? -7.065 2.630 -11.496 1.00 0.00 ? 10 TYR A N 4 ATOM 1324 C CA . TYR A 1 10 ? -6.210 2.231 -10.390 1.00 0.00 ? 10 TYR A CA 4 ATOM 1325 C C . TYR A 1 10 ? -6.800 1.033 -9.646 1.00 0.00 ? 10 TYR A C 4 ATOM 1326 O O . TYR A 1 10 ? -6.943 1.065 -8.425 1.00 0.00 ? 10 TYR A O 4 ATOM 1327 C CB . TYR A 1 10 ? -6.157 3.432 -9.443 1.00 0.00 ? 10 TYR A CB 4 ATOM 1328 C CG . TYR A 1 10 ? -5.314 4.597 -9.963 1.00 0.00 ? 10 TYR A CG 4 ATOM 1329 C CD1 . TYR A 1 10 ? -5.883 5.546 -10.787 1.00 0.00 ? 10 TYR A CD1 4 ATOM 1330 C CD2 . TYR A 1 10 ? -3.986 4.702 -9.603 1.00 0.00 ? 10 TYR A CD2 4 ATOM 1331 C CE1 . TYR A 1 10 ? -5.090 6.644 -11.276 1.00 0.00 ? 10 TYR A CE1 4 ATOM 1332 C CE2 . TYR A 1 10 ? -3.193 5.800 -10.092 1.00 0.00 ? 10 TYR A CE2 4 ATOM 1333 C CZ . TYR A 1 10 ? -3.782 6.718 -10.903 1.00 0.00 ? 10 TYR A CZ 4 ATOM 1334 O OH . TYR A 1 10 ? -3.034 7.754 -11.364 1.00 0.00 ? 10 TYR A OH 4 ATOM 1335 N N . ASP A 1 11 ? -7.128 0.002 -10.413 1.00 0.00 ? 11 ASP A N 4 ATOM 1336 C CA . ASP A 1 11 ? -7.698 -1.205 -9.839 1.00 0.00 ? 11 ASP A CA 4 ATOM 1337 C C . ASP A 1 11 ? -6.638 -2.306 -9.818 1.00 0.00 ? 11 ASP A C 4 ATOM 1338 O O . ASP A 1 11 ? -6.902 -3.435 -10.226 1.00 0.00 ? 11 ASP A O 4 ATOM 1339 C CB . ASP A 1 11 ? -8.881 -1.703 -10.673 1.00 0.00 ? 11 ASP A CB 4 ATOM 1340 C CG . ASP A 1 11 ? -9.708 -2.814 -10.023 1.00 0.00 ? 11 ASP A CG 4 ATOM 1341 O OD1 . ASP A 1 11 ? -10.310 -2.478 -8.933 1.00 0.00 ? 11 ASP A OD1 4 ATOM 1342 O OD2 . ASP A 1 11 ? -9.775 -3.941 -10.532 1.00 0.00 ? 11 ASP A OD2 4 ATOM 1343 N N . GLY A 1 12 ? -5.459 -1.938 -9.339 1.00 0.00 ? 12 GLY A N 4 ATOM 1344 C CA . GLY A 1 12 ? -4.355 -2.881 -9.260 1.00 0.00 ? 12 GLY A CA 4 ATOM 1345 C C . GLY A 1 12 ? -3.068 -2.183 -8.816 1.00 0.00 ? 12 GLY A C 4 ATOM 1346 O O . GLY A 1 12 ? -1.984 -2.513 -9.290 1.00 0.00 ? 12 GLY A O 4 ATOM 1347 N N . TYR A 1 13 ? -3.232 -1.229 -7.910 1.00 0.00 ? 13 TYR A N 4 ATOM 1348 C CA . TYR A 1 13 ? -2.097 -0.481 -7.397 1.00 0.00 ? 13 TYR A CA 4 ATOM 1349 C C . TYR A 1 13 ? -1.652 -1.023 -6.037 1.00 0.00 ? 13 TYR A C 4 ATOM 1350 O O . TYR A 1 13 ? -0.564 -0.702 -5.562 1.00 0.00 ? 13 TYR A O 4 ATOM 1351 C CB . TYR A 1 13 ? -2.583 0.959 -7.225 1.00 0.00 ? 13 TYR A CB 4 ATOM 1352 C CG . TYR A 1 13 ? -1.458 1.994 -7.178 1.00 0.00 ? 13 TYR A CG 4 ATOM 1353 C CD1 . TYR A 1 13 ? -0.653 2.089 -6.059 1.00 0.00 ? 13 TYR A CD1 4 ATOM 1354 C CD2 . TYR A 1 13 ? -1.248 2.834 -8.253 1.00 0.00 ? 13 TYR A CD2 4 ATOM 1355 C CE1 . TYR A 1 13 ? 0.405 3.064 -6.016 1.00 0.00 ? 13 TYR A CE1 4 ATOM 1356 C CE2 . TYR A 1 13 ? -0.189 3.807 -8.208 1.00 0.00 ? 13 TYR A CE2 4 ATOM 1357 C CZ . TYR A 1 13 ? 0.586 3.875 -7.092 1.00 0.00 ? 13 TYR A CZ 4 ATOM 1358 O OH . TYR A 1 13 ? 1.586 4.796 -7.050 1.00 0.00 ? 13 TYR A OH 4 ATOM 1359 N N . CYS A 1 14 ? -2.516 -1.837 -5.449 1.00 0.00 ? 14 CYS A N 4 ATOM 1360 C CA . CYS A 1 14 ? -2.227 -2.428 -4.153 1.00 0.00 ? 14 CYS A CA 4 ATOM 1361 C C . CYS A 1 14 ? -1.908 -3.909 -4.361 1.00 0.00 ? 14 CYS A C 4 ATOM 1362 O O . CYS A 1 14 ? -2.261 -4.487 -5.387 1.00 0.00 ? 14 CYS A O 4 ATOM 1363 C CB . CYS A 1 14 ? -3.381 -2.225 -3.169 1.00 0.00 ? 14 CYS A CB 4 ATOM 1364 S SG . CYS A 1 14 ? -4.262 -0.629 -3.337 1.00 0.00 ? 14 CYS A SG 4 ATOM 1365 N N . LEU A 1 15 ? -1.242 -4.484 -3.369 1.00 0.00 ? 15 LEU A N 4 ATOM 1366 C CA . LEU A 1 15 ? -0.872 -5.886 -3.429 1.00 0.00 ? 15 LEU A CA 4 ATOM 1367 C C . LEU A 1 15 ? -1.864 -6.708 -2.605 1.00 0.00 ? 15 LEU A C 4 ATOM 1368 O O . LEU A 1 15 ? -2.960 -6.240 -2.300 1.00 0.00 ? 15 LEU A O 4 ATOM 1369 C CB . LEU A 1 15 ? 0.586 -6.075 -3.004 1.00 0.00 ? 15 LEU A CB 4 ATOM 1370 C CG . LEU A 1 15 ? 1.638 -5.820 -4.085 1.00 0.00 ? 15 LEU A CG 4 ATOM 1371 C CD1 . LEU A 1 15 ? 2.512 -7.057 -4.300 1.00 0.00 ? 15 LEU A CD1 4 ATOM 1372 C CD2 . LEU A 1 15 ? 0.985 -5.346 -5.386 1.00 0.00 ? 15 LEU A CD2 4 ATOM 1373 N N . ASN A 1 16 ? -1.443 -7.918 -2.266 1.00 0.00 ? 16 ASN A N 4 ATOM 1374 C CA . ASN A 1 16 ? -2.283 -8.810 -1.481 1.00 0.00 ? 16 ASN A CA 4 ATOM 1375 C C . ASN A 1 16 ? -2.600 -8.151 -0.138 1.00 0.00 ? 16 ASN A C 4 ATOM 1376 O O . ASN A 1 16 ? -3.491 -8.602 0.582 1.00 0.00 ? 16 ASN A O 4 ATOM 1377 C CB . ASN A 1 16 ? -1.570 -10.133 -1.203 1.00 0.00 ? 16 ASN A CB 4 ATOM 1378 C CG . ASN A 1 16 ? -0.891 -10.668 -2.467 1.00 0.00 ? 16 ASN A CG 4 ATOM 1379 O OD1 . ASN A 1 16 ? -1.524 -10.935 -3.475 1.00 0.00 ? 16 ASN A OD1 4 ATOM 1380 N ND2 . ASN A 1 16 ? 0.427 -10.809 -2.356 1.00 0.00 ? 16 ASN A ND2 4 ATOM 1381 N N . GLY A 1 17 ? -1.856 -7.097 0.160 1.00 0.00 ? 17 GLY A N 4 ATOM 1382 C CA . GLY A 1 17 ? -2.048 -6.373 1.404 1.00 0.00 ? 17 GLY A CA 4 ATOM 1383 C C . GLY A 1 17 ? -1.814 -4.874 1.208 1.00 0.00 ? 17 GLY A C 4 ATOM 1384 O O . GLY A 1 17 ? -0.787 -4.342 1.630 1.00 0.00 ? 17 GLY A O 4 ATOM 1385 N N . GLY A 1 18 ? -2.781 -4.234 0.570 1.00 0.00 ? 18 GLY A N 4 ATOM 1386 C CA . GLY A 1 18 ? -2.693 -2.807 0.313 1.00 0.00 ? 18 GLY A CA 4 ATOM 1387 C C . GLY A 1 18 ? -4.055 -2.236 -0.090 1.00 0.00 ? 18 GLY A C 4 ATOM 1388 O O . GLY A 1 18 ? -4.745 -2.806 -0.934 1.00 0.00 ? 18 GLY A O 4 ATOM 1389 N N . VAL A 1 19 ? -4.400 -1.119 0.534 1.00 0.00 ? 19 VAL A N 4 ATOM 1390 C CA . VAL A 1 19 ? -5.668 -0.466 0.250 1.00 0.00 ? 19 VAL A CA 4 ATOM 1391 C C . VAL A 1 19 ? -5.434 0.684 -0.733 1.00 0.00 ? 19 VAL A C 4 ATOM 1392 O O . VAL A 1 19 ? -4.530 1.495 -0.543 1.00 0.00 ? 19 VAL A O 4 ATOM 1393 C CB . VAL A 1 19 ? -6.325 -0.013 1.555 1.00 0.00 ? 19 VAL A CB 4 ATOM 1394 C CG1 . VAL A 1 19 ? -7.787 0.379 1.325 1.00 0.00 ? 19 VAL A CG1 4 ATOM 1395 C CG2 . VAL A 1 19 ? -6.210 -1.094 2.633 1.00 0.00 ? 19 VAL A CG2 4 ATOM 1396 N N . CYS A 1 20 ? -6.268 0.716 -1.761 1.00 0.00 ? 20 CYS A N 4 ATOM 1397 C CA . CYS A 1 20 ? -6.165 1.752 -2.775 1.00 0.00 ? 20 CYS A CA 4 ATOM 1398 C C . CYS A 1 20 ? -6.585 3.082 -2.148 1.00 0.00 ? 20 CYS A C 4 ATOM 1399 O O . CYS A 1 20 ? -7.658 3.180 -1.552 1.00 0.00 ? 20 CYS A O 4 ATOM 1400 C CB . CYS A 1 20 ? -6.998 1.417 -4.014 1.00 0.00 ? 20 CYS A CB 4 ATOM 1401 S SG . CYS A 1 20 ? -6.247 1.924 -5.603 1.00 0.00 ? 20 CYS A SG 4 ATOM 1402 N N . MET A 1 21 ? -5.719 4.073 -2.300 1.00 0.00 ? 21 MET A N 4 ATOM 1403 C CA . MET A 1 21 ? -5.986 5.394 -1.755 1.00 0.00 ? 21 MET A CA 4 ATOM 1404 C C . MET A 1 21 ? -5.469 6.488 -2.690 1.00 0.00 ? 21 MET A C 4 ATOM 1405 O O . MET A 1 21 ? -4.726 6.207 -3.629 1.00 0.00 ? 21 MET A O 4 ATOM 1406 C CB . MET A 1 21 ? -5.312 5.528 -0.388 1.00 0.00 ? 21 MET A CB 4 ATOM 1407 C CG . MET A 1 21 ? -3.850 5.951 -0.538 1.00 0.00 ? 21 MET A CG 4 ATOM 1408 S SD . MET A 1 21 ? -3.215 6.513 1.032 1.00 0.00 ? 21 MET A SD 4 ATOM 1409 C CE . MET A 1 21 ? -4.130 8.034 1.212 1.00 0.00 ? 21 MET A CE 4 ATOM 1410 N N . HIS A 1 22 ? -5.884 7.712 -2.400 1.00 0.00 ? 22 HIS A N 4 ATOM 1411 C CA . HIS A 1 22 ? -5.471 8.852 -3.205 1.00 0.00 ? 22 HIS A CA 4 ATOM 1412 C C . HIS A 1 22 ? -4.870 9.927 -2.299 1.00 0.00 ? 22 HIS A C 4 ATOM 1413 O O . HIS A 1 22 ? -5.412 10.221 -1.234 1.00 0.00 ? 22 HIS A O 4 ATOM 1414 C CB . HIS A 1 22 ? -6.637 9.370 -4.049 1.00 0.00 ? 22 HIS A CB 4 ATOM 1415 C CG . HIS A 1 22 ? -6.218 10.273 -5.185 1.00 0.00 ? 22 HIS A CG 4 ATOM 1416 N ND1 . HIS A 1 22 ? -6.817 11.495 -5.431 1.00 0.00 ? 22 HIS A ND1 4 ATOM 1417 C CD2 . HIS A 1 22 ? -5.251 10.120 -6.136 1.00 0.00 ? 22 HIS A CD2 4 ATOM 1418 C CE1 . HIS A 1 22 ? -6.232 12.044 -6.485 1.00 0.00 ? 22 HIS A CE1 4 ATOM 1419 N NE2 . HIS A 1 22 ? -5.262 11.190 -6.922 1.00 0.00 ? 22 HIS A NE2 4 ATOM 1420 N N . ILE A 1 23 ? -3.759 10.486 -2.755 1.00 0.00 ? 23 ILE A N 4 ATOM 1421 C CA . ILE A 1 23 ? -3.078 11.525 -1.999 1.00 0.00 ? 23 ILE A CA 4 ATOM 1422 C C . ILE A 1 23 ? -3.361 12.885 -2.640 1.00 0.00 ? 23 ILE A C 4 ATOM 1423 O O . ILE A 1 23 ? -3.025 13.109 -3.801 1.00 0.00 ? 23 ILE A O 4 ATOM 1424 C CB . ILE A 1 23 ? -1.587 11.204 -1.870 1.00 0.00 ? 23 ILE A CB 4 ATOM 1425 C CG1 . ILE A 1 23 ? -1.138 10.240 -2.972 1.00 0.00 ? 23 ILE A CG1 4 ATOM 1426 C CG2 . ILE A 1 23 ? -1.260 10.670 -0.474 1.00 0.00 ? 23 ILE A CG2 4 ATOM 1427 C CD1 . ILE A 1 23 ? -1.672 8.830 -2.717 1.00 0.00 ? 23 ILE A CD1 4 ATOM 1428 N N . GLU A 1 24 ? -3.977 13.756 -1.854 1.00 0.00 ? 24 GLU A N 4 ATOM 1429 C CA . GLU A 1 24 ? -4.308 15.088 -2.330 1.00 0.00 ? 24 GLU A CA 4 ATOM 1430 C C . GLU A 1 24 ? -3.076 15.994 -2.275 1.00 0.00 ? 24 GLU A C 4 ATOM 1431 O O . GLU A 1 24 ? -3.044 17.043 -2.914 1.00 0.00 ? 24 GLU A O 4 ATOM 1432 C CB . GLU A 1 24 ? -5.464 15.685 -1.525 1.00 0.00 ? 24 GLU A CB 4 ATOM 1433 C CG . GLU A 1 24 ? -6.814 15.287 -2.124 1.00 0.00 ? 24 GLU A CG 4 ATOM 1434 C CD . GLU A 1 24 ? -7.496 16.486 -2.784 1.00 0.00 ? 24 GLU A CD 4 ATOM 1435 O OE1 . GLU A 1 24 ? -7.102 17.637 -2.541 1.00 0.00 ? 24 GLU A OE1 4 ATOM 1436 O OE2 . GLU A 1 24 ? -8.471 16.192 -3.576 1.00 0.00 ? 24 GLU A OE2 4 ATOM 1437 N N . SER A 1 25 ? -2.091 15.552 -1.507 1.00 0.00 ? 25 SER A N 4 ATOM 1438 C CA . SER A 1 25 ? -0.859 16.310 -1.360 1.00 0.00 ? 25 SER A CA 4 ATOM 1439 C C . SER A 1 25 ? -0.214 16.530 -2.730 1.00 0.00 ? 25 SER A C 4 ATOM 1440 O O . SER A 1 25 ? 0.547 17.477 -2.917 1.00 0.00 ? 25 SER A O 4 ATOM 1441 C CB . SER A 1 25 ? 0.117 15.599 -0.423 1.00 0.00 ? 25 SER A CB 4 ATOM 1442 O OG . SER A 1 25 ? 0.506 14.323 -0.925 1.00 0.00 ? 25 SER A OG 4 ATOM 1443 N N . LEU A 1 26 ? -0.542 15.637 -3.653 1.00 0.00 ? 26 LEU A N 4 ATOM 1444 C CA . LEU A 1 26 ? -0.004 15.722 -5.001 1.00 0.00 ? 26 LEU A CA 4 ATOM 1445 C C . LEU A 1 26 ? -0.959 15.023 -5.972 1.00 0.00 ? 26 LEU A C 4 ATOM 1446 O O . LEU A 1 26 ? -0.558 14.628 -7.066 1.00 0.00 ? 26 LEU A O 4 ATOM 1447 C CB . LEU A 1 26 ? 1.424 15.174 -5.041 1.00 0.00 ? 26 LEU A CB 4 ATOM 1448 C CG . LEU A 1 26 ? 2.523 16.195 -5.342 1.00 0.00 ? 26 LEU A CG 4 ATOM 1449 C CD1 . LEU A 1 26 ? 3.910 15.577 -5.157 1.00 0.00 ? 26 LEU A CD1 4 ATOM 1450 C CD2 . LEU A 1 26 ? 2.347 16.796 -6.738 1.00 0.00 ? 26 LEU A CD2 4 ATOM 1451 N N . ASP A 1 27 ? -2.203 14.890 -5.535 1.00 0.00 ? 27 ASP A N 4 ATOM 1452 C CA . ASP A 1 27 ? -3.217 14.245 -6.351 1.00 0.00 ? 27 ASP A CA 4 ATOM 1453 C C . ASP A 1 27 ? -2.651 12.944 -6.927 1.00 0.00 ? 27 ASP A C 4 ATOM 1454 O O . ASP A 1 27 ? -2.902 12.614 -8.085 1.00 0.00 ? 27 ASP A O 4 ATOM 1455 C CB . ASP A 1 27 ? -3.634 15.139 -7.520 1.00 0.00 ? 27 ASP A CB 4 ATOM 1456 C CG . ASP A 1 27 ? -5.137 15.178 -7.801 1.00 0.00 ? 27 ASP A CG 4 ATOM 1457 O OD1 . ASP A 1 27 ? -5.901 15.851 -7.094 1.00 0.00 ? 27 ASP A OD1 4 ATOM 1458 O OD2 . ASP A 1 27 ? -5.521 14.471 -8.808 1.00 0.00 ? 27 ASP A OD2 4 ATOM 1459 N N . SER A 1 28 ? -1.898 12.243 -6.093 1.00 0.00 ? 28 SER A N 4 ATOM 1460 C CA . SER A 1 28 ? -1.296 10.987 -6.505 1.00 0.00 ? 28 SER A CA 4 ATOM 1461 C C . SER A 1 28 ? -2.133 9.812 -5.994 1.00 0.00 ? 28 SER A C 4 ATOM 1462 O O . SER A 1 28 ? -2.973 9.981 -5.112 1.00 0.00 ? 28 SER A O 4 ATOM 1463 C CB . SER A 1 28 ? 0.143 10.875 -5.997 1.00 0.00 ? 28 SER A CB 4 ATOM 1464 O OG . SER A 1 28 ? 0.782 9.690 -6.465 1.00 0.00 ? 28 SER A OG 4 ATOM 1465 N N . TYR A 1 29 ? -1.874 8.647 -6.569 1.00 0.00 ? 29 TYR A N 4 ATOM 1466 C CA . TYR A 1 29 ? -2.592 7.445 -6.183 1.00 0.00 ? 29 TYR A CA 4 ATOM 1467 C C . TYR A 1 29 ? -1.633 6.384 -5.637 1.00 0.00 ? 29 TYR A C 4 ATOM 1468 O O . TYR A 1 29 ? -0.763 5.899 -6.359 1.00 0.00 ? 29 TYR A O 4 ATOM 1469 C CB . TYR A 1 29 ? -3.245 6.916 -7.461 1.00 0.00 ? 29 TYR A CB 4 ATOM 1470 C CG . TYR A 1 29 ? -4.627 7.511 -7.744 1.00 0.00 ? 29 TYR A CG 4 ATOM 1471 C CD1 . TYR A 1 29 ? -5.705 7.159 -6.959 1.00 0.00 ? 29 TYR A CD1 4 ATOM 1472 C CD2 . TYR A 1 29 ? -4.793 8.399 -8.788 1.00 0.00 ? 29 TYR A CD2 4 ATOM 1473 C CE1 . TYR A 1 29 ? -7.004 7.720 -7.227 1.00 0.00 ? 29 TYR A CE1 4 ATOM 1474 C CE2 . TYR A 1 29 ? -6.093 8.958 -9.057 1.00 0.00 ? 29 TYR A CE2 4 ATOM 1475 C CZ . TYR A 1 29 ? -7.133 8.591 -8.262 1.00 0.00 ? 29 TYR A CZ 4 ATOM 1476 O OH . TYR A 1 29 ? -8.361 9.120 -8.516 1.00 0.00 ? 29 TYR A OH 4 ATOM 1477 N N . THR A 1 30 ? -1.824 6.057 -4.369 1.00 0.00 ? 30 THR A N 4 ATOM 1478 C CA . THR A 1 30 ? -0.987 5.062 -3.719 1.00 0.00 ? 30 THR A CA 4 ATOM 1479 C C . THR A 1 30 ? -1.843 3.919 -3.171 1.00 0.00 ? 30 THR A C 4 ATOM 1480 O O . THR A 1 30 ? -3.010 3.783 -3.537 1.00 0.00 ? 30 THR A O 4 ATOM 1481 C CB . THR A 1 30 ? -0.161 5.769 -2.643 1.00 0.00 ? 30 THR A CB 4 ATOM 1482 O OG1 . THR A 1 30 ? 0.815 4.803 -2.262 1.00 0.00 ? 30 THR A OG1 4 ATOM 1483 C CG2 . THR A 1 30 ? -0.958 6.020 -1.360 1.00 0.00 ? 30 THR A CG2 4 ATOM 1484 N N . CYS A 1 31 ? -1.232 3.125 -2.305 1.00 0.00 ? 31 CYS A N 4 ATOM 1485 C CA . CYS A 1 31 ? -1.925 1.999 -1.704 1.00 0.00 ? 31 CYS A CA 4 ATOM 1486 C C . CYS A 1 31 ? -1.405 1.820 -0.275 1.00 0.00 ? 31 CYS A C 4 ATOM 1487 O O . CYS A 1 31 ? -0.220 1.564 -0.071 1.00 0.00 ? 31 CYS A O 4 ATOM 1488 C CB . CYS A 1 31 ? -1.758 0.724 -2.535 1.00 0.00 ? 31 CYS A CB 4 ATOM 1489 S SG . CYS A 1 31 ? -3.076 0.438 -3.772 1.00 0.00 ? 31 CYS A SG 4 ATOM 1490 N N . ASN A 1 32 ? -2.317 1.962 0.674 1.00 0.00 ? 32 ASN A N 4 ATOM 1491 C CA . ASN A 1 32 ? -1.965 1.821 2.078 1.00 0.00 ? 32 ASN A CA 4 ATOM 1492 C C . ASN A 1 32 ? -1.482 0.393 2.336 1.00 0.00 ? 32 ASN A C 4 ATOM 1493 O O . ASN A 1 32 ? -2.292 -0.525 2.469 1.00 0.00 ? 32 ASN A O 4 ATOM 1494 C CB . ASN A 1 32 ? -3.174 2.082 2.978 1.00 0.00 ? 32 ASN A CB 4 ATOM 1495 C CG . ASN A 1 32 ? -3.947 3.320 2.513 1.00 0.00 ? 32 ASN A CG 4 ATOM 1496 O OD1 . ASN A 1 32 ? -3.781 3.807 1.407 1.00 0.00 ? 32 ASN A OD1 4 ATOM 1497 N ND2 . ASN A 1 32 ? -4.795 3.797 3.418 1.00 0.00 ? 32 ASN A ND2 4 ATOM 1498 N N . CYS A 1 33 ? -0.166 0.249 2.398 1.00 0.00 ? 33 CYS A N 4 ATOM 1499 C CA . CYS A 1 33 ? 0.432 -1.052 2.639 1.00 0.00 ? 33 CYS A CA 4 ATOM 1500 C C . CYS A 1 33 ? 0.277 -1.386 4.126 1.00 0.00 ? 33 CYS A C 4 ATOM 1501 O O . CYS A 1 33 ? -0.579 -0.822 4.805 1.00 0.00 ? 33 CYS A O 4 ATOM 1502 C CB . CYS A 1 33 ? 1.897 -1.091 2.196 1.00 0.00 ? 33 CYS A CB 4 ATOM 1503 S SG . CYS A 1 33 ? 2.415 -2.656 1.401 1.00 0.00 ? 33 CYS A SG 4 ATOM 1504 N N . VAL A 1 34 ? 1.118 -2.302 4.583 1.00 0.00 ? 34 VAL A N 4 ATOM 1505 C CA . VAL A 1 34 ? 1.085 -2.716 5.977 1.00 0.00 ? 34 VAL A CA 4 ATOM 1506 C C . VAL A 1 34 ? 2.515 -2.924 6.476 1.00 0.00 ? 34 VAL A C 4 ATOM 1507 O O . VAL A 1 34 ? 3.475 -2.565 5.794 1.00 0.00 ? 34 VAL A O 4 ATOM 1508 C CB . VAL A 1 34 ? 0.212 -3.963 6.129 1.00 0.00 ? 34 VAL A CB 4 ATOM 1509 C CG1 . VAL A 1 34 ? -1.272 -3.610 6.015 1.00 0.00 ? 34 VAL A CG1 4 ATOM 1510 C CG2 . VAL A 1 34 ? 0.601 -5.034 5.108 1.00 0.00 ? 34 VAL A CG2 4 ATOM 1511 N N . ILE A 1 35 ? 2.617 -3.505 7.661 1.00 0.00 ? 35 ILE A N 4 ATOM 1512 C CA . ILE A 1 35 ? 3.914 -3.764 8.261 1.00 0.00 ? 35 ILE A CA 4 ATOM 1513 C C . ILE A 1 35 ? 4.742 -4.636 7.316 1.00 0.00 ? 35 ILE A C 4 ATOM 1514 O O . ILE A 1 35 ? 4.188 -5.376 6.504 1.00 0.00 ? 35 ILE A O 4 ATOM 1515 C CB . ILE A 1 35 ? 3.748 -4.360 9.660 1.00 0.00 ? 35 ILE A CB 4 ATOM 1516 C CG1 . ILE A 1 35 ? 2.593 -3.692 10.408 1.00 0.00 ? 35 ILE A CG1 4 ATOM 1517 C CG2 . ILE A 1 35 ? 5.058 -4.285 10.447 1.00 0.00 ? 35 ILE A CG2 4 ATOM 1518 C CD1 . ILE A 1 35 ? 2.773 -3.818 11.922 1.00 0.00 ? 35 ILE A CD1 4 ATOM 1519 N N . GLY A 1 36 ? 6.055 -4.522 7.454 1.00 0.00 ? 36 GLY A N 4 ATOM 1520 C CA . GLY A 1 36 ? 6.964 -5.291 6.621 1.00 0.00 ? 36 GLY A CA 4 ATOM 1521 C C . GLY A 1 36 ? 6.423 -5.424 5.196 1.00 0.00 ? 36 GLY A C 4 ATOM 1522 O O . GLY A 1 36 ? 6.693 -6.412 4.516 1.00 0.00 ? 36 GLY A O 4 ATOM 1523 N N . TYR A 1 37 ? 5.671 -4.415 4.786 1.00 0.00 ? 37 TYR A N 4 ATOM 1524 C CA . TYR A 1 37 ? 5.091 -4.405 3.453 1.00 0.00 ? 37 TYR A CA 4 ATOM 1525 C C . TYR A 1 37 ? 4.891 -2.975 2.951 1.00 0.00 ? 37 TYR A C 4 ATOM 1526 O O . TYR A 1 37 ? 4.153 -2.199 3.555 1.00 0.00 ? 37 TYR A O 4 ATOM 1527 C CB . TYR A 1 37 ? 3.724 -5.081 3.586 1.00 0.00 ? 37 TYR A CB 4 ATOM 1528 C CG . TYR A 1 37 ? 3.743 -6.584 3.293 1.00 0.00 ? 37 TYR A CG 4 ATOM 1529 C CD1 . TYR A 1 37 ? 4.144 -7.471 4.271 1.00 0.00 ? 37 TYR A CD1 4 ATOM 1530 C CD2 . TYR A 1 37 ? 3.359 -7.049 2.052 1.00 0.00 ? 37 TYR A CD2 4 ATOM 1531 C CE1 . TYR A 1 37 ? 4.162 -8.886 3.996 1.00 0.00 ? 37 TYR A CE1 4 ATOM 1532 C CE2 . TYR A 1 37 ? 3.376 -8.463 1.777 1.00 0.00 ? 37 TYR A CE2 4 ATOM 1533 C CZ . TYR A 1 37 ? 3.777 -9.311 2.764 1.00 0.00 ? 37 TYR A CZ 4 ATOM 1534 O OH . TYR A 1 37 ? 3.793 -10.646 2.505 1.00 0.00 ? 37 TYR A OH 4 ATOM 1535 N N . SER A 1 38 ? 5.564 -2.668 1.852 1.00 0.00 ? 38 SER A N 4 ATOM 1536 C CA . SER A 1 38 ? 5.470 -1.343 1.262 1.00 0.00 ? 38 SER A CA 4 ATOM 1537 C C . SER A 1 38 ? 5.923 -1.389 -0.200 1.00 0.00 ? 38 SER A C 4 ATOM 1538 O O . SER A 1 38 ? 6.214 -2.460 -0.730 1.00 0.00 ? 38 SER A O 4 ATOM 1539 C CB . SER A 1 38 ? 6.307 -0.331 2.046 1.00 0.00 ? 38 SER A CB 4 ATOM 1540 O OG . SER A 1 38 ? 5.871 -0.210 3.396 1.00 0.00 ? 38 SER A OG 4 ATOM 1541 N N . GLY A 1 39 ? 5.968 -0.213 -0.808 1.00 0.00 ? 39 GLY A N 4 ATOM 1542 C CA . GLY A 1 39 ? 6.380 -0.104 -2.197 1.00 0.00 ? 39 GLY A CA 4 ATOM 1543 C C . GLY A 1 39 ? 5.183 0.188 -3.104 1.00 0.00 ? 39 GLY A C 4 ATOM 1544 O O . GLY A 1 39 ? 4.840 -0.621 -3.966 1.00 0.00 ? 39 GLY A O 4 ATOM 1545 N N . ASP A 1 40 ? 4.581 1.347 -2.879 1.00 0.00 ? 40 ASP A N 4 ATOM 1546 C CA . ASP A 1 40 ? 3.430 1.757 -3.665 1.00 0.00 ? 40 ASP A CA 4 ATOM 1547 C C . ASP A 1 40 ? 2.245 0.843 -3.341 1.00 0.00 ? 40 ASP A C 4 ATOM 1548 O O . ASP A 1 40 ? 1.254 1.287 -2.763 1.00 0.00 ? 40 ASP A O 4 ATOM 1549 C CB . ASP A 1 40 ? 3.718 1.645 -5.164 1.00 0.00 ? 40 ASP A CB 4 ATOM 1550 C CG . ASP A 1 40 ? 3.262 2.842 -5.999 1.00 0.00 ? 40 ASP A CG 4 ATOM 1551 O OD1 . ASP A 1 40 ? 3.232 3.984 -5.517 1.00 0.00 ? 40 ASP A OD1 4 ATOM 1552 O OD2 . ASP A 1 40 ? 2.925 2.562 -7.212 1.00 0.00 ? 40 ASP A OD2 4 ATOM 1553 N N . ARG A 1 41 ? 2.389 -0.418 -3.726 1.00 0.00 ? 41 ARG A N 4 ATOM 1554 C CA . ARG A 1 41 ? 1.343 -1.397 -3.484 1.00 0.00 ? 41 ARG A CA 4 ATOM 1555 C C . ARG A 1 41 ? 1.646 -2.194 -2.215 1.00 0.00 ? 41 ARG A C 4 ATOM 1556 O O . ARG A 1 41 ? 0.986 -2.016 -1.193 1.00 0.00 ? 41 ARG A O 4 ATOM 1557 C CB . ARG A 1 41 ? 1.208 -2.360 -4.665 1.00 0.00 ? 41 ARG A CB 4 ATOM 1558 C CG . ARG A 1 41 ? 1.769 -1.741 -5.946 1.00 0.00 ? 41 ARG A CG 4 ATOM 1559 C CD . ARG A 1 41 ? 1.062 -2.305 -7.181 1.00 0.00 ? 41 ARG A CD 4 ATOM 1560 N NE . ARG A 1 41 ? 2.051 -2.576 -8.249 1.00 0.00 ? 41 ARG A NE 4 ATOM 1561 C CZ . ARG A 1 41 ? 2.273 -1.759 -9.302 1.00 0.00 ? 41 ARG A CZ 4 ATOM 1562 N NH1 . ARG A 1 41 ? 1.564 -1.928 -10.403 1.00 0.00 ? 41 ARG A NH1 4 ATOM 1563 N NH2 . ARG A 1 41 ? 3.204 -0.783 -9.227 1.00 0.00 ? 41 ARG A NH2 4 ATOM 1564 N N . CYS A 1 42 ? 2.648 -3.056 -2.320 1.00 0.00 ? 42 CYS A N 4 ATOM 1565 C CA . CYS A 1 42 ? 3.048 -3.882 -1.194 1.00 0.00 ? 42 CYS A CA 4 ATOM 1566 C C . CYS A 1 42 ? 3.773 -5.115 -1.736 1.00 0.00 ? 42 CYS A C 4 ATOM 1567 O O . CYS A 1 42 ? 3.501 -6.237 -1.309 1.00 0.00 ? 42 CYS A O 4 ATOM 1568 C CB . CYS A 1 42 ? 1.852 -4.260 -0.319 1.00 0.00 ? 42 CYS A CB 4 ATOM 1569 S SG . CYS A 1 42 ? 1.717 -3.319 1.245 1.00 0.00 ? 42 CYS A SG 4 ATOM 1570 N N . GLN A 1 43 ? 4.682 -4.867 -2.667 1.00 0.00 ? 43 GLN A N 4 ATOM 1571 C CA . GLN A 1 43 ? 5.447 -5.944 -3.271 1.00 0.00 ? 43 GLN A CA 4 ATOM 1572 C C . GLN A 1 43 ? 6.753 -6.162 -2.505 1.00 0.00 ? 43 GLN A C 4 ATOM 1573 O O . GLN A 1 43 ? 7.365 -7.225 -2.602 1.00 0.00 ? 43 GLN A O 4 ATOM 1574 C CB . GLN A 1 43 ? 5.722 -5.659 -4.750 1.00 0.00 ? 43 GLN A CB 4 ATOM 1575 C CG . GLN A 1 43 ? 6.650 -4.455 -4.914 1.00 0.00 ? 43 GLN A CG 4 ATOM 1576 C CD . GLN A 1 43 ? 6.127 -3.503 -5.989 1.00 0.00 ? 43 GLN A CD 4 ATOM 1577 O OE1 . GLN A 1 43 ? 4.962 -3.515 -6.356 1.00 0.00 ? 43 GLN A OE1 4 ATOM 1578 N NE2 . GLN A 1 43 ? 7.048 -2.675 -6.474 1.00 0.00 ? 43 GLN A NE2 4 ATOM 1579 N N . THR A 1 44 ? 7.142 -5.138 -1.759 1.00 0.00 ? 44 THR A N 4 ATOM 1580 C CA . THR A 1 44 ? 8.364 -5.204 -0.975 1.00 0.00 ? 44 THR A CA 4 ATOM 1581 C C . THR A 1 44 ? 8.055 -5.632 0.460 1.00 0.00 ? 44 THR A C 4 ATOM 1582 O O . THR A 1 44 ? 7.414 -4.893 1.207 1.00 0.00 ? 44 THR A O 4 ATOM 1583 C CB . THR A 1 44 ? 9.060 -3.844 -1.068 1.00 0.00 ? 44 THR A CB 4 ATOM 1584 O OG1 . THR A 1 44 ? 9.316 -3.679 -2.461 1.00 0.00 ? 44 THR A OG1 4 ATOM 1585 C CG2 . THR A 1 44 ? 10.451 -3.853 -0.432 1.00 0.00 ? 44 THR A CG2 4 ATOM 1586 N N . ARG A 1 45 ? 8.525 -6.821 0.805 1.00 0.00 ? 45 ARG A N 4 ATOM 1587 C CA . ARG A 1 45 ? 8.306 -7.357 2.137 1.00 0.00 ? 45 ARG A CA 4 ATOM 1588 C C . ARG A 1 45 ? 9.471 -6.983 3.057 1.00 0.00 ? 45 ARG A C 4 ATOM 1589 O O . ARG A 1 45 ? 10.527 -7.616 3.013 1.00 0.00 ? 45 ARG A O 4 ATOM 1590 C CB . ARG A 1 45 ? 8.159 -8.878 2.103 1.00 0.00 ? 45 ARG A CB 4 ATOM 1591 C CG . ARG A 1 45 ? 6.716 -9.295 2.392 1.00 0.00 ? 45 ARG A CG 4 ATOM 1592 C CD . ARG A 1 45 ? 6.672 -10.553 3.264 1.00 0.00 ? 45 ARG A CD 4 ATOM 1593 N NE . ARG A 1 45 ? 7.120 -11.727 2.481 1.00 0.00 ? 45 ARG A NE 4 ATOM 1594 C CZ . ARG A 1 45 ? 6.285 -12.555 1.817 1.00 0.00 ? 45 ARG A CZ 4 ATOM 1595 N NH1 . ARG A 1 45 ? 5.688 -13.582 2.456 1.00 0.00 ? 45 ARG A NH1 4 ATOM 1596 N NH2 . ARG A 1 45 ? 6.063 -12.345 0.533 1.00 0.00 ? 45 ARG A NH2 4 ATOM 1597 N N . ASP A 1 46 ? 9.243 -5.960 3.863 1.00 0.00 ? 46 ASP A N 4 ATOM 1598 C CA . ASP A 1 46 ? 10.261 -5.497 4.792 1.00 0.00 ? 46 ASP A CA 4 ATOM 1599 C C . ASP A 1 46 ? 10.388 -6.494 5.944 1.00 0.00 ? 46 ASP A C 4 ATOM 1600 O O . ASP A 1 46 ? 11.470 -6.670 6.502 1.00 0.00 ? 46 ASP A O 4 ATOM 1601 C CB . ASP A 1 46 ? 9.887 -4.136 5.384 1.00 0.00 ? 46 ASP A CB 4 ATOM 1602 C CG . ASP A 1 46 ? 10.849 -2.995 5.041 1.00 0.00 ? 46 ASP A CG 4 ATOM 1603 O OD1 . ASP A 1 46 ? 11.278 -2.847 3.887 1.00 0.00 ? 46 ASP A OD1 4 ATOM 1604 O OD2 . ASP A 1 46 ? 11.159 -2.229 6.032 1.00 0.00 ? 46 ASP A OD2 4 ATOM 1605 N N . LEU A 1 47 ? 9.266 -7.120 6.268 1.00 0.00 ? 47 LEU A N 4 ATOM 1606 C CA . LEU A 1 47 ? 9.238 -8.096 7.345 1.00 0.00 ? 47 LEU A CA 4 ATOM 1607 C C . LEU A 1 47 ? 7.996 -8.978 7.196 1.00 0.00 ? 47 LEU A C 4 ATOM 1608 O O . LEU A 1 47 ? 7.404 -9.044 6.121 1.00 0.00 ? 47 LEU A O 4 ATOM 1609 C CB . LEU A 1 47 ? 9.340 -7.400 8.703 1.00 0.00 ? 47 LEU A CB 4 ATOM 1610 C CG . LEU A 1 47 ? 10.596 -7.704 9.520 1.00 0.00 ? 47 LEU A CG 4 ATOM 1611 C CD1 . LEU A 1 47 ? 10.940 -9.194 9.461 1.00 0.00 ? 47 LEU A CD1 4 ATOM 1612 C CD2 . LEU A 1 47 ? 11.767 -6.828 9.074 1.00 0.00 ? 47 LEU A CD2 4 ATOM 1613 N N . ARG A 1 48 ? 7.639 -9.629 8.293 1.00 0.00 ? 48 ARG A N 4 ATOM 1614 C CA . ARG A 1 48 ? 6.477 -10.503 8.297 1.00 0.00 ? 48 ARG A CA 4 ATOM 1615 C C . ARG A 1 48 ? 5.763 -10.430 9.650 1.00 0.00 ? 48 ARG A C 4 ATOM 1616 O O . ARG A 1 48 ? 5.497 -11.456 10.272 1.00 0.00 ? 48 ARG A O 4 ATOM 1617 C CB . ARG A 1 48 ? 6.879 -11.955 8.021 1.00 0.00 ? 48 ARG A CB 4 ATOM 1618 C CG . ARG A 1 48 ? 5.789 -12.682 7.232 1.00 0.00 ? 48 ARG A CG 4 ATOM 1619 C CD . ARG A 1 48 ? 6.286 -14.042 6.735 1.00 0.00 ? 48 ARG A CD 4 ATOM 1620 N NE . ARG A 1 48 ? 6.578 -14.924 7.885 1.00 0.00 ? 48 ARG A NE 4 ATOM 1621 C CZ . ARG A 1 48 ? 7.781 -15.487 8.123 1.00 0.00 ? 48 ARG A CZ 4 ATOM 1622 N NH1 . ARG A 1 48 ? 8.158 -16.604 7.465 1.00 0.00 ? 48 ARG A NH1 4 ATOM 1623 N NH2 . ARG A 1 48 ? 8.587 -14.928 9.008 1.00 0.00 ? 48 ARG A NH2 4 ATOM 1624 N N . TRP A 1 49 ? 5.473 -9.204 10.062 1.00 0.00 ? 49 TRP A N 4 ATOM 1625 C CA . TRP A 1 49 ? 4.795 -8.981 11.328 1.00 0.00 ? 49 TRP A CA 4 ATOM 1626 C C . TRP A 1 49 ? 3.401 -9.602 11.232 1.00 0.00 ? 49 TRP A C 4 ATOM 1627 O O . TRP A 1 49 ? 2.419 -8.899 11.000 1.00 0.00 ? 49 TRP A O 4 ATOM 1628 C CB . TRP A 1 49 ? 4.764 -7.492 11.678 1.00 0.00 ? 49 TRP A CB 4 ATOM 1629 C CG . TRP A 1 49 ? 3.937 -7.163 12.923 1.00 0.00 ? 49 TRP A CG 4 ATOM 1630 C CD1 . TRP A 1 49 ? 2.608 -7.001 13.012 1.00 0.00 ? 49 TRP A CD1 4 ATOM 1631 C CD2 . TRP A 1 49 ? 4.438 -6.961 14.261 1.00 0.00 ? 49 TRP A CD2 4 ATOM 1632 N NE1 . TRP A 1 49 ? 2.220 -6.711 14.304 1.00 0.00 ? 49 TRP A NE1 4 ATOM 1633 C CE2 . TRP A 1 49 ? 3.368 -6.686 15.088 1.00 0.00 ? 49 TRP A CE2 4 ATOM 1634 C CE3 . TRP A 1 49 ? 5.754 -7.011 14.756 1.00 0.00 ? 49 TRP A CE3 4 ATOM 1635 C CZ2 . TRP A 1 49 ? 3.504 -6.439 16.459 1.00 0.00 ? 49 TRP A CZ2 4 ATOM 1636 C CZ3 . TRP A 1 49 ? 5.872 -6.760 16.127 1.00 0.00 ? 49 TRP A CZ3 4 ATOM 1637 C CH2 . TRP A 1 49 ? 4.805 -6.482 16.974 1.00 0.00 ? 49 TRP A CH2 4 ATOM 1638 N N . TRP A 1 50 ? 3.357 -10.914 11.417 1.00 0.00 ? 50 TRP A N 4 ATOM 1639 C CA . TRP A 1 50 ? 2.099 -11.638 11.354 1.00 0.00 ? 50 TRP A CA 4 ATOM 1640 C C . TRP A 1 50 ? 2.316 -13.018 11.976 1.00 0.00 ? 50 TRP A C 4 ATOM 1641 O O . TRP A 1 50 ? 1.594 -13.412 12.891 1.00 0.00 ? 50 TRP A O 4 ATOM 1642 C CB . TRP A 1 50 ? 1.576 -11.704 9.918 1.00 0.00 ? 50 TRP A CB 4 ATOM 1643 C CG . TRP A 1 50 ? 1.902 -10.469 9.077 1.00 0.00 ? 50 TRP A CG 4 ATOM 1644 C CD1 . TRP A 1 50 ? 3.012 -10.224 8.366 1.00 0.00 ? 50 TRP A CD1 4 ATOM 1645 C CD2 . TRP A 1 50 ? 1.062 -9.310 8.889 1.00 0.00 ? 50 TRP A CD2 4 ATOM 1646 N NE1 . TRP A 1 50 ? 2.947 -8.998 7.735 1.00 0.00 ? 50 TRP A NE1 4 ATOM 1647 C CE2 . TRP A 1 50 ? 1.725 -8.424 8.064 1.00 0.00 ? 50 TRP A CE2 4 ATOM 1648 C CE3 . TRP A 1 50 ? -0.214 -9.019 9.402 1.00 0.00 ? 50 TRP A CE3 4 ATOM 1649 C CZ2 . TRP A 1 50 ? 1.189 -7.189 7.677 1.00 0.00 ? 50 TRP A CZ2 4 ATOM 1650 C CZ3 . TRP A 1 50 ? -0.735 -7.782 9.006 1.00 0.00 ? 50 TRP A CZ3 4 ATOM 1651 C CH2 . TRP A 1 50 ? -0.082 -6.880 8.175 1.00 0.00 ? 50 TRP A CH2 4 ATOM 1652 N N . GLU A 1 51 ? 3.315 -13.715 11.457 1.00 0.00 ? 51 GLU A N 4 ATOM 1653 C CA . GLU A 1 51 ? 3.638 -15.044 11.949 1.00 0.00 ? 51 GLU A CA 4 ATOM 1654 C C . GLU A 1 51 ? 4.588 -14.950 13.145 1.00 0.00 ? 51 GLU A C 4 ATOM 1655 O O . GLU A 1 51 ? 5.464 -14.087 13.180 1.00 0.00 ? 51 GLU A O 4 ATOM 1656 C CB . GLU A 1 51 ? 4.236 -15.911 10.840 1.00 0.00 ? 51 GLU A CB 4 ATOM 1657 C CG . GLU A 1 51 ? 3.442 -15.761 9.539 1.00 0.00 ? 51 GLU A CG 4 ATOM 1658 C CD . GLU A 1 51 ? 2.239 -16.709 9.519 1.00 0.00 ? 51 GLU A CD 4 ATOM 1659 O OE1 . GLU A 1 51 ? 2.381 -17.883 9.148 1.00 0.00 ? 51 GLU A OE1 4 ATOM 1660 O OE2 . GLU A 1 51 ? 1.127 -16.184 9.909 1.00 0.00 ? 51 GLU A OE2 4 ATOM 1661 N N . LEU A 1 52 ? 4.384 -15.852 14.095 1.00 0.00 ? 52 LEU A N 4 ATOM 1662 C CA . LEU A 1 52 ? 5.211 -15.881 15.288 1.00 0.00 ? 52 LEU A CA 4 ATOM 1663 C C . LEU A 1 52 ? 5.621 -17.326 15.583 1.00 0.00 ? 52 LEU A C 4 ATOM 1664 O O . LEU A 1 52 ? 6.807 -17.625 15.706 1.00 0.00 ? 52 LEU A O 4 ATOM 1665 C CB . LEU A 1 52 ? 4.496 -15.195 16.454 1.00 0.00 ? 52 LEU A CB 4 ATOM 1666 C CG . LEU A 1 52 ? 5.314 -15.022 17.735 1.00 0.00 ? 52 LEU A CG 4 ATOM 1667 C CD1 . LEU A 1 52 ? 5.264 -13.576 18.228 1.00 0.00 ? 52 LEU A CD1 4 ATOM 1668 C CD2 . LEU A 1 52 ? 4.862 -16.012 18.810 1.00 0.00 ? 52 LEU A CD2 4 ATOM 1669 N N . ARG A 1 53 ? 4.616 -18.183 15.689 1.00 0.00 ? 53 ARG A N 4 ATOM 1670 C CA . ARG A 1 53 ? 4.857 -19.588 15.966 1.00 0.00 ? 53 ARG A CA 4 ATOM 1671 C C . ARG A 1 53 ? 5.767 -19.739 17.188 1.00 0.00 ? 53 ARG A C 4 ATOM 1672 O O . ARG A 1 53 ? 5.317 -19.597 18.324 1.00 0.00 ? 53 ARG A O 4 ATOM 1673 C CB . ARG A 1 53 ? 5.504 -20.284 14.768 1.00 0.00 ? 53 ARG A CB 4 ATOM 1674 C CG . ARG A 1 53 ? 5.335 -21.802 14.856 1.00 0.00 ? 53 ARG A CG 4 ATOM 1675 C CD . ARG A 1 53 ? 4.317 -22.301 13.831 1.00 0.00 ? 53 ARG A CD 4 ATOM 1676 N NE . ARG A 1 53 ? 2.973 -21.766 14.148 1.00 0.00 ? 53 ARG A NE 4 ATOM 1677 C CZ . ARG A 1 53 ? 2.051 -22.424 14.883 1.00 0.00 ? 53 ARG A CZ 4 ATOM 1678 N NH1 . ARG A 1 53 ? 2.041 -22.311 16.228 1.00 0.00 ? 53 ARG A NH1 4 ATOM 1679 N NH2 . ARG A 1 53 ? 1.161 -23.178 14.267 1.00 0.00 ? 53 ARG A NH2 4 ATOM 1680 O OXT . ARG A 1 53 ? 6.999 -20.017 16.919 1.00 0.00 ? 53 ARG A OXT 4 ATOM 1681 N N . ASN A 1 1 ? -4.510 16.791 1.535 1.00 0.00 ? 1 ASN A N 5 ATOM 1682 C CA . ASN A 1 1 ? -5.488 16.017 2.281 1.00 0.00 ? 1 ASN A CA 5 ATOM 1683 C C . ASN A 1 1 ? -5.587 14.613 1.678 1.00 0.00 ? 1 ASN A C 5 ATOM 1684 O O . ASN A 1 1 ? -5.849 14.463 0.484 1.00 0.00 ? 1 ASN A O 5 ATOM 1685 C CB . ASN A 1 1 ? -6.874 16.660 2.207 1.00 0.00 ? 1 ASN A CB 5 ATOM 1686 C CG . ASN A 1 1 ? -7.136 17.239 0.814 1.00 0.00 ? 1 ASN A CG 5 ATOM 1687 O OD1 . ASN A 1 1 ? -6.650 18.296 0.452 1.00 0.00 ? 1 ASN A OD1 5 ATOM 1688 N ND2 . ASN A 1 1 ? -7.932 16.487 0.057 1.00 0.00 ? 1 ASN A ND2 5 ATOM 1689 N N . SER A 1 2 ? -5.371 13.622 2.528 1.00 0.00 ? 2 SER A N 5 ATOM 1690 C CA . SER A 1 2 ? -5.433 12.236 2.094 1.00 0.00 ? 2 SER A CA 5 ATOM 1691 C C . SER A 1 2 ? -6.889 11.812 1.901 1.00 0.00 ? 2 SER A C 5 ATOM 1692 O O . SER A 1 2 ? -7.748 12.134 2.722 1.00 0.00 ? 2 SER A O 5 ATOM 1693 C CB . SER A 1 2 ? -4.740 11.313 3.099 1.00 0.00 ? 2 SER A CB 5 ATOM 1694 O OG . SER A 1 2 ? -3.388 11.696 3.333 1.00 0.00 ? 2 SER A OG 5 ATOM 1695 N N . TYR A 1 3 ? -7.124 11.096 0.811 1.00 0.00 ? 3 TYR A N 5 ATOM 1696 C CA . TYR A 1 3 ? -8.463 10.625 0.499 1.00 0.00 ? 3 TYR A CA 5 ATOM 1697 C C . TYR A 1 3 ? -8.422 9.224 -0.113 1.00 0.00 ? 3 TYR A C 5 ATOM 1698 O O . TYR A 1 3 ? -7.564 8.932 -0.944 1.00 0.00 ? 3 TYR A O 5 ATOM 1699 C CB . TYR A 1 3 ? -9.026 11.604 -0.534 1.00 0.00 ? 3 TYR A CB 5 ATOM 1700 C CG . TYR A 1 3 ? -10.464 11.304 -0.955 1.00 0.00 ? 3 TYR A CG 5 ATOM 1701 C CD1 . TYR A 1 3 ? -11.518 11.843 -0.248 1.00 0.00 ? 3 TYR A CD1 5 ATOM 1702 C CD2 . TYR A 1 3 ? -10.708 10.493 -2.046 1.00 0.00 ? 3 TYR A CD2 5 ATOM 1703 C CE1 . TYR A 1 3 ? -12.873 11.562 -0.645 1.00 0.00 ? 3 TYR A CE1 5 ATOM 1704 C CE2 . TYR A 1 3 ? -12.063 10.212 -2.444 1.00 0.00 ? 3 TYR A CE2 5 ATOM 1705 C CZ . TYR A 1 3 ? -13.080 10.760 -1.724 1.00 0.00 ? 3 TYR A CZ 5 ATOM 1706 O OH . TYR A 1 3 ? -14.358 10.493 -2.100 1.00 0.00 ? 3 TYR A OH 5 ATOM 1707 N N . PRO A 1 4 ? -9.385 8.373 0.333 1.00 0.00 ? 4 PRO A N 5 ATOM 1708 C CA . PRO A 1 4 ? -9.466 7.010 -0.163 1.00 0.00 ? 4 PRO A CA 5 ATOM 1709 C C . PRO A 1 4 ? -10.043 6.974 -1.579 1.00 0.00 ? 4 PRO A C 5 ATOM 1710 O O . PRO A 1 4 ? -11.236 7.202 -1.773 1.00 0.00 ? 4 PRO A O 5 ATOM 1711 C CB . PRO A 1 4 ? -10.331 6.274 0.849 1.00 0.00 ? 4 PRO A CB 5 ATOM 1712 C CG . PRO A 1 4 ? -11.080 7.352 1.617 1.00 0.00 ? 4 PRO A CG 5 ATOM 1713 C CD . PRO A 1 4 ? -10.417 8.685 1.317 1.00 0.00 ? 4 PRO A CD 5 ATOM 1714 N N . GLY A 1 5 ? -9.169 6.688 -2.533 1.00 0.00 ? 5 GLY A N 5 ATOM 1715 C CA . GLY A 1 5 ? -9.576 6.620 -3.925 1.00 0.00 ? 5 GLY A CA 5 ATOM 1716 C C . GLY A 1 5 ? -8.587 5.792 -4.747 1.00 0.00 ? 5 GLY A C 5 ATOM 1717 O O . GLY A 1 5 ? -7.447 5.588 -4.331 1.00 0.00 ? 5 GLY A O 5 ATOM 1718 N N . CYS A 1 6 ? -9.056 5.339 -5.900 1.00 0.00 ? 6 CYS A N 5 ATOM 1719 C CA . CYS A 1 6 ? -8.225 4.539 -6.784 1.00 0.00 ? 6 CYS A CA 5 ATOM 1720 C C . CYS A 1 6 ? -9.059 4.155 -8.009 1.00 0.00 ? 6 CYS A C 5 ATOM 1721 O O . CYS A 1 6 ? -9.817 3.186 -7.969 1.00 0.00 ? 6 CYS A O 5 ATOM 1722 C CB . CYS A 1 6 ? -7.661 3.308 -6.069 1.00 0.00 ? 6 CYS A CB 5 ATOM 1723 S SG . CYS A 1 6 ? -5.860 3.063 -6.271 1.00 0.00 ? 6 CYS A SG 5 ATOM 1724 N N . PRO A 1 7 ? -8.885 4.954 -9.094 1.00 0.00 ? 7 PRO A N 5 ATOM 1725 C CA . PRO A 1 7 ? -9.612 4.707 -10.330 1.00 0.00 ? 7 PRO A CA 5 ATOM 1726 C C . PRO A 1 7 ? -9.031 3.507 -11.078 1.00 0.00 ? 7 PRO A C 5 ATOM 1727 O O . PRO A 1 7 ? -8.098 2.865 -10.597 1.00 0.00 ? 7 PRO A O 5 ATOM 1728 C CB . PRO A 1 7 ? -9.504 6.005 -11.115 1.00 0.00 ? 7 PRO A CB 5 ATOM 1729 C CG . PRO A 1 7 ? -8.338 6.765 -10.504 1.00 0.00 ? 7 PRO A CG 5 ATOM 1730 C CD . PRO A 1 7 ? -7.996 6.108 -9.177 1.00 0.00 ? 7 PRO A CD 5 ATOM 1731 N N . SER A 1 8 ? -9.608 3.237 -12.239 1.00 0.00 ? 8 SER A N 5 ATOM 1732 C CA . SER A 1 8 ? -9.160 2.123 -13.057 1.00 0.00 ? 8 SER A CA 5 ATOM 1733 C C . SER A 1 8 ? -7.696 2.323 -13.455 1.00 0.00 ? 8 SER A C 5 ATOM 1734 O O . SER A 1 8 ? -7.025 1.375 -13.864 1.00 0.00 ? 8 SER A O 5 ATOM 1735 C CB . SER A 1 8 ? -10.032 1.971 -14.306 1.00 0.00 ? 8 SER A CB 5 ATOM 1736 O OG . SER A 1 8 ? -9.678 0.819 -15.066 1.00 0.00 ? 8 SER A OG 5 ATOM 1737 N N . SER A 1 9 ? -7.243 3.560 -13.322 1.00 0.00 ? 9 SER A N 5 ATOM 1738 C CA . SER A 1 9 ? -5.870 3.896 -13.662 1.00 0.00 ? 9 SER A CA 5 ATOM 1739 C C . SER A 1 9 ? -4.925 2.800 -13.165 1.00 0.00 ? 9 SER A C 5 ATOM 1740 O O . SER A 1 9 ? -4.149 2.246 -13.942 1.00 0.00 ? 9 SER A O 5 ATOM 1741 C CB . SER A 1 9 ? -5.472 5.250 -13.070 1.00 0.00 ? 9 SER A CB 5 ATOM 1742 O OG . SER A 1 9 ? -4.140 5.615 -13.425 1.00 0.00 ? 9 SER A OG 5 ATOM 1743 N N . TYR A 1 10 ? -5.022 2.520 -11.873 1.00 0.00 ? 10 TYR A N 5 ATOM 1744 C CA . TYR A 1 10 ? -4.185 1.501 -11.265 1.00 0.00 ? 10 TYR A CA 5 ATOM 1745 C C . TYR A 1 10 ? -4.933 0.171 -11.156 1.00 0.00 ? 10 TYR A C 5 ATOM 1746 O O . TYR A 1 10 ? -4.473 -0.848 -11.668 1.00 0.00 ? 10 TYR A O 5 ATOM 1747 C CB . TYR A 1 10 ? -3.862 2.007 -9.857 1.00 0.00 ? 10 TYR A CB 5 ATOM 1748 C CG . TYR A 1 10 ? -3.421 3.472 -9.808 1.00 0.00 ? 10 TYR A CG 5 ATOM 1749 C CD1 . TYR A 1 10 ? -4.364 4.474 -9.723 1.00 0.00 ? 10 TYR A CD1 5 ATOM 1750 C CD2 . TYR A 1 10 ? -2.078 3.789 -9.848 1.00 0.00 ? 10 TYR A CD2 5 ATOM 1751 C CE1 . TYR A 1 10 ? -3.949 5.852 -9.676 1.00 0.00 ? 10 TYR A CE1 5 ATOM 1752 C CE2 . TYR A 1 10 ? -1.663 5.167 -9.803 1.00 0.00 ? 10 TYR A CE2 5 ATOM 1753 C CZ . TYR A 1 10 ? -2.620 6.130 -9.719 1.00 0.00 ? 10 TYR A CZ 5 ATOM 1754 O OH . TYR A 1 10 ? -2.226 7.431 -9.676 1.00 0.00 ? 10 TYR A OH 5 ATOM 1755 N N . ASP A 1 11 ? -6.074 0.223 -10.485 1.00 0.00 ? 11 ASP A N 5 ATOM 1756 C CA . ASP A 1 11 ? -6.890 -0.966 -10.302 1.00 0.00 ? 11 ASP A CA 5 ATOM 1757 C C . ASP A 1 11 ? -6.088 -2.015 -9.532 1.00 0.00 ? 11 ASP A C 5 ATOM 1758 O O . ASP A 1 11 ? -5.550 -2.949 -10.126 1.00 0.00 ? 11 ASP A O 5 ATOM 1759 C CB . ASP A 1 11 ? -7.291 -1.570 -11.649 1.00 0.00 ? 11 ASP A CB 5 ATOM 1760 C CG . ASP A 1 11 ? -8.138 -2.841 -11.561 1.00 0.00 ? 11 ASP A CG 5 ATOM 1761 O OD1 . ASP A 1 11 ? -9.358 -2.781 -11.346 1.00 0.00 ? 11 ASP A OD1 5 ATOM 1762 O OD2 . ASP A 1 11 ? -7.487 -3.942 -11.725 1.00 0.00 ? 11 ASP A OD2 5 ATOM 1763 N N . GLY A 1 12 ? -6.035 -1.828 -8.221 1.00 0.00 ? 12 GLY A N 5 ATOM 1764 C CA . GLY A 1 12 ? -5.308 -2.750 -7.363 1.00 0.00 ? 12 GLY A CA 5 ATOM 1765 C C . GLY A 1 12 ? -3.896 -2.235 -7.079 1.00 0.00 ? 12 GLY A C 5 ATOM 1766 O O . GLY A 1 12 ? -2.956 -3.019 -6.968 1.00 0.00 ? 12 GLY A O 5 ATOM 1767 N N . TYR A 1 13 ? -3.791 -0.918 -6.970 1.00 0.00 ? 13 TYR A N 5 ATOM 1768 C CA . TYR A 1 13 ? -2.508 -0.287 -6.701 1.00 0.00 ? 13 TYR A CA 5 ATOM 1769 C C . TYR A 1 13 ? -1.791 -0.981 -5.540 1.00 0.00 ? 13 TYR A C 5 ATOM 1770 O O . TYR A 1 13 ? -0.567 -0.912 -5.432 1.00 0.00 ? 13 TYR A O 5 ATOM 1771 C CB . TYR A 1 13 ? -2.822 1.155 -6.303 1.00 0.00 ? 13 TYR A CB 5 ATOM 1772 C CG . TYR A 1 13 ? -1.665 2.130 -6.533 1.00 0.00 ? 13 TYR A CG 5 ATOM 1773 C CD1 . TYR A 1 13 ? -1.009 2.147 -7.746 1.00 0.00 ? 13 TYR A CD1 5 ATOM 1774 C CD2 . TYR A 1 13 ? -1.278 2.990 -5.524 1.00 0.00 ? 13 TYR A CD2 5 ATOM 1775 C CE1 . TYR A 1 13 ? 0.080 3.065 -7.963 1.00 0.00 ? 13 TYR A CE1 5 ATOM 1776 C CE2 . TYR A 1 13 ? -0.188 3.907 -5.740 1.00 0.00 ? 13 TYR A CE2 5 ATOM 1777 C CZ . TYR A 1 13 ? 0.436 3.900 -6.949 1.00 0.00 ? 13 TYR A CZ 5 ATOM 1778 O OH . TYR A 1 13 ? 1.466 4.766 -7.152 1.00 0.00 ? 13 TYR A OH 5 ATOM 1779 N N . CYS A 1 14 ? -2.584 -1.631 -4.701 1.00 0.00 ? 14 CYS A N 5 ATOM 1780 C CA . CYS A 1 14 ? -2.040 -2.334 -3.552 1.00 0.00 ? 14 CYS A CA 5 ATOM 1781 C C . CYS A 1 14 ? -2.604 -3.756 -3.547 1.00 0.00 ? 14 CYS A C 5 ATOM 1782 O O . CYS A 1 14 ? -3.812 -3.948 -3.671 1.00 0.00 ? 14 CYS A O 5 ATOM 1783 C CB . CYS A 1 14 ? -2.338 -1.598 -2.244 1.00 0.00 ? 14 CYS A CB 5 ATOM 1784 S SG . CYS A 1 14 ? -2.551 0.212 -2.413 1.00 0.00 ? 14 CYS A SG 5 ATOM 1785 N N . LEU A 1 15 ? -1.703 -4.716 -3.404 1.00 0.00 ? 15 LEU A N 5 ATOM 1786 C CA . LEU A 1 15 ? -2.095 -6.116 -3.382 1.00 0.00 ? 15 LEU A CA 5 ATOM 1787 C C . LEU A 1 15 ? -1.391 -6.820 -2.222 1.00 0.00 ? 15 LEU A C 5 ATOM 1788 O O . LEU A 1 15 ? -0.228 -6.540 -1.935 1.00 0.00 ? 15 LEU A O 5 ATOM 1789 C CB . LEU A 1 15 ? -1.840 -6.764 -4.743 1.00 0.00 ? 15 LEU A CB 5 ATOM 1790 C CG . LEU A 1 15 ? -1.535 -5.808 -5.898 1.00 0.00 ? 15 LEU A CG 5 ATOM 1791 C CD1 . LEU A 1 15 ? -0.036 -5.516 -5.989 1.00 0.00 ? 15 LEU A CD1 5 ATOM 1792 C CD2 . LEU A 1 15 ? -2.098 -6.343 -7.216 1.00 0.00 ? 15 LEU A CD2 5 ATOM 1793 N N . ASN A 1 16 ? -2.125 -7.722 -1.585 1.00 0.00 ? 16 ASN A N 5 ATOM 1794 C CA . ASN A 1 16 ? -1.583 -8.468 -0.464 1.00 0.00 ? 16 ASN A CA 5 ATOM 1795 C C . ASN A 1 16 ? -0.596 -7.587 0.303 1.00 0.00 ? 16 ASN A C 5 ATOM 1796 O O . ASN A 1 16 ? 0.594 -7.895 0.372 1.00 0.00 ? 16 ASN A O 5 ATOM 1797 C CB . ASN A 1 16 ? -0.834 -9.715 -0.941 1.00 0.00 ? 16 ASN A CB 5 ATOM 1798 C CG . ASN A 1 16 ? -0.367 -9.553 -2.389 1.00 0.00 ? 16 ASN A CG 5 ATOM 1799 O OD1 . ASN A 1 16 ? 0.813 -9.458 -2.682 1.00 0.00 ? 16 ASN A OD1 5 ATOM 1800 N ND2 . ASN A 1 16 ? -1.358 -9.527 -3.276 1.00 0.00 ? 16 ASN A ND2 5 ATOM 1801 N N . GLY A 1 17 ? -1.125 -6.508 0.861 1.00 0.00 ? 17 GLY A N 5 ATOM 1802 C CA . GLY A 1 17 ? -0.305 -5.580 1.620 1.00 0.00 ? 17 GLY A CA 5 ATOM 1803 C C . GLY A 1 17 ? -1.175 -4.596 2.404 1.00 0.00 ? 17 GLY A C 5 ATOM 1804 O O . GLY A 1 17 ? -1.383 -4.768 3.606 1.00 0.00 ? 17 GLY A O 5 ATOM 1805 N N . GLY A 1 18 ? -1.659 -3.587 1.696 1.00 0.00 ? 18 GLY A N 5 ATOM 1806 C CA . GLY A 1 18 ? -2.501 -2.576 2.312 1.00 0.00 ? 18 GLY A CA 5 ATOM 1807 C C . GLY A 1 18 ? -3.643 -2.170 1.379 1.00 0.00 ? 18 GLY A C 5 ATOM 1808 O O . GLY A 1 18 ? -4.208 -3.013 0.682 1.00 0.00 ? 18 GLY A O 5 ATOM 1809 N N . VAL A 1 19 ? -3.950 -0.882 1.395 1.00 0.00 ? 19 VAL A N 5 ATOM 1810 C CA . VAL A 1 19 ? -5.013 -0.355 0.558 1.00 0.00 ? 19 VAL A CA 5 ATOM 1811 C C . VAL A 1 19 ? -4.486 0.839 -0.241 1.00 0.00 ? 19 VAL A C 5 ATOM 1812 O O . VAL A 1 19 ? -3.378 1.314 0.004 1.00 0.00 ? 19 VAL A O 5 ATOM 1813 C CB . VAL A 1 19 ? -6.232 -0.008 1.417 1.00 0.00 ? 19 VAL A CB 5 ATOM 1814 C CG1 . VAL A 1 19 ? -7.424 0.385 0.544 1.00 0.00 ? 19 VAL A CG1 5 ATOM 1815 C CG2 . VAL A 1 19 ? -6.592 -1.166 2.348 1.00 0.00 ? 19 VAL A CG2 5 ATOM 1816 N N . CYS A 1 20 ? -5.303 1.291 -1.180 1.00 0.00 ? 20 CYS A N 5 ATOM 1817 C CA . CYS A 1 20 ? -4.933 2.420 -2.016 1.00 0.00 ? 20 CYS A CA 5 ATOM 1818 C C . CYS A 1 20 ? -5.400 3.702 -1.325 1.00 0.00 ? 20 CYS A C 5 ATOM 1819 O O . CYS A 1 20 ? -6.413 3.702 -0.627 1.00 0.00 ? 20 CYS A O 5 ATOM 1820 C CB . CYS A 1 20 ? -5.507 2.291 -3.429 1.00 0.00 ? 20 CYS A CB 5 ATOM 1821 S SG . CYS A 1 20 ? -5.237 3.749 -4.503 1.00 0.00 ? 20 CYS A SG 5 ATOM 1822 N N . MET A 1 21 ? -4.640 4.766 -1.543 1.00 0.00 ? 21 MET A N 5 ATOM 1823 C CA . MET A 1 21 ? -4.964 6.051 -0.952 1.00 0.00 ? 21 MET A CA 5 ATOM 1824 C C . MET A 1 21 ? -4.746 7.187 -1.954 1.00 0.00 ? 21 MET A C 5 ATOM 1825 O O . MET A 1 21 ? -4.076 7.004 -2.968 1.00 0.00 ? 21 MET A O 5 ATOM 1826 C CB . MET A 1 21 ? -4.086 6.283 0.281 1.00 0.00 ? 21 MET A CB 5 ATOM 1827 C CG . MET A 1 21 ? -4.820 5.880 1.561 1.00 0.00 ? 21 MET A CG 5 ATOM 1828 S SD . MET A 1 21 ? -4.270 6.892 2.925 1.00 0.00 ? 21 MET A SD 5 ATOM 1829 C CE . MET A 1 21 ? -5.691 7.951 3.119 1.00 0.00 ? 21 MET A CE 5 ATOM 1830 N N . HIS A 1 22 ? -5.324 8.336 -1.632 1.00 0.00 ? 22 HIS A N 5 ATOM 1831 C CA . HIS A 1 22 ? -5.202 9.500 -2.491 1.00 0.00 ? 22 HIS A CA 5 ATOM 1832 C C . HIS A 1 22 ? -4.592 10.660 -1.702 1.00 0.00 ? 22 HIS A C 5 ATOM 1833 O O . HIS A 1 22 ? -4.974 10.906 -0.557 1.00 0.00 ? 22 HIS A O 5 ATOM 1834 C CB . HIS A 1 22 ? -6.551 9.857 -3.118 1.00 0.00 ? 22 HIS A CB 5 ATOM 1835 C CG . HIS A 1 22 ? -6.443 10.607 -4.425 1.00 0.00 ? 22 HIS A CG 5 ATOM 1836 N ND1 . HIS A 1 22 ? -7.260 11.676 -4.745 1.00 0.00 ? 22 HIS A ND1 5 ATOM 1837 C CD2 . HIS A 1 22 ? -5.604 10.433 -5.486 1.00 0.00 ? 22 HIS A CD2 5 ATOM 1838 C CE1 . HIS A 1 22 ? -6.920 12.116 -5.949 1.00 0.00 ? 22 HIS A CE1 5 ATOM 1839 N NE2 . HIS A 1 22 ? -5.895 11.343 -6.407 1.00 0.00 ? 22 HIS A NE2 5 ATOM 1840 N N . ILE A 1 23 ? -3.653 11.341 -2.341 1.00 0.00 ? 23 ILE A N 5 ATOM 1841 C CA . ILE A 1 23 ? -2.987 12.468 -1.713 1.00 0.00 ? 23 ILE A CA 5 ATOM 1842 C C . ILE A 1 23 ? -3.796 13.742 -1.968 1.00 0.00 ? 23 ILE A C 5 ATOM 1843 O O . ILE A 1 23 ? -3.822 14.643 -1.131 1.00 0.00 ? 23 ILE A O 5 ATOM 1844 C CB . ILE A 1 23 ? -1.533 12.560 -2.179 1.00 0.00 ? 23 ILE A CB 5 ATOM 1845 C CG1 . ILE A 1 23 ? -1.091 11.258 -2.851 1.00 0.00 ? 23 ILE A CG1 5 ATOM 1846 C CG2 . ILE A 1 23 ? -0.609 12.953 -1.025 1.00 0.00 ? 23 ILE A CG2 5 ATOM 1847 C CD1 . ILE A 1 23 ? 0.425 11.072 -2.742 1.00 0.00 ? 23 ILE A CD1 5 ATOM 1848 N N . GLU A 1 24 ? -4.437 13.776 -3.127 1.00 0.00 ? 24 GLU A N 5 ATOM 1849 C CA . GLU A 1 24 ? -5.244 14.923 -3.503 1.00 0.00 ? 24 GLU A CA 5 ATOM 1850 C C . GLU A 1 24 ? -4.354 16.142 -3.749 1.00 0.00 ? 24 GLU A C 5 ATOM 1851 O O . GLU A 1 24 ? -4.374 16.722 -4.833 1.00 0.00 ? 24 GLU A O 5 ATOM 1852 C CB . GLU A 1 24 ? -6.302 15.224 -2.437 1.00 0.00 ? 24 GLU A CB 5 ATOM 1853 C CG . GLU A 1 24 ? -7.670 15.465 -3.076 1.00 0.00 ? 24 GLU A CG 5 ATOM 1854 C CD . GLU A 1 24 ? -8.596 14.268 -2.858 1.00 0.00 ? 24 GLU A CD 5 ATOM 1855 O OE1 . GLU A 1 24 ? -9.070 14.047 -1.732 1.00 0.00 ? 24 GLU A OE1 5 ATOM 1856 O OE2 . GLU A 1 24 ? -8.820 13.553 -3.907 1.00 0.00 ? 24 GLU A OE2 5 ATOM 1857 N N . SER A 1 25 ? -3.591 16.494 -2.723 1.00 0.00 ? 25 SER A N 5 ATOM 1858 C CA . SER A 1 25 ? -2.695 17.634 -2.814 1.00 0.00 ? 25 SER A CA 5 ATOM 1859 C C . SER A 1 25 ? -1.782 17.485 -4.035 1.00 0.00 ? 25 SER A C 5 ATOM 1860 O O . SER A 1 25 ? -1.195 18.462 -4.496 1.00 0.00 ? 25 SER A O 5 ATOM 1861 C CB . SER A 1 25 ? -1.858 17.780 -1.541 1.00 0.00 ? 25 SER A CB 5 ATOM 1862 O OG . SER A 1 25 ? -1.055 18.955 -1.563 1.00 0.00 ? 25 SER A OG 5 ATOM 1863 N N . LEU A 1 26 ? -1.693 16.258 -4.521 1.00 0.00 ? 26 LEU A N 5 ATOM 1864 C CA . LEU A 1 26 ? -0.863 15.968 -5.679 1.00 0.00 ? 26 LEU A CA 5 ATOM 1865 C C . LEU A 1 26 ? -1.664 15.130 -6.679 1.00 0.00 ? 26 LEU A C 5 ATOM 1866 O O . LEU A 1 26 ? -1.093 14.532 -7.589 1.00 0.00 ? 26 LEU A O 5 ATOM 1867 C CB . LEU A 1 26 ? 0.451 15.319 -5.246 1.00 0.00 ? 26 LEU A CB 5 ATOM 1868 C CG . LEU A 1 26 ? 1.697 16.203 -5.333 1.00 0.00 ? 26 LEU A CG 5 ATOM 1869 C CD1 . LEU A 1 26 ? 2.322 16.136 -6.727 1.00 0.00 ? 26 LEU A CD1 5 ATOM 1870 C CD2 . LEU A 1 26 ? 1.379 17.641 -4.917 1.00 0.00 ? 26 LEU A CD2 5 ATOM 1871 N N . ASP A 1 27 ? -2.973 15.115 -6.475 1.00 0.00 ? 27 ASP A N 5 ATOM 1872 C CA . ASP A 1 27 ? -3.857 14.363 -7.347 1.00 0.00 ? 27 ASP A CA 5 ATOM 1873 C C . ASP A 1 27 ? -3.241 12.990 -7.628 1.00 0.00 ? 27 ASP A C 5 ATOM 1874 O O . ASP A 1 27 ? -3.473 12.406 -8.686 1.00 0.00 ? 27 ASP A O 5 ATOM 1875 C CB . ASP A 1 27 ? -4.049 15.077 -8.688 1.00 0.00 ? 27 ASP A CB 5 ATOM 1876 C CG . ASP A 1 27 ? -5.460 14.980 -9.274 1.00 0.00 ? 27 ASP A CG 5 ATOM 1877 O OD1 . ASP A 1 27 ? -6.309 15.820 -8.790 1.00 0.00 ? 27 ASP A OD1 5 ATOM 1878 O OD2 . ASP A 1 27 ? -5.730 14.145 -10.149 1.00 0.00 ? 27 ASP A OD2 5 ATOM 1879 N N . SER A 1 28 ? -2.468 12.514 -6.662 1.00 0.00 ? 28 SER A N 5 ATOM 1880 C CA . SER A 1 28 ? -1.818 11.223 -6.791 1.00 0.00 ? 28 SER A CA 5 ATOM 1881 C C . SER A 1 28 ? -2.499 10.200 -5.881 1.00 0.00 ? 28 SER A C 5 ATOM 1882 O O . SER A 1 28 ? -3.057 10.560 -4.844 1.00 0.00 ? 28 SER A O 5 ATOM 1883 C CB . SER A 1 28 ? -0.328 11.319 -6.459 1.00 0.00 ? 28 SER A CB 5 ATOM 1884 O OG . SER A 1 28 ? 0.367 10.113 -6.757 1.00 0.00 ? 28 SER A OG 5 ATOM 1885 N N . TYR A 1 29 ? -2.432 8.944 -6.298 1.00 0.00 ? 29 TYR A N 5 ATOM 1886 C CA . TYR A 1 29 ? -3.035 7.867 -5.532 1.00 0.00 ? 29 TYR A CA 5 ATOM 1887 C C . TYR A 1 29 ? -1.964 6.963 -4.919 1.00 0.00 ? 29 TYR A C 5 ATOM 1888 O O . TYR A 1 29 ? -1.394 6.116 -5.605 1.00 0.00 ? 29 TYR A O 5 ATOM 1889 C CB . TYR A 1 29 ? -3.862 7.052 -6.530 1.00 0.00 ? 29 TYR A CB 5 ATOM 1890 C CG . TYR A 1 29 ? -5.117 7.772 -7.031 1.00 0.00 ? 29 TYR A CG 5 ATOM 1891 C CD1 . TYR A 1 29 ? -6.289 7.703 -6.306 1.00 0.00 ? 29 TYR A CD1 5 ATOM 1892 C CD2 . TYR A 1 29 ? -5.073 8.491 -8.210 1.00 0.00 ? 29 TYR A CD2 5 ATOM 1893 C CE1 . TYR A 1 29 ? -7.468 8.381 -6.780 1.00 0.00 ? 29 TYR A CE1 5 ATOM 1894 C CE2 . TYR A 1 29 ? -6.253 9.167 -8.683 1.00 0.00 ? 29 TYR A CE2 5 ATOM 1895 C CZ . TYR A 1 29 ? -7.393 9.079 -7.944 1.00 0.00 ? 29 TYR A CZ 5 ATOM 1896 O OH . TYR A 1 29 ? -8.507 9.719 -8.391 1.00 0.00 ? 29 TYR A OH 5 ATOM 1897 N N . THR A 1 30 ? -1.722 7.175 -3.634 1.00 0.00 ? 30 THR A N 5 ATOM 1898 C CA . THR A 1 30 ? -0.729 6.389 -2.920 1.00 0.00 ? 30 THR A CA 5 ATOM 1899 C C . THR A 1 30 ? -1.283 5.002 -2.589 1.00 0.00 ? 30 THR A C 5 ATOM 1900 O O . THR A 1 30 ? -2.311 4.595 -3.129 1.00 0.00 ? 30 THR A O 5 ATOM 1901 C CB . THR A 1 30 ? -0.299 7.183 -1.685 1.00 0.00 ? 30 THR A CB 5 ATOM 1902 O OG1 . THR A 1 30 ? 0.765 6.412 -1.131 1.00 0.00 ? 30 THR A OG1 5 ATOM 1903 C CG2 . THR A 1 30 ? -1.365 7.186 -0.588 1.00 0.00 ? 30 THR A CG2 5 ATOM 1904 N N . CYS A 1 31 ? -0.577 4.314 -1.703 1.00 0.00 ? 31 CYS A N 5 ATOM 1905 C CA . CYS A 1 31 ? -0.987 2.982 -1.292 1.00 0.00 ? 31 CYS A CA 5 ATOM 1906 C C . CYS A 1 31 ? -0.404 2.706 0.093 1.00 0.00 ? 31 CYS A C 5 ATOM 1907 O O . CYS A 1 31 ? 0.806 2.533 0.240 1.00 0.00 ? 31 CYS A O 5 ATOM 1908 C CB . CYS A 1 31 ? -0.563 1.923 -2.313 1.00 0.00 ? 31 CYS A CB 5 ATOM 1909 S SG . CYS A 1 31 ? -1.933 0.912 -2.984 1.00 0.00 ? 31 CYS A SG 5 ATOM 1910 N N . ASN A 1 32 ? -1.290 2.674 1.078 1.00 0.00 ? 32 ASN A N 5 ATOM 1911 C CA . ASN A 1 32 ? -0.878 2.421 2.449 1.00 0.00 ? 32 ASN A CA 5 ATOM 1912 C C . ASN A 1 32 ? -0.763 0.912 2.672 1.00 0.00 ? 32 ASN A C 5 ATOM 1913 O O . ASN A 1 32 ? -1.686 0.285 3.193 1.00 0.00 ? 32 ASN A O 5 ATOM 1914 C CB . ASN A 1 32 ? -1.904 2.968 3.442 1.00 0.00 ? 32 ASN A CB 5 ATOM 1915 C CG . ASN A 1 32 ? -3.302 2.429 3.140 1.00 0.00 ? 32 ASN A CG 5 ATOM 1916 O OD1 . ASN A 1 32 ? -3.492 1.543 2.321 1.00 0.00 ? 32 ASN A OD1 5 ATOM 1917 N ND2 . ASN A 1 32 ? -4.271 3.011 3.843 1.00 0.00 ? 32 ASN A ND2 5 ATOM 1918 N N . CYS A 1 33 ? 0.375 0.370 2.266 1.00 0.00 ? 33 CYS A N 5 ATOM 1919 C CA . CYS A 1 33 ? 0.622 -1.054 2.416 1.00 0.00 ? 33 CYS A CA 5 ATOM 1920 C C . CYS A 1 33 ? 0.547 -1.401 3.903 1.00 0.00 ? 33 CYS A C 5 ATOM 1921 O O . CYS A 1 33 ? -0.067 -0.674 4.685 1.00 0.00 ? 33 CYS A O 5 ATOM 1922 C CB . CYS A 1 33 ? 1.964 -1.464 1.802 1.00 0.00 ? 33 CYS A CB 5 ATOM 1923 S SG . CYS A 1 33 ? 1.908 -2.978 0.777 1.00 0.00 ? 33 CYS A SG 5 ATOM 1924 N N . VAL A 1 34 ? 1.178 -2.513 4.252 1.00 0.00 ? 34 VAL A N 5 ATOM 1925 C CA . VAL A 1 34 ? 1.189 -2.965 5.634 1.00 0.00 ? 34 VAL A CA 5 ATOM 1926 C C . VAL A 1 34 ? 2.495 -3.715 5.909 1.00 0.00 ? 34 VAL A C 5 ATOM 1927 O O . VAL A 1 34 ? 3.445 -3.616 5.138 1.00 0.00 ? 34 VAL A O 5 ATOM 1928 C CB . VAL A 1 34 ? -0.056 -3.806 5.919 1.00 0.00 ? 34 VAL A CB 5 ATOM 1929 C CG1 . VAL A 1 34 ? 0.199 -5.284 5.619 1.00 0.00 ? 34 VAL A CG1 5 ATOM 1930 C CG2 . VAL A 1 34 ? -0.530 -3.613 7.362 1.00 0.00 ? 34 VAL A CG2 5 ATOM 1931 N N . ILE A 1 35 ? 2.495 -4.448 7.013 1.00 0.00 ? 35 ILE A N 5 ATOM 1932 C CA . ILE A 1 35 ? 3.668 -5.216 7.399 1.00 0.00 ? 35 ILE A CA 5 ATOM 1933 C C . ILE A 1 35 ? 3.864 -6.369 6.413 1.00 0.00 ? 35 ILE A C 5 ATOM 1934 O O . ILE A 1 35 ? 2.904 -7.034 6.030 1.00 0.00 ? 35 ILE A O 5 ATOM 1935 C CB . ILE A 1 35 ? 3.555 -5.667 8.857 1.00 0.00 ? 35 ILE A CB 5 ATOM 1936 C CG1 . ILE A 1 35 ? 2.761 -4.654 9.685 1.00 0.00 ? 35 ILE A CG1 5 ATOM 1937 C CG2 . ILE A 1 35 ? 4.937 -5.935 9.456 1.00 0.00 ? 35 ILE A CG2 5 ATOM 1938 C CD1 . ILE A 1 35 ? 3.109 -4.764 11.170 1.00 0.00 ? 35 ILE A CD1 5 ATOM 1939 N N . GLY A 1 36 ? 5.117 -6.570 6.032 1.00 0.00 ? 36 GLY A N 5 ATOM 1940 C CA . GLY A 1 36 ? 5.453 -7.631 5.097 1.00 0.00 ? 36 GLY A CA 5 ATOM 1941 C C . GLY A 1 36 ? 4.934 -7.311 3.694 1.00 0.00 ? 36 GLY A C 5 ATOM 1942 O O . GLY A 1 36 ? 4.734 -8.215 2.882 1.00 0.00 ? 36 GLY A O 5 ATOM 1943 N N . TYR A 1 37 ? 4.727 -6.027 3.453 1.00 0.00 ? 37 TYR A N 5 ATOM 1944 C CA . TYR A 1 37 ? 4.233 -5.577 2.162 1.00 0.00 ? 37 TYR A CA 5 ATOM 1945 C C . TYR A 1 37 ? 4.392 -4.063 2.011 1.00 0.00 ? 37 TYR A C 5 ATOM 1946 O O . TYR A 1 37 ? 3.887 -3.297 2.829 1.00 0.00 ? 37 TYR A O 5 ATOM 1947 C CB . TYR A 1 37 ? 2.743 -5.926 2.136 1.00 0.00 ? 37 TYR A CB 5 ATOM 1948 C CG . TYR A 1 37 ? 2.457 -7.427 2.071 1.00 0.00 ? 37 TYR A CG 5 ATOM 1949 C CD1 . TYR A 1 37 ? 2.993 -8.188 1.053 1.00 0.00 ? 37 TYR A CD1 5 ATOM 1950 C CD2 . TYR A 1 37 ? 1.663 -8.020 3.032 1.00 0.00 ? 37 TYR A CD2 5 ATOM 1951 C CE1 . TYR A 1 37 ? 2.723 -9.602 0.991 1.00 0.00 ? 37 TYR A CE1 5 ATOM 1952 C CE2 . TYR A 1 37 ? 1.393 -9.433 2.970 1.00 0.00 ? 37 TYR A CE2 5 ATOM 1953 C CZ . TYR A 1 37 ? 1.936 -10.154 1.954 1.00 0.00 ? 37 TYR A CZ 5 ATOM 1954 O OH . TYR A 1 37 ? 1.682 -11.488 1.896 1.00 0.00 ? 37 TYR A OH 5 ATOM 1955 N N . SER A 1 38 ? 5.097 -3.677 0.957 1.00 0.00 ? 38 SER A N 5 ATOM 1956 C CA . SER A 1 38 ? 5.330 -2.268 0.687 1.00 0.00 ? 38 SER A CA 5 ATOM 1957 C C . SER A 1 38 ? 5.954 -2.096 -0.699 1.00 0.00 ? 38 SER A C 5 ATOM 1958 O O . SER A 1 38 ? 6.173 -3.075 -1.411 1.00 0.00 ? 38 SER A O 5 ATOM 1959 C CB . SER A 1 38 ? 6.229 -1.645 1.756 1.00 0.00 ? 38 SER A CB 5 ATOM 1960 O OG . SER A 1 38 ? 5.660 -1.747 3.059 1.00 0.00 ? 38 SER A OG 5 ATOM 1961 N N . GLY A 1 39 ? 6.225 -0.845 -1.039 1.00 0.00 ? 39 GLY A N 5 ATOM 1962 C CA . GLY A 1 39 ? 6.820 -0.533 -2.328 1.00 0.00 ? 39 GLY A CA 5 ATOM 1963 C C . GLY A 1 39 ? 5.845 0.252 -3.207 1.00 0.00 ? 39 GLY A C 5 ATOM 1964 O O . GLY A 1 39 ? 5.606 -0.119 -4.355 1.00 0.00 ? 39 GLY A O 5 ATOM 1965 N N . ASP A 1 40 ? 5.308 1.319 -2.635 1.00 0.00 ? 40 ASP A N 5 ATOM 1966 C CA . ASP A 1 40 ? 4.365 2.159 -3.352 1.00 0.00 ? 40 ASP A CA 5 ATOM 1967 C C . ASP A 1 40 ? 3.042 1.405 -3.517 1.00 0.00 ? 40 ASP A C 5 ATOM 1968 O O . ASP A 1 40 ? 2.004 1.854 -3.031 1.00 0.00 ? 40 ASP A O 5 ATOM 1969 C CB . ASP A 1 40 ? 4.886 2.505 -4.748 1.00 0.00 ? 40 ASP A CB 5 ATOM 1970 C CG . ASP A 1 40 ? 4.192 3.691 -5.421 1.00 0.00 ? 40 ASP A CG 5 ATOM 1971 O OD1 . ASP A 1 40 ? 4.623 4.853 -5.059 1.00 0.00 ? 40 ASP A OD1 5 ATOM 1972 O OD2 . ASP A 1 40 ? 3.286 3.514 -6.249 1.00 0.00 ? 40 ASP A OD2 5 ATOM 1973 N N . ARG A 1 41 ? 3.123 0.274 -4.199 1.00 0.00 ? 41 ARG A N 5 ATOM 1974 C CA . ARG A 1 41 ? 1.945 -0.543 -4.434 1.00 0.00 ? 41 ARG A CA 5 ATOM 1975 C C . ARG A 1 41 ? 1.722 -1.501 -3.261 1.00 0.00 ? 41 ARG A C 5 ATOM 1976 O O . ARG A 1 41 ? 0.946 -1.207 -2.353 1.00 0.00 ? 41 ARG A O 5 ATOM 1977 C CB . ARG A 1 41 ? 2.083 -1.355 -5.724 1.00 0.00 ? 41 ARG A CB 5 ATOM 1978 C CG . ARG A 1 41 ? 1.926 -0.458 -6.953 1.00 0.00 ? 41 ARG A CG 5 ATOM 1979 C CD . ARG A 1 41 ? 2.543 -1.111 -8.192 1.00 0.00 ? 41 ARG A CD 5 ATOM 1980 N NE . ARG A 1 41 ? 1.942 -2.444 -8.413 1.00 0.00 ? 41 ARG A NE 5 ATOM 1981 C CZ . ARG A 1 41 ? 2.632 -3.603 -8.369 1.00 0.00 ? 41 ARG A CZ 5 ATOM 1982 N NH1 . ARG A 1 41 ? 3.256 -4.074 -9.469 1.00 0.00 ? 41 ARG A NH1 5 ATOM 1983 N NH2 . ARG A 1 41 ? 2.687 -4.272 -7.230 1.00 0.00 ? 41 ARG A NH2 5 ATOM 1984 N N . CYS A 1 42 ? 2.418 -2.627 -3.317 1.00 0.00 ? 42 CYS A N 5 ATOM 1985 C CA . CYS A 1 42 ? 2.308 -3.630 -2.271 1.00 0.00 ? 42 CYS A CA 5 ATOM 1986 C C . CYS A 1 42 ? 2.654 -4.993 -2.872 1.00 0.00 ? 42 CYS A C 5 ATOM 1987 O O . CYS A 1 42 ? 1.793 -5.659 -3.443 1.00 0.00 ? 42 CYS A O 5 ATOM 1988 C CB . CYS A 1 42 ? 0.920 -3.625 -1.628 1.00 0.00 ? 42 CYS A CB 5 ATOM 1989 S SG . CYS A 1 42 ? 0.802 -2.688 -0.061 1.00 0.00 ? 42 CYS A SG 5 ATOM 1990 N N . GLN A 1 43 ? 3.917 -5.366 -2.722 1.00 0.00 ? 43 GLN A N 5 ATOM 1991 C CA . GLN A 1 43 ? 4.385 -6.639 -3.243 1.00 0.00 ? 43 GLN A CA 5 ATOM 1992 C C . GLN A 1 43 ? 5.637 -7.093 -2.488 1.00 0.00 ? 43 GLN A C 5 ATOM 1993 O O . GLN A 1 43 ? 5.798 -8.278 -2.203 1.00 0.00 ? 43 GLN A O 5 ATOM 1994 C CB . GLN A 1 43 ? 4.654 -6.550 -4.747 1.00 0.00 ? 43 GLN A CB 5 ATOM 1995 C CG . GLN A 1 43 ? 6.060 -6.010 -5.020 1.00 0.00 ? 43 GLN A CG 5 ATOM 1996 C CD . GLN A 1 43 ? 6.144 -4.515 -4.707 1.00 0.00 ? 43 GLN A CD 5 ATOM 1997 O OE1 . GLN A 1 43 ? 6.085 -4.090 -3.566 1.00 0.00 ? 43 GLN A OE1 5 ATOM 1998 N NE2 . GLN A 1 43 ? 6.286 -3.744 -5.782 1.00 0.00 ? 43 GLN A NE2 5 ATOM 1999 N N . THR A 1 44 ? 6.490 -6.125 -2.187 1.00 0.00 ? 44 THR A N 5 ATOM 2000 C CA . THR A 1 44 ? 7.722 -6.410 -1.471 1.00 0.00 ? 44 THR A CA 5 ATOM 2001 C C . THR A 1 44 ? 7.440 -6.592 0.023 1.00 0.00 ? 44 THR A C 5 ATOM 2002 O O . THR A 1 44 ? 6.837 -5.726 0.655 1.00 0.00 ? 44 THR A O 5 ATOM 2003 C CB . THR A 1 44 ? 8.712 -5.285 -1.768 1.00 0.00 ? 44 THR A CB 5 ATOM 2004 O OG1 . THR A 1 44 ? 9.225 -5.604 -3.060 1.00 0.00 ? 44 THR A OG1 5 ATOM 2005 C CG2 . THR A 1 44 ? 9.942 -5.330 -0.858 1.00 0.00 ? 44 THR A CG2 5 ATOM 2006 N N . ARG A 1 45 ? 7.889 -7.725 0.543 1.00 0.00 ? 45 ARG A N 5 ATOM 2007 C CA . ARG A 1 45 ? 7.693 -8.033 1.949 1.00 0.00 ? 45 ARG A CA 5 ATOM 2008 C C . ARG A 1 45 ? 8.688 -7.251 2.807 1.00 0.00 ? 45 ARG A C 5 ATOM 2009 O O . ARG A 1 45 ? 9.858 -7.616 2.895 1.00 0.00 ? 45 ARG A O 5 ATOM 2010 C CB . ARG A 1 45 ? 7.868 -9.529 2.215 1.00 0.00 ? 45 ARG A CB 5 ATOM 2011 C CG . ARG A 1 45 ? 6.725 -10.070 3.076 1.00 0.00 ? 45 ARG A CG 5 ATOM 2012 C CD . ARG A 1 45 ? 7.051 -11.468 3.605 1.00 0.00 ? 45 ARG A CD 5 ATOM 2013 N NE . ARG A 1 45 ? 6.780 -12.481 2.560 1.00 0.00 ? 45 ARG A NE 5 ATOM 2014 C CZ . ARG A 1 45 ? 6.282 -13.710 2.808 1.00 0.00 ? 45 ARG A CZ 5 ATOM 2015 N NH1 . ARG A 1 45 ? 7.105 -14.737 3.101 1.00 0.00 ? 45 ARG A NH1 5 ATOM 2016 N NH2 . ARG A 1 45 ? 4.975 -13.893 2.760 1.00 0.00 ? 45 ARG A NH2 5 ATOM 2017 N N . ASP A 1 46 ? 8.186 -6.188 3.419 1.00 0.00 ? 46 ASP A N 5 ATOM 2018 C CA . ASP A 1 46 ? 9.016 -5.350 4.267 1.00 0.00 ? 46 ASP A CA 5 ATOM 2019 C C . ASP A 1 46 ? 8.734 -5.679 5.734 1.00 0.00 ? 46 ASP A C 5 ATOM 2020 O O . ASP A 1 46 ? 8.084 -6.678 6.037 1.00 0.00 ? 46 ASP A O 5 ATOM 2021 C CB . ASP A 1 46 ? 8.708 -3.867 4.046 1.00 0.00 ? 46 ASP A CB 5 ATOM 2022 C CG . ASP A 1 46 ? 9.348 -3.254 2.799 1.00 0.00 ? 46 ASP A CG 5 ATOM 2023 O OD1 . ASP A 1 46 ? 8.814 -3.614 1.680 1.00 0.00 ? 46 ASP A OD1 5 ATOM 2024 O OD2 . ASP A 1 46 ? 10.304 -2.471 2.890 1.00 0.00 ? 46 ASP A OD2 5 ATOM 2025 N N . LEU A 1 47 ? 9.234 -4.816 6.607 1.00 0.00 ? 47 LEU A N 5 ATOM 2026 C CA . LEU A 1 47 ? 9.043 -5.002 8.035 1.00 0.00 ? 47 LEU A CA 5 ATOM 2027 C C . LEU A 1 47 ? 9.581 -6.375 8.443 1.00 0.00 ? 47 LEU A C 5 ATOM 2028 O O . LEU A 1 47 ? 10.779 -6.532 8.675 1.00 0.00 ? 47 LEU A O 5 ATOM 2029 C CB . LEU A 1 47 ? 7.577 -4.779 8.414 1.00 0.00 ? 47 LEU A CB 5 ATOM 2030 C CG . LEU A 1 47 ? 7.028 -3.374 8.166 1.00 0.00 ? 47 LEU A CG 5 ATOM 2031 C CD1 . LEU A 1 47 ? 8.027 -2.306 8.612 1.00 0.00 ? 47 LEU A CD1 5 ATOM 2032 C CD2 . LEU A 1 47 ? 6.612 -3.196 6.704 1.00 0.00 ? 47 LEU A CD2 5 ATOM 2033 N N . ARG A 1 48 ? 8.671 -7.335 8.519 1.00 0.00 ? 48 ARG A N 5 ATOM 2034 C CA . ARG A 1 48 ? 9.039 -8.688 8.894 1.00 0.00 ? 48 ARG A CA 5 ATOM 2035 C C . ARG A 1 48 ? 9.808 -8.681 10.217 1.00 0.00 ? 48 ARG A C 5 ATOM 2036 O O . ARG A 1 48 ? 10.666 -9.534 10.445 1.00 0.00 ? 48 ARG A O 5 ATOM 2037 C CB . ARG A 1 48 ? 9.901 -9.344 7.814 1.00 0.00 ? 48 ARG A CB 5 ATOM 2038 C CG . ARG A 1 48 ? 9.885 -10.869 7.948 1.00 0.00 ? 48 ARG A CG 5 ATOM 2039 C CD . ARG A 1 48 ? 10.969 -11.508 7.081 1.00 0.00 ? 48 ARG A CD 5 ATOM 2040 N NE . ARG A 1 48 ? 12.249 -11.547 7.820 1.00 0.00 ? 48 ARG A NE 5 ATOM 2041 C CZ . ARG A 1 48 ? 13.305 -10.750 7.547 1.00 0.00 ? 48 ARG A CZ 5 ATOM 2042 N NH1 . ARG A 1 48 ? 14.093 -11.054 6.532 1.00 0.00 ? 48 ARG A NH1 5 ATOM 2043 N NH2 . ARG A 1 48 ? 13.553 -9.659 8.302 1.00 0.00 ? 48 ARG A NH2 5 ATOM 2044 N N . TRP A 1 49 ? 9.475 -7.709 11.053 1.00 0.00 ? 49 TRP A N 5 ATOM 2045 C CA . TRP A 1 49 ? 10.125 -7.581 12.347 1.00 0.00 ? 49 TRP A CA 5 ATOM 2046 C C . TRP A 1 49 ? 9.310 -8.380 13.366 1.00 0.00 ? 49 TRP A C 5 ATOM 2047 O O . TRP A 1 49 ? 9.459 -8.190 14.572 1.00 0.00 ? 49 TRP A O 5 ATOM 2048 C CB . TRP A 1 49 ? 10.287 -6.110 12.734 1.00 0.00 ? 49 TRP A CB 5 ATOM 2049 C CG . TRP A 1 49 ? 9.024 -5.270 12.534 1.00 0.00 ? 49 TRP A CG 5 ATOM 2050 C CD1 . TRP A 1 49 ? 7.756 -5.693 12.441 1.00 0.00 ? 49 TRP A CD1 5 ATOM 2051 C CD2 . TRP A 1 49 ? 8.960 -3.834 12.404 1.00 0.00 ? 49 TRP A CD2 5 ATOM 2052 N NE1 . TRP A 1 49 ? 6.883 -4.641 12.262 1.00 0.00 ? 49 TRP A NE1 5 ATOM 2053 C CE2 . TRP A 1 49 ? 7.637 -3.473 12.239 1.00 0.00 ? 49 TRP A CE2 5 ATOM 2054 C CE3 . TRP A 1 49 ? 9.981 -2.871 12.425 1.00 0.00 ? 49 TRP A CE3 5 ATOM 2055 C CZ2 . TRP A 1 49 ? 7.217 -2.147 12.083 1.00 0.00 ? 49 TRP A CZ2 5 ATOM 2056 C CZ3 . TRP A 1 49 ? 9.546 -1.549 12.267 1.00 0.00 ? 49 TRP A CZ3 5 ATOM 2057 C CH2 . TRP A 1 49 ? 8.220 -1.171 12.100 1.00 0.00 ? 49 TRP A CH2 5 ATOM 2058 N N . TRP A 1 50 ? 8.464 -9.256 12.844 1.00 0.00 ? 50 TRP A N 5 ATOM 2059 C CA . TRP A 1 50 ? 7.625 -10.085 13.694 1.00 0.00 ? 50 TRP A CA 5 ATOM 2060 C C . TRP A 1 50 ? 7.719 -11.526 13.189 1.00 0.00 ? 50 TRP A C 5 ATOM 2061 O O . TRP A 1 50 ? 6.929 -12.380 13.588 1.00 0.00 ? 50 TRP A O 5 ATOM 2062 C CB . TRP A 1 50 ? 6.190 -9.556 13.730 1.00 0.00 ? 50 TRP A CB 5 ATOM 2063 C CG . TRP A 1 50 ? 5.544 -9.411 12.351 1.00 0.00 ? 50 TRP A CG 5 ATOM 2064 C CD1 . TRP A 1 50 ? 6.021 -8.756 11.282 1.00 0.00 ? 50 TRP A CD1 5 ATOM 2065 C CD2 . TRP A 1 50 ? 4.279 -9.962 11.932 1.00 0.00 ? 50 TRP A CD2 5 ATOM 2066 N NE1 . TRP A 1 50 ? 5.158 -8.845 10.209 1.00 0.00 ? 50 TRP A NE1 5 ATOM 2067 C CE2 . TRP A 1 50 ? 4.064 -9.600 10.615 1.00 0.00 ? 50 TRP A CE2 5 ATOM 2068 C CE3 . TRP A 1 50 ? 3.346 -10.739 12.639 1.00 0.00 ? 50 TRP A CE3 5 ATOM 2069 C CZ2 . TRP A 1 50 ? 2.923 -9.973 9.896 1.00 0.00 ? 50 TRP A CZ2 5 ATOM 2070 C CZ3 . TRP A 1 50 ? 2.210 -11.103 11.906 1.00 0.00 ? 50 TRP A CZ3 5 ATOM 2071 C CH2 . TRP A 1 50 ? 1.980 -10.748 10.580 1.00 0.00 ? 50 TRP A CH2 5 ATOM 2072 N N . GLU A 1 51 ? 8.692 -11.751 12.319 1.00 0.00 ? 51 GLU A N 5 ATOM 2073 C CA . GLU A 1 51 ? 8.899 -13.076 11.756 1.00 0.00 ? 51 GLU A CA 5 ATOM 2074 C C . GLU A 1 51 ? 10.301 -13.180 11.147 1.00 0.00 ? 51 GLU A C 5 ATOM 2075 O O . GLU A 1 51 ? 10.880 -12.175 10.740 1.00 0.00 ? 51 GLU A O 5 ATOM 2076 C CB . GLU A 1 51 ? 7.826 -13.403 10.718 1.00 0.00 ? 51 GLU A CB 5 ATOM 2077 C CG . GLU A 1 51 ? 8.003 -12.555 9.458 1.00 0.00 ? 51 GLU A CG 5 ATOM 2078 C CD . GLU A 1 51 ? 6.837 -12.763 8.487 1.00 0.00 ? 51 GLU A CD 5 ATOM 2079 O OE1 . GLU A 1 51 ? 5.669 -12.663 8.893 1.00 0.00 ? 51 GLU A OE1 5 ATOM 2080 O OE2 . GLU A 1 51 ? 7.179 -13.035 7.274 1.00 0.00 ? 51 GLU A OE2 5 ATOM 2081 N N . LEU A 1 52 ? 10.802 -14.406 11.105 1.00 0.00 ? 52 LEU A N 5 ATOM 2082 C CA . LEU A 1 52 ? 12.124 -14.655 10.554 1.00 0.00 ? 52 LEU A CA 5 ATOM 2083 C C . LEU A 1 52 ? 11.987 -15.091 9.094 1.00 0.00 ? 52 LEU A C 5 ATOM 2084 O O . LEU A 1 52 ? 12.619 -14.514 8.209 1.00 0.00 ? 52 LEU A O 5 ATOM 2085 C CB . LEU A 1 52 ? 12.888 -15.652 11.426 1.00 0.00 ? 52 LEU A CB 5 ATOM 2086 C CG . LEU A 1 52 ? 13.668 -15.059 12.599 1.00 0.00 ? 52 LEU A CG 5 ATOM 2087 C CD1 . LEU A 1 52 ? 14.860 -14.236 12.106 1.00 0.00 ? 52 LEU A CD1 5 ATOM 2088 C CD2 . LEU A 1 52 ? 12.749 -14.244 13.513 1.00 0.00 ? 52 LEU A CD2 5 ATOM 2089 N N . ARG A 1 53 ? 11.161 -16.105 8.887 1.00 0.00 ? 53 ARG A N 5 ATOM 2090 C CA . ARG A 1 53 ? 10.935 -16.624 7.549 1.00 0.00 ? 53 ARG A CA 5 ATOM 2091 C C . ARG A 1 53 ? 10.219 -15.581 6.688 1.00 0.00 ? 53 ARG A C 5 ATOM 2092 O O . ARG A 1 53 ? 9.607 -14.653 7.213 1.00 0.00 ? 53 ARG A O 5 ATOM 2093 C CB . ARG A 1 53 ? 10.096 -17.904 7.590 1.00 0.00 ? 53 ARG A CB 5 ATOM 2094 C CG . ARG A 1 53 ? 8.629 -17.588 7.890 1.00 0.00 ? 53 ARG A CG 5 ATOM 2095 C CD . ARG A 1 53 ? 7.878 -18.846 8.333 1.00 0.00 ? 53 ARG A CD 5 ATOM 2096 N NE . ARG A 1 53 ? 8.159 -19.126 9.759 1.00 0.00 ? 53 ARG A NE 5 ATOM 2097 C CZ . ARG A 1 53 ? 7.341 -18.777 10.774 1.00 0.00 ? 53 ARG A CZ 5 ATOM 2098 N NH1 . ARG A 1 53 ? 7.443 -17.559 11.350 1.00 0.00 ? 53 ARG A NH1 5 ATOM 2099 N NH2 . ARG A 1 53 ? 6.438 -19.643 11.198 1.00 0.00 ? 53 ARG A NH2 5 ATOM 2100 O OXT . ARG A 1 53 ? 10.318 -15.765 5.415 1.00 0.00 ? 53 ARG A OXT 5 ATOM 2101 N N . ASN A 1 1 ? -2.134 15.643 1.497 1.00 0.00 ? 1 ASN A N 6 ATOM 2102 C CA . ASN A 1 1 ? -3.182 15.039 2.301 1.00 0.00 ? 1 ASN A CA 6 ATOM 2103 C C . ASN A 1 1 ? -3.680 13.767 1.611 1.00 0.00 ? 1 ASN A C 6 ATOM 2104 O O . ASN A 1 1 ? -3.939 13.770 0.407 1.00 0.00 ? 1 ASN A O 6 ATOM 2105 C CB . ASN A 1 1 ? -4.372 15.988 2.459 1.00 0.00 ? 1 ASN A CB 6 ATOM 2106 C CG . ASN A 1 1 ? -3.997 17.200 3.313 1.00 0.00 ? 1 ASN A CG 6 ATOM 2107 O OD1 . ASN A 1 1 ? -3.420 18.168 2.845 1.00 0.00 ? 1 ASN A OD1 6 ATOM 2108 N ND2 . ASN A 1 1 ? -4.353 17.094 4.590 1.00 0.00 ? 1 ASN A ND2 6 ATOM 2109 N N . SER A 1 2 ? -3.801 12.710 2.400 1.00 0.00 ? 2 SER A N 6 ATOM 2110 C CA . SER A 1 2 ? -4.263 11.435 1.881 1.00 0.00 ? 2 SER A CA 6 ATOM 2111 C C . SER A 1 2 ? -5.787 11.450 1.737 1.00 0.00 ? 2 SER A C 6 ATOM 2112 O O . SER A 1 2 ? -6.498 11.809 2.673 1.00 0.00 ? 2 SER A O 6 ATOM 2113 C CB . SER A 1 2 ? -3.826 10.280 2.783 1.00 0.00 ? 2 SER A CB 6 ATOM 2114 O OG . SER A 1 2 ? -4.378 10.388 4.093 1.00 0.00 ? 2 SER A OG 6 ATOM 2115 N N . TYR A 1 3 ? -6.241 11.056 0.557 1.00 0.00 ? 3 TYR A N 6 ATOM 2116 C CA . TYR A 1 3 ? -7.667 11.017 0.278 1.00 0.00 ? 3 TYR A CA 6 ATOM 2117 C C . TYR A 1 3 ? -8.075 9.672 -0.321 1.00 0.00 ? 3 TYR A C 6 ATOM 2118 O O . TYR A 1 3 ? -7.341 9.100 -1.126 1.00 0.00 ? 3 TYR A O 6 ATOM 2119 C CB . TYR A 1 3 ? -7.924 12.120 -0.750 1.00 0.00 ? 3 TYR A CB 6 ATOM 2120 C CG . TYR A 1 3 ? -9.301 12.042 -1.414 1.00 0.00 ? 3 TYR A CG 6 ATOM 2121 C CD1 . TYR A 1 3 ? -10.382 12.685 -0.843 1.00 0.00 ? 3 TYR A CD1 6 ATOM 2122 C CD2 . TYR A 1 3 ? -9.463 11.329 -2.585 1.00 0.00 ? 3 TYR A CD2 6 ATOM 2123 C CE1 . TYR A 1 3 ? -11.675 12.612 -1.469 1.00 0.00 ? 3 TYR A CE1 6 ATOM 2124 C CE2 . TYR A 1 3 ? -10.757 11.255 -3.210 1.00 0.00 ? 3 TYR A CE2 6 ATOM 2125 C CZ . TYR A 1 3 ? -11.800 11.901 -2.620 1.00 0.00 ? 3 TYR A CZ 6 ATOM 2126 O OH . TYR A 1 3 ? -13.024 11.830 -3.211 1.00 0.00 ? 3 TYR A OH 6 ATOM 2127 N N . PRO A 1 4 ? -9.272 9.190 0.106 1.00 0.00 ? 4 PRO A N 6 ATOM 2128 C CA . PRO A 1 4 ? -9.785 7.921 -0.380 1.00 0.00 ? 4 PRO A CA 6 ATOM 2129 C C . PRO A 1 4 ? -10.311 8.053 -1.811 1.00 0.00 ? 4 PRO A C 6 ATOM 2130 O O . PRO A 1 4 ? -11.207 8.852 -2.077 1.00 0.00 ? 4 PRO A O 6 ATOM 2131 C CB . PRO A 1 4 ? -10.866 7.527 0.614 1.00 0.00 ? 4 PRO A CB 6 ATOM 2132 C CG . PRO A 1 4 ? -11.239 8.803 1.352 1.00 0.00 ? 4 PRO A CG 6 ATOM 2133 C CD . PRO A 1 4 ? -10.167 9.839 1.059 1.00 0.00 ? 4 PRO A CD 6 ATOM 2134 N N . GLY A 1 5 ? -9.726 7.259 -2.698 1.00 0.00 ? 5 GLY A N 6 ATOM 2135 C CA . GLY A 1 5 ? -10.124 7.277 -4.096 1.00 0.00 ? 5 GLY A CA 6 ATOM 2136 C C . GLY A 1 5 ? -9.540 6.080 -4.846 1.00 0.00 ? 5 GLY A C 6 ATOM 2137 O O . GLY A 1 5 ? -8.438 5.626 -4.539 1.00 0.00 ? 5 GLY A O 6 ATOM 2138 N N . CYS A 1 6 ? -10.306 5.600 -5.817 1.00 0.00 ? 6 CYS A N 6 ATOM 2139 C CA . CYS A 1 6 ? -9.878 4.464 -6.614 1.00 0.00 ? 6 CYS A CA 6 ATOM 2140 C C . CYS A 1 6 ? -10.630 4.501 -7.946 1.00 0.00 ? 6 CYS A C 6 ATOM 2141 O O . CYS A 1 6 ? -11.599 3.768 -8.136 1.00 0.00 ? 6 CYS A O 6 ATOM 2142 C CB . CYS A 1 6 ? -10.092 3.140 -5.874 1.00 0.00 ? 6 CYS A CB 6 ATOM 2143 S SG . CYS A 1 6 ? -9.912 3.241 -4.056 1.00 0.00 ? 6 CYS A SG 6 ATOM 2144 N N . PRO A 1 7 ? -10.142 5.385 -8.857 1.00 0.00 ? 7 PRO A N 6 ATOM 2145 C CA . PRO A 1 7 ? -10.757 5.527 -10.165 1.00 0.00 ? 7 PRO A CA 6 ATOM 2146 C C . PRO A 1 7 ? -10.402 4.346 -11.069 1.00 0.00 ? 7 PRO A C 6 ATOM 2147 O O . PRO A 1 7 ? -9.717 3.418 -10.644 1.00 0.00 ? 7 PRO A O 6 ATOM 2148 C CB . PRO A 1 7 ? -10.248 6.856 -10.696 1.00 0.00 ? 7 PRO A CB 6 ATOM 2149 C CG . PRO A 1 7 ? -9.011 7.187 -9.877 1.00 0.00 ? 7 PRO A CG 6 ATOM 2150 C CD . PRO A 1 7 ? -8.995 6.268 -8.666 1.00 0.00 ? 7 PRO A CD 6 ATOM 2151 N N . SER A 1 8 ? -10.886 4.419 -12.301 1.00 0.00 ? 8 SER A N 6 ATOM 2152 C CA . SER A 1 8 ? -10.628 3.367 -13.270 1.00 0.00 ? 8 SER A CA 6 ATOM 2153 C C . SER A 1 8 ? -9.212 3.508 -13.833 1.00 0.00 ? 8 SER A C 6 ATOM 2154 O O . SER A 1 8 ? -8.797 2.722 -14.681 1.00 0.00 ? 8 SER A O 6 ATOM 2155 C CB . SER A 1 8 ? -11.655 3.399 -14.404 1.00 0.00 ? 8 SER A CB 6 ATOM 2156 O OG . SER A 1 8 ? -11.585 4.607 -15.153 1.00 0.00 ? 8 SER A OG 6 ATOM 2157 N N . SER A 1 9 ? -8.512 4.518 -13.336 1.00 0.00 ? 9 SER A N 6 ATOM 2158 C CA . SER A 1 9 ? -7.150 4.772 -13.778 1.00 0.00 ? 9 SER A CA 6 ATOM 2159 C C . SER A 1 9 ? -6.313 3.497 -13.654 1.00 0.00 ? 9 SER A C 6 ATOM 2160 O O . SER A 1 9 ? -5.801 2.988 -14.651 1.00 0.00 ? 9 SER A O 6 ATOM 2161 C CB . SER A 1 9 ? -6.513 5.907 -12.974 1.00 0.00 ? 9 SER A CB 6 ATOM 2162 O OG . SER A 1 9 ? -7.094 7.171 -13.282 1.00 0.00 ? 9 SER A OG 6 ATOM 2163 N N . TYR A 1 10 ? -6.199 3.020 -12.424 1.00 0.00 ? 10 TYR A N 6 ATOM 2164 C CA . TYR A 1 10 ? -5.431 1.815 -12.157 1.00 0.00 ? 10 TYR A CA 6 ATOM 2165 C C . TYR A 1 10 ? -6.329 0.706 -11.603 1.00 0.00 ? 10 TYR A C 6 ATOM 2166 O O . TYR A 1 10 ? -6.343 -0.405 -12.128 1.00 0.00 ? 10 TYR A O 6 ATOM 2167 C CB . TYR A 1 10 ? -4.399 2.199 -11.096 1.00 0.00 ? 10 TYR A CB 6 ATOM 2168 C CG . TYR A 1 10 ? -4.989 2.939 -9.893 1.00 0.00 ? 10 TYR A CG 6 ATOM 2169 C CD1 . TYR A 1 10 ? -5.294 4.281 -9.989 1.00 0.00 ? 10 TYR A CD1 6 ATOM 2170 C CD2 . TYR A 1 10 ? -5.216 2.263 -8.712 1.00 0.00 ? 10 TYR A CD2 6 ATOM 2171 C CE1 . TYR A 1 10 ? -5.849 4.978 -8.858 1.00 0.00 ? 10 TYR A CE1 6 ATOM 2172 C CE2 . TYR A 1 10 ? -5.771 2.960 -7.579 1.00 0.00 ? 10 TYR A CE2 6 ATOM 2173 C CZ . TYR A 1 10 ? -6.061 4.282 -7.708 1.00 0.00 ? 10 TYR A CZ 6 ATOM 2174 O OH . TYR A 1 10 ? -6.584 4.940 -6.639 1.00 0.00 ? 10 TYR A OH 6 ATOM 2175 N N . ASP A 1 11 ? -7.052 1.047 -10.546 1.00 0.00 ? 11 ASP A N 6 ATOM 2176 C CA . ASP A 1 11 ? -7.949 0.094 -9.914 1.00 0.00 ? 11 ASP A CA 6 ATOM 2177 C C . ASP A 1 11 ? -7.200 -1.218 -9.670 1.00 0.00 ? 11 ASP A C 6 ATOM 2178 O O . ASP A 1 11 ? -7.477 -2.225 -10.321 1.00 0.00 ? 11 ASP A O 6 ATOM 2179 C CB . ASP A 1 11 ? -9.152 -0.208 -10.811 1.00 0.00 ? 11 ASP A CB 6 ATOM 2180 C CG . ASP A 1 11 ? -10.107 -1.274 -10.273 1.00 0.00 ? 11 ASP A CG 6 ATOM 2181 O OD1 . ASP A 1 11 ? -10.939 -1.002 -9.395 1.00 0.00 ? 11 ASP A OD1 6 ATOM 2182 O OD2 . ASP A 1 11 ? -9.970 -2.443 -10.799 1.00 0.00 ? 11 ASP A OD2 6 ATOM 2183 N N . GLY A 1 12 ? -6.268 -1.165 -8.729 1.00 0.00 ? 12 GLY A N 6 ATOM 2184 C CA . GLY A 1 12 ? -5.479 -2.335 -8.391 1.00 0.00 ? 12 GLY A CA 6 ATOM 2185 C C . GLY A 1 12 ? -4.055 -1.941 -7.994 1.00 0.00 ? 12 GLY A C 6 ATOM 2186 O O . GLY A 1 12 ? -3.094 -2.596 -8.390 1.00 0.00 ? 12 GLY A O 6 ATOM 2187 N N . TYR A 1 13 ? -3.967 -0.872 -7.217 1.00 0.00 ? 13 TYR A N 6 ATOM 2188 C CA . TYR A 1 13 ? -2.676 -0.382 -6.762 1.00 0.00 ? 13 TYR A CA 6 ATOM 2189 C C . TYR A 1 13 ? -2.292 -1.012 -5.420 1.00 0.00 ? 13 TYR A C 6 ATOM 2190 O O . TYR A 1 13 ? -1.399 -0.519 -4.734 1.00 0.00 ? 13 TYR A O 6 ATOM 2191 C CB . TYR A 1 13 ? -2.839 1.128 -6.577 1.00 0.00 ? 13 TYR A CB 6 ATOM 2192 C CG . TYR A 1 13 ? -1.708 1.956 -7.187 1.00 0.00 ? 13 TYR A CG 6 ATOM 2193 C CD1 . TYR A 1 13 ? -1.482 1.918 -8.549 1.00 0.00 ? 13 TYR A CD1 6 ATOM 2194 C CD2 . TYR A 1 13 ? -0.913 2.740 -6.377 1.00 0.00 ? 13 TYR A CD2 6 ATOM 2195 C CE1 . TYR A 1 13 ? -0.418 2.698 -9.123 1.00 0.00 ? 13 TYR A CE1 6 ATOM 2196 C CE2 . TYR A 1 13 ? 0.153 3.520 -6.954 1.00 0.00 ? 13 TYR A CE2 6 ATOM 2197 C CZ . TYR A 1 13 ? 0.348 3.459 -8.298 1.00 0.00 ? 13 TYR A CZ 6 ATOM 2198 O OH . TYR A 1 13 ? 1.354 4.197 -8.841 1.00 0.00 ? 13 TYR A OH 6 ATOM 2199 N N . CYS A 1 14 ? -2.988 -2.091 -5.089 1.00 0.00 ? 14 CYS A N 6 ATOM 2200 C CA . CYS A 1 14 ? -2.732 -2.791 -3.842 1.00 0.00 ? 14 CYS A CA 6 ATOM 2201 C C . CYS A 1 14 ? -2.690 -4.292 -4.135 1.00 0.00 ? 14 CYS A C 6 ATOM 2202 O O . CYS A 1 14 ? -3.721 -4.904 -4.407 1.00 0.00 ? 14 CYS A O 6 ATOM 2203 C CB . CYS A 1 14 ? -3.773 -2.446 -2.775 1.00 0.00 ? 14 CYS A CB 6 ATOM 2204 S SG . CYS A 1 14 ? -4.818 -0.994 -3.162 1.00 0.00 ? 14 CYS A SG 6 ATOM 2205 N N . LEU A 1 15 ? -1.486 -4.842 -4.070 1.00 0.00 ? 15 LEU A N 6 ATOM 2206 C CA . LEU A 1 15 ? -1.297 -6.260 -4.324 1.00 0.00 ? 15 LEU A CA 6 ATOM 2207 C C . LEU A 1 15 ? -1.396 -7.028 -3.005 1.00 0.00 ? 15 LEU A C 6 ATOM 2208 O O . LEU A 1 15 ? -1.236 -6.450 -1.932 1.00 0.00 ? 15 LEU A O 6 ATOM 2209 C CB . LEU A 1 15 ? 0.014 -6.498 -5.077 1.00 0.00 ? 15 LEU A CB 6 ATOM 2210 C CG . LEU A 1 15 ? 0.672 -5.261 -5.688 1.00 0.00 ? 15 LEU A CG 6 ATOM 2211 C CD1 . LEU A 1 15 ? 1.878 -4.815 -4.856 1.00 0.00 ? 15 LEU A CD1 6 ATOM 2212 C CD2 . LEU A 1 15 ? 1.043 -5.501 -7.153 1.00 0.00 ? 15 LEU A CD2 6 ATOM 2213 N N . ASN A 1 16 ? -1.663 -8.320 -3.129 1.00 0.00 ? 16 ASN A N 6 ATOM 2214 C CA . ASN A 1 16 ? -1.786 -9.174 -1.959 1.00 0.00 ? 16 ASN A CA 6 ATOM 2215 C C . ASN A 1 16 ? -3.119 -8.891 -1.267 1.00 0.00 ? 16 ASN A C 6 ATOM 2216 O O . ASN A 1 16 ? -3.904 -9.807 -1.024 1.00 0.00 ? 16 ASN A O 6 ATOM 2217 C CB . ASN A 1 16 ? -0.664 -8.899 -0.956 1.00 0.00 ? 16 ASN A CB 6 ATOM 2218 C CG . ASN A 1 16 ? 0.689 -8.787 -1.662 1.00 0.00 ? 16 ASN A CG 6 ATOM 2219 O OD1 . ASN A 1 16 ? 0.966 -9.462 -2.641 1.00 0.00 ? 16 ASN A OD1 6 ATOM 2220 N ND2 . ASN A 1 16 ? 1.514 -7.898 -1.116 1.00 0.00 ? 16 ASN A ND2 6 ATOM 2221 N N . GLY A 1 17 ? -3.335 -7.621 -0.964 1.00 0.00 ? 17 GLY A N 6 ATOM 2222 C CA . GLY A 1 17 ? -4.561 -7.205 -0.303 1.00 0.00 ? 17 GLY A CA 6 ATOM 2223 C C . GLY A 1 17 ? -4.559 -5.699 -0.039 1.00 0.00 ? 17 GLY A C 6 ATOM 2224 O O . GLY A 1 17 ? -5.264 -4.947 -0.711 1.00 0.00 ? 17 GLY A O 6 ATOM 2225 N N . GLY A 1 18 ? -3.758 -5.301 0.939 1.00 0.00 ? 18 GLY A N 6 ATOM 2226 C CA . GLY A 1 18 ? -3.656 -3.897 1.299 1.00 0.00 ? 18 GLY A CA 6 ATOM 2227 C C . GLY A 1 18 ? -5.003 -3.190 1.136 1.00 0.00 ? 18 GLY A C 6 ATOM 2228 O O . GLY A 1 18 ? -6.054 -3.824 1.211 1.00 0.00 ? 18 GLY A O 6 ATOM 2229 N N . VAL A 1 19 ? -4.928 -1.885 0.917 1.00 0.00 ? 19 VAL A N 6 ATOM 2230 C CA . VAL A 1 19 ? -6.128 -1.085 0.743 1.00 0.00 ? 19 VAL A CA 6 ATOM 2231 C C . VAL A 1 19 ? -5.867 -0.003 -0.308 1.00 0.00 ? 19 VAL A C 6 ATOM 2232 O O . VAL A 1 19 ? -4.719 0.250 -0.672 1.00 0.00 ? 19 VAL A O 6 ATOM 2233 C CB . VAL A 1 19 ? -6.574 -0.513 2.090 1.00 0.00 ? 19 VAL A CB 6 ATOM 2234 C CG1 . VAL A 1 19 ? -6.304 0.991 2.164 1.00 0.00 ? 19 VAL A CG1 6 ATOM 2235 C CG2 . VAL A 1 19 ? -8.050 -0.819 2.354 1.00 0.00 ? 19 VAL A CG2 6 ATOM 2236 N N . CYS A 1 20 ? -6.953 0.602 -0.768 1.00 0.00 ? 20 CYS A N 6 ATOM 2237 C CA . CYS A 1 20 ? -6.856 1.650 -1.770 1.00 0.00 ? 20 CYS A CA 6 ATOM 2238 C C . CYS A 1 20 ? -6.864 3.001 -1.056 1.00 0.00 ? 20 CYS A C 6 ATOM 2239 O O . CYS A 1 20 ? -7.643 3.212 -0.127 1.00 0.00 ? 20 CYS A O 6 ATOM 2240 C CB . CYS A 1 20 ? -7.976 1.546 -2.806 1.00 0.00 ? 20 CYS A CB 6 ATOM 2241 S SG . CYS A 1 20 ? -7.924 2.815 -4.123 1.00 0.00 ? 20 CYS A SG 6 ATOM 2242 N N . MET A 1 21 ? -5.987 3.883 -1.514 1.00 0.00 ? 21 MET A N 6 ATOM 2243 C CA . MET A 1 21 ? -5.885 5.210 -0.930 1.00 0.00 ? 21 MET A CA 6 ATOM 2244 C C . MET A 1 21 ? -5.236 6.192 -1.909 1.00 0.00 ? 21 MET A C 6 ATOM 2245 O O . MET A 1 21 ? -4.157 5.926 -2.436 1.00 0.00 ? 21 MET A O 6 ATOM 2246 C CB . MET A 1 21 ? -5.050 5.140 0.351 1.00 0.00 ? 21 MET A CB 6 ATOM 2247 C CG . MET A 1 21 ? -5.949 5.041 1.585 1.00 0.00 ? 21 MET A CG 6 ATOM 2248 S SD . MET A 1 21 ? -7.015 6.470 1.680 1.00 0.00 ? 21 MET A SD 6 ATOM 2249 C CE . MET A 1 21 ? -6.108 7.456 2.860 1.00 0.00 ? 21 MET A CE 6 ATOM 2250 N N . HIS A 1 22 ? -5.922 7.306 -2.122 1.00 0.00 ? 22 HIS A N 6 ATOM 2251 C CA . HIS A 1 22 ? -5.427 8.327 -3.027 1.00 0.00 ? 22 HIS A CA 6 ATOM 2252 C C . HIS A 1 22 ? -4.718 9.422 -2.227 1.00 0.00 ? 22 HIS A C 6 ATOM 2253 O O . HIS A 1 22 ? -5.020 9.633 -1.054 1.00 0.00 ? 22 HIS A O 6 ATOM 2254 C CB . HIS A 1 22 ? -6.557 8.871 -3.903 1.00 0.00 ? 22 HIS A CB 6 ATOM 2255 C CG . HIS A 1 22 ? -6.111 9.907 -4.908 1.00 0.00 ? 22 HIS A CG 6 ATOM 2256 N ND1 . HIS A 1 22 ? -6.751 11.124 -5.065 1.00 0.00 ? 22 HIS A ND1 6 ATOM 2257 C CD2 . HIS A 1 22 ? -5.084 9.891 -5.806 1.00 0.00 ? 22 HIS A CD2 6 ATOM 2258 C CE1 . HIS A 1 22 ? -6.128 11.803 -6.016 1.00 0.00 ? 22 HIS A CE1 6 ATOM 2259 N NE2 . HIS A 1 22 ? -5.095 11.038 -6.475 1.00 0.00 ? 22 HIS A NE2 6 ATOM 2260 N N . ILE A 1 23 ? -3.788 10.091 -2.894 1.00 0.00 ? 23 ILE A N 6 ATOM 2261 C CA . ILE A 1 23 ? -3.034 11.159 -2.260 1.00 0.00 ? 23 ILE A CA 6 ATOM 2262 C C . ILE A 1 23 ? -3.372 12.487 -2.939 1.00 0.00 ? 23 ILE A C 6 ATOM 2263 O O . ILE A 1 23 ? -3.989 12.507 -4.003 1.00 0.00 ? 23 ILE A O 6 ATOM 2264 C CB . ILE A 1 23 ? -1.539 10.830 -2.260 1.00 0.00 ? 23 ILE A CB 6 ATOM 2265 C CG1 . ILE A 1 23 ? -1.304 9.347 -2.547 1.00 0.00 ? 23 ILE A CG1 6 ATOM 2266 C CG2 . ILE A 1 23 ? -0.883 11.273 -0.951 1.00 0.00 ? 23 ILE A CG2 6 ATOM 2267 C CD1 . ILE A 1 23 ? 0.142 8.951 -2.235 1.00 0.00 ? 23 ILE A CD1 6 ATOM 2268 N N . GLU A 1 24 ? -2.954 13.567 -2.293 1.00 0.00 ? 24 GLU A N 6 ATOM 2269 C CA . GLU A 1 24 ? -3.206 14.898 -2.819 1.00 0.00 ? 24 GLU A CA 6 ATOM 2270 C C . GLU A 1 24 ? -1.885 15.631 -3.060 1.00 0.00 ? 24 GLU A C 6 ATOM 2271 O O . GLU A 1 24 ? -0.811 15.072 -2.839 1.00 0.00 ? 24 GLU A O 6 ATOM 2272 C CB . GLU A 1 24 ? -4.113 15.696 -1.881 1.00 0.00 ? 24 GLU A CB 6 ATOM 2273 C CG . GLU A 1 24 ? -5.560 15.207 -1.969 1.00 0.00 ? 24 GLU A CG 6 ATOM 2274 C CD . GLU A 1 24 ? -6.452 16.257 -2.636 1.00 0.00 ? 24 GLU A CD 6 ATOM 2275 O OE1 . GLU A 1 24 ? -6.585 16.265 -3.869 1.00 0.00 ? 24 GLU A OE1 6 ATOM 2276 O OE2 . GLU A 1 24 ? -7.020 17.083 -1.827 1.00 0.00 ? 24 GLU A OE2 6 ATOM 2277 N N . SER A 1 25 ? -2.007 16.869 -3.512 1.00 0.00 ? 25 SER A N 6 ATOM 2278 C CA . SER A 1 25 ? -0.836 17.685 -3.786 1.00 0.00 ? 25 SER A CA 6 ATOM 2279 C C . SER A 1 25 ? -0.349 17.439 -5.215 1.00 0.00 ? 25 SER A C 6 ATOM 2280 O O . SER A 1 25 ? 0.186 18.340 -5.857 1.00 0.00 ? 25 SER A O 6 ATOM 2281 C CB . SER A 1 25 ? 0.285 17.395 -2.786 1.00 0.00 ? 25 SER A CB 6 ATOM 2282 O OG . SER A 1 25 ? 1.194 18.485 -2.670 1.00 0.00 ? 25 SER A OG 6 ATOM 2283 N N . LEU A 1 26 ? -0.553 16.211 -5.672 1.00 0.00 ? 26 LEU A N 6 ATOM 2284 C CA . LEU A 1 26 ? -0.140 15.833 -7.012 1.00 0.00 ? 26 LEU A CA 6 ATOM 2285 C C . LEU A 1 26 ? -1.128 14.808 -7.575 1.00 0.00 ? 26 LEU A C 6 ATOM 2286 O O . LEU A 1 26 ? -0.837 14.139 -8.565 1.00 0.00 ? 26 LEU A O 6 ATOM 2287 C CB . LEU A 1 26 ? 1.311 15.351 -7.012 1.00 0.00 ? 26 LEU A CB 6 ATOM 2288 C CG . LEU A 1 26 ? 2.326 16.277 -7.688 1.00 0.00 ? 26 LEU A CG 6 ATOM 2289 C CD1 . LEU A 1 26 ? 3.715 16.113 -7.066 1.00 0.00 ? 26 LEU A CD1 6 ATOM 2290 C CD2 . LEU A 1 26 ? 2.345 16.056 -9.202 1.00 0.00 ? 26 LEU A CD2 6 ATOM 2291 N N . ASP A 1 27 ? -2.277 14.720 -6.921 1.00 0.00 ? 27 ASP A N 6 ATOM 2292 C CA . ASP A 1 27 ? -3.309 13.789 -7.343 1.00 0.00 ? 27 ASP A CA 6 ATOM 2293 C C . ASP A 1 27 ? -2.709 12.386 -7.454 1.00 0.00 ? 27 ASP A C 6 ATOM 2294 O O . ASP A 1 27 ? -3.162 11.576 -8.261 1.00 0.00 ? 27 ASP A O 6 ATOM 2295 C CB . ASP A 1 27 ? -3.870 14.174 -8.713 1.00 0.00 ? 27 ASP A CB 6 ATOM 2296 C CG . ASP A 1 27 ? -5.398 14.205 -8.801 1.00 0.00 ? 27 ASP A CG 6 ATOM 2297 O OD1 . ASP A 1 27 ? -6.046 15.137 -8.302 1.00 0.00 ? 27 ASP A OD1 6 ATOM 2298 O OD2 . ASP A 1 27 ? -5.928 13.205 -9.420 1.00 0.00 ? 27 ASP A OD2 6 ATOM 2299 N N . SER A 1 28 ? -1.699 12.142 -6.633 1.00 0.00 ? 28 SER A N 6 ATOM 2300 C CA . SER A 1 28 ? -1.033 10.850 -6.630 1.00 0.00 ? 28 SER A CA 6 ATOM 2301 C C . SER A 1 28 ? -1.902 9.815 -5.912 1.00 0.00 ? 28 SER A C 6 ATOM 2302 O O . SER A 1 28 ? -2.706 10.165 -5.048 1.00 0.00 ? 28 SER A O 6 ATOM 2303 C CB . SER A 1 28 ? 0.341 10.941 -5.964 1.00 0.00 ? 28 SER A CB 6 ATOM 2304 O OG . SER A 1 28 ? 0.666 9.756 -5.242 1.00 0.00 ? 28 SER A OG 6 ATOM 2305 N N . TYR A 1 29 ? -1.713 8.561 -6.296 1.00 0.00 ? 29 TYR A N 6 ATOM 2306 C CA . TYR A 1 29 ? -2.468 7.472 -5.701 1.00 0.00 ? 29 TYR A CA 6 ATOM 2307 C C . TYR A 1 29 ? -1.553 6.536 -4.911 1.00 0.00 ? 29 TYR A C 6 ATOM 2308 O O . TYR A 1 29 ? -0.373 6.397 -5.235 1.00 0.00 ? 29 TYR A O 6 ATOM 2309 C CB . TYR A 1 29 ? -3.084 6.698 -6.869 1.00 0.00 ? 29 TYR A CB 6 ATOM 2310 C CG . TYR A 1 29 ? -4.203 7.452 -7.592 1.00 0.00 ? 29 TYR A CG 6 ATOM 2311 C CD1 . TYR A 1 29 ? -5.488 7.424 -7.090 1.00 0.00 ? 29 TYR A CD1 6 ATOM 2312 C CD2 . TYR A 1 29 ? -3.928 8.157 -8.746 1.00 0.00 ? 29 TYR A CD2 6 ATOM 2313 C CE1 . TYR A 1 29 ? -6.542 8.132 -7.771 1.00 0.00 ? 29 TYR A CE1 6 ATOM 2314 C CE2 . TYR A 1 29 ? -4.981 8.864 -9.426 1.00 0.00 ? 29 TYR A CE2 6 ATOM 2315 C CZ . TYR A 1 29 ? -6.237 8.817 -8.904 1.00 0.00 ? 29 TYR A CZ 6 ATOM 2316 O OH . TYR A 1 29 ? -7.232 9.485 -9.547 1.00 0.00 ? 29 TYR A OH 6 ATOM 2317 N N . THR A 1 30 ? -2.129 5.918 -3.892 1.00 0.00 ? 30 THR A N 6 ATOM 2318 C CA . THR A 1 30 ? -1.379 4.998 -3.053 1.00 0.00 ? 30 THR A CA 6 ATOM 2319 C C . THR A 1 30 ? -2.246 3.796 -2.671 1.00 0.00 ? 30 THR A C 6 ATOM 2320 O O . THR A 1 30 ? -3.372 3.662 -3.149 1.00 0.00 ? 30 THR A O 6 ATOM 2321 C CB . THR A 1 30 ? -0.855 5.778 -1.846 1.00 0.00 ? 30 THR A CB 6 ATOM 2322 O OG1 . THR A 1 30 ? -0.114 4.814 -1.103 1.00 0.00 ? 30 THR A OG1 6 ATOM 2323 C CG2 . THR A 1 30 ? -1.975 6.203 -0.893 1.00 0.00 ? 30 THR A CG2 6 ATOM 2324 N N . CYS A 1 31 ? -1.688 2.955 -1.813 1.00 0.00 ? 31 CYS A N 6 ATOM 2325 C CA . CYS A 1 31 ? -2.398 1.769 -1.360 1.00 0.00 ? 31 CYS A CA 6 ATOM 2326 C C . CYS A 1 31 ? -1.796 1.331 -0.024 1.00 0.00 ? 31 CYS A C 6 ATOM 2327 O O . CYS A 1 31 ? -0.577 1.317 0.138 1.00 0.00 ? 31 CYS A O 6 ATOM 2328 C CB . CYS A 1 31 ? -2.350 0.649 -2.403 1.00 0.00 ? 31 CYS A CB 6 ATOM 2329 S SG . CYS A 1 31 ? -3.907 0.399 -3.330 1.00 0.00 ? 31 CYS A SG 6 ATOM 2330 N N . ASN A 1 32 ? -2.680 0.983 0.900 1.00 0.00 ? 32 ASN A N 6 ATOM 2331 C CA . ASN A 1 32 ? -2.251 0.545 2.218 1.00 0.00 ? 32 ASN A CA 6 ATOM 2332 C C . ASN A 1 32 ? -1.586 -0.828 2.103 1.00 0.00 ? 32 ASN A C 6 ATOM 2333 O O . ASN A 1 32 ? -1.923 -1.612 1.215 1.00 0.00 ? 32 ASN A O 6 ATOM 2334 C CB . ASN A 1 32 ? -3.443 0.415 3.170 1.00 0.00 ? 32 ASN A CB 6 ATOM 2335 C CG . ASN A 1 32 ? -3.936 1.792 3.619 1.00 0.00 ? 32 ASN A CG 6 ATOM 2336 O OD1 . ASN A 1 32 ? -3.715 2.802 2.971 1.00 0.00 ? 32 ASN A OD1 6 ATOM 2337 N ND2 . ASN A 1 32 ? -4.615 1.776 4.763 1.00 0.00 ? 32 ASN A ND2 6 ATOM 2338 N N . CYS A 1 33 ? -0.657 -1.079 3.012 1.00 0.00 ? 33 CYS A N 6 ATOM 2339 C CA . CYS A 1 33 ? 0.058 -2.344 3.024 1.00 0.00 ? 33 CYS A CA 6 ATOM 2340 C C . CYS A 1 33 ? -0.047 -2.941 4.429 1.00 0.00 ? 33 CYS A C 6 ATOM 2341 O O . CYS A 1 33 ? -1.005 -2.675 5.152 1.00 0.00 ? 33 CYS A O 6 ATOM 2342 C CB . CYS A 1 33 ? 1.512 -2.177 2.581 1.00 0.00 ? 33 CYS A CB 6 ATOM 2343 S SG . CYS A 1 33 ? 2.220 -3.622 1.710 1.00 0.00 ? 33 CYS A SG 6 ATOM 2344 N N . VAL A 1 34 ? 0.955 -3.738 4.773 1.00 0.00 ? 34 VAL A N 6 ATOM 2345 C CA . VAL A 1 34 ? 0.988 -4.376 6.079 1.00 0.00 ? 34 VAL A CA 6 ATOM 2346 C C . VAL A 1 34 ? 2.441 -4.532 6.528 1.00 0.00 ? 34 VAL A C 6 ATOM 2347 O O . VAL A 1 34 ? 3.363 -4.144 5.811 1.00 0.00 ? 34 VAL A O 6 ATOM 2348 C CB . VAL A 1 34 ? 0.231 -5.703 6.033 1.00 0.00 ? 34 VAL A CB 6 ATOM 2349 C CG1 . VAL A 1 34 ? -1.263 -5.473 5.791 1.00 0.00 ? 34 VAL A CG1 6 ATOM 2350 C CG2 . VAL A 1 34 ? 0.820 -6.635 4.972 1.00 0.00 ? 34 VAL A CG2 6 ATOM 2351 N N . ILE A 1 35 ? 2.604 -5.103 7.713 1.00 0.00 ? 35 ILE A N 6 ATOM 2352 C CA . ILE A 1 35 ? 3.932 -5.315 8.266 1.00 0.00 ? 35 ILE A CA 6 ATOM 2353 C C . ILE A 1 35 ? 4.725 -6.237 7.338 1.00 0.00 ? 35 ILE A C 6 ATOM 2354 O O . ILE A 1 35 ? 4.281 -7.341 7.026 1.00 0.00 ? 35 ILE A O 6 ATOM 2355 C CB . ILE A 1 35 ? 3.836 -5.827 9.705 1.00 0.00 ? 35 ILE A CB 6 ATOM 2356 C CG1 . ILE A 1 35 ? 2.781 -5.049 10.495 1.00 0.00 ? 35 ILE A CG1 6 ATOM 2357 C CG2 . ILE A 1 35 ? 5.204 -5.795 10.390 1.00 0.00 ? 35 ILE A CG2 6 ATOM 2358 C CD1 . ILE A 1 35 ? 2.970 -5.242 12.000 1.00 0.00 ? 35 ILE A CD1 6 ATOM 2359 N N . GLY A 1 36 ? 5.884 -5.749 6.920 1.00 0.00 ? 36 GLY A N 6 ATOM 2360 C CA . GLY A 1 36 ? 6.742 -6.515 6.034 1.00 0.00 ? 36 GLY A CA 6 ATOM 2361 C C . GLY A 1 36 ? 6.427 -6.211 4.568 1.00 0.00 ? 36 GLY A C 6 ATOM 2362 O O . GLY A 1 36 ? 6.859 -6.935 3.673 1.00 0.00 ? 36 GLY A O 6 ATOM 2363 N N . TYR A 1 37 ? 5.678 -5.137 4.367 1.00 0.00 ? 37 TYR A N 6 ATOM 2364 C CA . TYR A 1 37 ? 5.301 -4.727 3.025 1.00 0.00 ? 37 TYR A CA 6 ATOM 2365 C C . TYR A 1 37 ? 4.769 -3.293 3.019 1.00 0.00 ? 37 TYR A C 6 ATOM 2366 O O . TYR A 1 37 ? 4.015 -2.903 3.909 1.00 0.00 ? 37 TYR A O 6 ATOM 2367 C CB . TYR A 1 37 ? 4.180 -5.674 2.594 1.00 0.00 ? 37 TYR A CB 6 ATOM 2368 C CG . TYR A 1 37 ? 4.546 -7.156 2.696 1.00 0.00 ? 37 TYR A CG 6 ATOM 2369 C CD1 . TYR A 1 37 ? 5.196 -7.781 1.651 1.00 0.00 ? 37 TYR A CD1 6 ATOM 2370 C CD2 . TYR A 1 37 ? 4.226 -7.870 3.833 1.00 0.00 ? 37 TYR A CD2 6 ATOM 2371 C CE1 . TYR A 1 37 ? 5.539 -9.177 1.746 1.00 0.00 ? 37 TYR A CE1 6 ATOM 2372 C CE2 . TYR A 1 37 ? 4.571 -9.265 3.930 1.00 0.00 ? 37 TYR A CE2 6 ATOM 2373 C CZ . TYR A 1 37 ? 5.210 -9.849 2.882 1.00 0.00 ? 37 TYR A CZ 6 ATOM 2374 O OH . TYR A 1 37 ? 5.535 -11.166 2.971 1.00 0.00 ? 37 TYR A OH 6 ATOM 2375 N N . SER A 1 38 ? 5.183 -2.546 2.006 1.00 0.00 ? 38 SER A N 6 ATOM 2376 C CA . SER A 1 38 ? 4.758 -1.164 1.873 1.00 0.00 ? 38 SER A CA 6 ATOM 2377 C C . SER A 1 38 ? 5.119 -0.638 0.481 1.00 0.00 ? 38 SER A C 6 ATOM 2378 O O . SER A 1 38 ? 5.792 -1.320 -0.290 1.00 0.00 ? 38 SER A O 6 ATOM 2379 C CB . SER A 1 38 ? 5.395 -0.285 2.952 1.00 0.00 ? 38 SER A CB 6 ATOM 2380 O OG . SER A 1 38 ? 5.145 -0.784 4.263 1.00 0.00 ? 38 SER A OG 6 ATOM 2381 N N . GLY A 1 39 ? 4.653 0.572 0.201 1.00 0.00 ? 39 GLY A N 6 ATOM 2382 C CA . GLY A 1 39 ? 4.916 1.196 -1.084 1.00 0.00 ? 39 GLY A CA 6 ATOM 2383 C C . GLY A 1 39 ? 3.617 1.669 -1.741 1.00 0.00 ? 39 GLY A C 6 ATOM 2384 O O . GLY A 1 39 ? 2.578 1.738 -1.087 1.00 0.00 ? 39 GLY A O 6 ATOM 2385 N N . ASP A 1 40 ? 3.720 1.984 -3.023 1.00 0.00 ? 40 ASP A N 6 ATOM 2386 C CA . ASP A 1 40 ? 2.567 2.450 -3.774 1.00 0.00 ? 40 ASP A CA 6 ATOM 2387 C C . ASP A 1 40 ? 1.454 1.403 -3.692 1.00 0.00 ? 40 ASP A C 6 ATOM 2388 O O . ASP A 1 40 ? 0.294 1.701 -3.972 1.00 0.00 ? 40 ASP A O 6 ATOM 2389 C CB . ASP A 1 40 ? 2.916 2.653 -5.250 1.00 0.00 ? 40 ASP A CB 6 ATOM 2390 C CG . ASP A 1 40 ? 4.010 1.729 -5.788 1.00 0.00 ? 40 ASP A CG 6 ATOM 2391 O OD1 . ASP A 1 40 ? 5.216 2.097 -5.520 1.00 0.00 ? 40 ASP A OD1 6 ATOM 2392 O OD2 . ASP A 1 40 ? 3.723 0.709 -6.432 1.00 0.00 ? 40 ASP A OD2 6 ATOM 2393 N N . ARG A 1 41 ? 1.846 0.198 -3.304 1.00 0.00 ? 41 ARG A N 6 ATOM 2394 C CA . ARG A 1 41 ? 0.896 -0.894 -3.183 1.00 0.00 ? 41 ARG A CA 6 ATOM 2395 C C . ARG A 1 41 ? 1.266 -1.789 -1.997 1.00 0.00 ? 41 ARG A C 6 ATOM 2396 O O . ARG A 1 41 ? 0.661 -1.692 -0.930 1.00 0.00 ? 41 ARG A O 6 ATOM 2397 C CB . ARG A 1 41 ? 0.859 -1.739 -4.458 1.00 0.00 ? 41 ARG A CB 6 ATOM 2398 C CG . ARG A 1 41 ? 1.046 -0.865 -5.700 1.00 0.00 ? 41 ARG A CG 6 ATOM 2399 C CD . ARG A 1 41 ? 0.511 -1.566 -6.950 1.00 0.00 ? 41 ARG A CD 6 ATOM 2400 N NE . ARG A 1 41 ? 0.604 -0.662 -8.116 1.00 0.00 ? 41 ARG A NE 6 ATOM 2401 C CZ . ARG A 1 41 ? 1.542 -0.765 -9.081 1.00 0.00 ? 41 ARG A CZ 6 ATOM 2402 N NH1 . ARG A 1 41 ? 1.342 -1.563 -10.151 1.00 0.00 ? 41 ARG A NH1 6 ATOM 2403 N NH2 . ARG A 1 41 ? 2.660 -0.073 -8.963 1.00 0.00 ? 41 ARG A NH2 6 ATOM 2404 N N . CYS A 1 42 ? 2.255 -2.640 -2.225 1.00 0.00 ? 42 CYS A N 6 ATOM 2405 C CA . CYS A 1 42 ? 2.712 -3.551 -1.189 1.00 0.00 ? 42 CYS A CA 6 ATOM 2406 C C . CYS A 1 42 ? 3.670 -4.560 -1.826 1.00 0.00 ? 42 CYS A C 6 ATOM 2407 O O . CYS A 1 42 ? 3.362 -5.748 -1.906 1.00 0.00 ? 42 CYS A O 6 ATOM 2408 C CB . CYS A 1 42 ? 1.543 -4.240 -0.485 1.00 0.00 ? 42 CYS A CB 6 ATOM 2409 S SG . CYS A 1 42 ? 1.638 -4.239 1.342 1.00 0.00 ? 42 CYS A SG 6 ATOM 2410 N N . GLN A 1 43 ? 4.812 -4.049 -2.262 1.00 0.00 ? 43 GLN A N 6 ATOM 2411 C CA . GLN A 1 43 ? 5.817 -4.892 -2.889 1.00 0.00 ? 43 GLN A CA 6 ATOM 2412 C C . GLN A 1 43 ? 7.131 -4.820 -2.111 1.00 0.00 ? 43 GLN A C 6 ATOM 2413 O O . GLN A 1 43 ? 7.868 -5.803 -2.037 1.00 0.00 ? 43 GLN A O 6 ATOM 2414 C CB . GLN A 1 43 ? 6.023 -4.500 -4.355 1.00 0.00 ? 43 GLN A CB 6 ATOM 2415 C CG . GLN A 1 43 ? 7.343 -5.060 -4.890 1.00 0.00 ? 43 GLN A CG 6 ATOM 2416 C CD . GLN A 1 43 ? 8.527 -4.208 -4.432 1.00 0.00 ? 43 GLN A CD 6 ATOM 2417 O OE1 . GLN A 1 43 ? 9.282 -4.573 -3.546 1.00 0.00 ? 43 GLN A OE1 6 ATOM 2418 N NE2 . GLN A 1 43 ? 8.649 -3.055 -5.086 1.00 0.00 ? 43 GLN A NE2 6 ATOM 2419 N N . THR A 1 44 ? 7.386 -3.647 -1.549 1.00 0.00 ? 44 THR A N 6 ATOM 2420 C CA . THR A 1 44 ? 8.600 -3.434 -0.779 1.00 0.00 ? 44 THR A CA 6 ATOM 2421 C C . THR A 1 44 ? 8.478 -4.090 0.598 1.00 0.00 ? 44 THR A C 6 ATOM 2422 O O . THR A 1 44 ? 7.710 -3.631 1.442 1.00 0.00 ? 44 THR A O 6 ATOM 2423 C CB . THR A 1 44 ? 8.859 -1.928 -0.715 1.00 0.00 ? 44 THR A CB 6 ATOM 2424 O OG1 . THR A 1 44 ? 9.666 -1.666 -1.861 1.00 0.00 ? 44 THR A OG1 6 ATOM 2425 C CG2 . THR A 1 44 ? 9.751 -1.538 0.466 1.00 0.00 ? 44 THR A CG2 6 ATOM 2426 N N . ARG A 1 45 ? 9.248 -5.152 0.783 1.00 0.00 ? 45 ARG A N 6 ATOM 2427 C CA . ARG A 1 45 ? 9.237 -5.874 2.042 1.00 0.00 ? 45 ARG A CA 6 ATOM 2428 C C . ARG A 1 45 ? 10.026 -5.105 3.104 1.00 0.00 ? 45 ARG A C 6 ATOM 2429 O O . ARG A 1 45 ? 11.240 -4.941 2.983 1.00 0.00 ? 45 ARG A O 6 ATOM 2430 C CB . ARG A 1 45 ? 9.840 -7.270 1.882 1.00 0.00 ? 45 ARG A CB 6 ATOM 2431 C CG . ARG A 1 45 ? 8.764 -8.351 2.013 1.00 0.00 ? 45 ARG A CG 6 ATOM 2432 C CD . ARG A 1 45 ? 9.319 -9.726 1.634 1.00 0.00 ? 45 ARG A CD 6 ATOM 2433 N NE . ARG A 1 45 ? 8.270 -10.758 1.799 1.00 0.00 ? 45 ARG A NE 6 ATOM 2434 C CZ . ARG A 1 45 ? 8.447 -12.067 1.523 1.00 0.00 ? 45 ARG A CZ 6 ATOM 2435 N NH1 . ARG A 1 45 ? 8.963 -12.899 2.453 1.00 0.00 ? 45 ARG A NH1 6 ATOM 2436 N NH2 . ARG A 1 45 ? 8.109 -12.520 0.331 1.00 0.00 ? 45 ARG A NH2 6 ATOM 2437 N N . ASP A 1 46 ? 9.306 -4.651 4.119 1.00 0.00 ? 46 ASP A N 6 ATOM 2438 C CA . ASP A 1 46 ? 9.923 -3.903 5.201 1.00 0.00 ? 46 ASP A CA 6 ATOM 2439 C C . ASP A 1 46 ? 10.823 -4.837 6.013 1.00 0.00 ? 46 ASP A C 6 ATOM 2440 O O . ASP A 1 46 ? 11.840 -4.408 6.555 1.00 0.00 ? 46 ASP A O 6 ATOM 2441 C CB . ASP A 1 46 ? 8.866 -3.326 6.144 1.00 0.00 ? 46 ASP A CB 6 ATOM 2442 C CG . ASP A 1 46 ? 8.943 -1.811 6.348 1.00 0.00 ? 46 ASP A CG 6 ATOM 2443 O OD1 . ASP A 1 46 ? 9.710 -1.427 7.312 1.00 0.00 ? 46 ASP A OD1 6 ATOM 2444 O OD2 . ASP A 1 46 ? 8.299 -1.036 5.625 1.00 0.00 ? 46 ASP A OD2 6 ATOM 2445 N N . LEU A 1 47 ? 10.415 -6.096 6.070 1.00 0.00 ? 47 LEU A N 6 ATOM 2446 C CA . LEU A 1 47 ? 11.172 -7.095 6.807 1.00 0.00 ? 47 LEU A CA 6 ATOM 2447 C C . LEU A 1 47 ? 11.666 -6.486 8.120 1.00 0.00 ? 47 LEU A C 6 ATOM 2448 O O . LEU A 1 47 ? 12.856 -6.212 8.272 1.00 0.00 ? 47 LEU A O 6 ATOM 2449 C CB . LEU A 1 47 ? 12.289 -7.670 5.936 1.00 0.00 ? 47 LEU A CB 6 ATOM 2450 C CG . LEU A 1 47 ? 11.865 -8.713 4.900 1.00 0.00 ? 47 LEU A CG 6 ATOM 2451 C CD1 . LEU A 1 47 ? 12.716 -8.606 3.634 1.00 0.00 ? 47 LEU A CD1 6 ATOM 2452 C CD2 . LEU A 1 47 ? 11.894 -10.121 5.495 1.00 0.00 ? 47 LEU A CD2 6 ATOM 2453 N N . ARG A 1 48 ? 10.728 -6.292 9.037 1.00 0.00 ? 48 ARG A N 6 ATOM 2454 C CA . ARG A 1 48 ? 11.054 -5.721 10.333 1.00 0.00 ? 48 ARG A CA 6 ATOM 2455 C C . ARG A 1 48 ? 9.793 -5.181 11.006 1.00 0.00 ? 48 ARG A C 6 ATOM 2456 O O . ARG A 1 48 ? 9.423 -4.025 10.806 1.00 0.00 ? 48 ARG A O 6 ATOM 2457 C CB . ARG A 1 48 ? 12.076 -4.590 10.193 1.00 0.00 ? 48 ARG A CB 6 ATOM 2458 C CG . ARG A 1 48 ? 13.460 -5.040 10.664 1.00 0.00 ? 48 ARG A CG 6 ATOM 2459 C CD . ARG A 1 48 ? 13.630 -4.816 12.168 1.00 0.00 ? 48 ARG A CD 6 ATOM 2460 N NE . ARG A 1 48 ? 14.928 -5.366 12.617 1.00 0.00 ? 48 ARG A NE 6 ATOM 2461 C CZ . ARG A 1 48 ? 16.047 -4.628 12.780 1.00 0.00 ? 48 ARG A CZ 6 ATOM 2462 N NH1 . ARG A 1 48 ? 16.288 -3.998 13.950 1.00 0.00 ? 48 ARG A NH1 6 ATOM 2463 N NH2 . ARG A 1 48 ? 16.900 -4.531 11.779 1.00 0.00 ? 48 ARG A NH2 6 ATOM 2464 N N . TRP A 1 49 ? 9.166 -6.043 11.794 1.00 0.00 ? 49 TRP A N 6 ATOM 2465 C CA . TRP A 1 49 ? 7.952 -5.666 12.500 1.00 0.00 ? 49 TRP A CA 6 ATOM 2466 C C . TRP A 1 49 ? 8.148 -4.256 13.060 1.00 0.00 ? 49 TRP A C 6 ATOM 2467 O O . TRP A 1 49 ? 9.246 -3.903 13.491 1.00 0.00 ? 49 TRP A O 6 ATOM 2468 C CB . TRP A 1 49 ? 7.605 -6.695 13.578 1.00 0.00 ? 49 TRP A CB 6 ATOM 2469 C CG . TRP A 1 49 ? 6.261 -7.396 13.360 1.00 0.00 ? 49 TRP A CG 6 ATOM 2470 C CD1 . TRP A 1 49 ? 5.044 -6.986 13.744 1.00 0.00 ? 49 TRP A CD1 6 ATOM 2471 C CD2 . TRP A 1 49 ? 6.048 -8.653 12.684 1.00 0.00 ? 49 TRP A CD2 6 ATOM 2472 N NE1 . TRP A 1 49 ? 4.067 -7.885 13.368 1.00 0.00 ? 49 TRP A NE1 6 ATOM 2473 C CE2 . TRP A 1 49 ? 4.697 -8.929 12.702 1.00 0.00 ? 49 TRP A CE2 6 ATOM 2474 C CE3 . TRP A 1 49 ? 6.967 -9.526 12.076 1.00 0.00 ? 49 TRP A CE3 6 ATOM 2475 C CZ2 . TRP A 1 49 ? 4.142 -10.080 12.129 1.00 0.00 ? 49 TRP A CZ2 6 ATOM 2476 C CZ3 . TRP A 1 49 ? 6.397 -10.671 11.507 1.00 0.00 ? 49 TRP A CZ3 6 ATOM 2477 C CH2 . TRP A 1 49 ? 5.039 -10.965 11.518 1.00 0.00 ? 49 TRP A CH2 6 ATOM 2478 N N . TRP A 1 50 ? 7.070 -3.489 13.034 1.00 0.00 ? 50 TRP A N 6 ATOM 2479 C CA . TRP A 1 50 ? 7.110 -2.124 13.533 1.00 0.00 ? 50 TRP A CA 6 ATOM 2480 C C . TRP A 1 50 ? 6.340 -2.081 14.854 1.00 0.00 ? 50 TRP A C 6 ATOM 2481 O O . TRP A 1 50 ? 6.747 -1.399 15.792 1.00 0.00 ? 50 TRP A O 6 ATOM 2482 C CB . TRP A 1 50 ? 6.568 -1.142 12.493 1.00 0.00 ? 50 TRP A CB 6 ATOM 2483 C CG . TRP A 1 50 ? 6.732 -1.615 11.046 1.00 0.00 ? 50 TRP A CG 6 ATOM 2484 C CD1 . TRP A 1 50 ? 7.857 -2.001 10.428 1.00 0.00 ? 50 TRP A CD1 6 ATOM 2485 C CD2 . TRP A 1 50 ? 5.688 -1.737 10.058 1.00 0.00 ? 50 TRP A CD2 6 ATOM 2486 N NE1 . TRP A 1 50 ? 7.615 -2.360 9.118 1.00 0.00 ? 50 TRP A NE1 6 ATOM 2487 C CE2 . TRP A 1 50 ? 6.254 -2.195 8.885 1.00 0.00 ? 50 TRP A CE2 6 ATOM 2488 C CE3 . TRP A 1 50 ? 4.312 -1.470 10.151 1.00 0.00 ? 50 TRP A CE3 6 ATOM 2489 C CZ2 . TRP A 1 50 ? 5.519 -2.425 7.718 1.00 0.00 ? 50 TRP A CZ2 6 ATOM 2490 C CZ3 . TRP A 1 50 ? 3.589 -1.704 8.974 1.00 0.00 ? 50 TRP A CZ3 6 ATOM 2491 C CH2 . TRP A 1 50 ? 4.143 -2.164 7.786 1.00 0.00 ? 50 TRP A CH2 6 ATOM 2492 N N . GLU A 1 51 ? 5.240 -2.819 14.884 1.00 0.00 ? 51 GLU A N 6 ATOM 2493 C CA . GLU A 1 51 ? 4.407 -2.874 16.075 1.00 0.00 ? 51 GLU A CA 6 ATOM 2494 C C . GLU A 1 51 ? 4.705 -4.145 16.871 1.00 0.00 ? 51 GLU A C 6 ATOM 2495 O O . GLU A 1 51 ? 4.974 -5.197 16.292 1.00 0.00 ? 51 GLU A O 6 ATOM 2496 C CB . GLU A 1 51 ? 2.924 -2.788 15.710 1.00 0.00 ? 51 GLU A CB 6 ATOM 2497 C CG . GLU A 1 51 ? 2.741 -2.349 14.258 1.00 0.00 ? 51 GLU A CG 6 ATOM 2498 C CD . GLU A 1 51 ? 1.315 -1.847 14.013 1.00 0.00 ? 51 GLU A CD 6 ATOM 2499 O OE1 . GLU A 1 51 ? 1.006 -0.685 14.314 1.00 0.00 ? 51 GLU A OE1 6 ATOM 2500 O OE2 . GLU A 1 51 ? 0.515 -2.713 13.487 1.00 0.00 ? 51 GLU A OE2 6 ATOM 2501 N N . LEU A 1 52 ? 4.645 -4.008 18.188 1.00 0.00 ? 52 LEU A N 6 ATOM 2502 C CA . LEU A 1 52 ? 4.904 -5.133 19.070 1.00 0.00 ? 52 LEU A CA 6 ATOM 2503 C C . LEU A 1 52 ? 3.586 -5.601 19.693 1.00 0.00 ? 52 LEU A C 6 ATOM 2504 O O . LEU A 1 52 ? 3.236 -6.776 19.601 1.00 0.00 ? 52 LEU A O 6 ATOM 2505 C CB . LEU A 1 52 ? 5.978 -4.772 20.099 1.00 0.00 ? 52 LEU A CB 6 ATOM 2506 C CG . LEU A 1 52 ? 7.395 -4.588 19.553 1.00 0.00 ? 52 LEU A CG 6 ATOM 2507 C CD1 . LEU A 1 52 ? 8.115 -3.445 20.270 1.00 0.00 ? 52 LEU A CD1 6 ATOM 2508 C CD2 . LEU A 1 52 ? 8.184 -5.897 19.624 1.00 0.00 ? 52 LEU A CD2 6 ATOM 2509 N N . ARG A 1 53 ? 2.895 -4.656 20.314 1.00 0.00 ? 53 ARG A N 6 ATOM 2510 C CA . ARG A 1 53 ? 1.625 -4.957 20.952 1.00 0.00 ? 53 ARG A CA 6 ATOM 2511 C C . ARG A 1 53 ? 1.745 -6.223 21.802 1.00 0.00 ? 53 ARG A C 6 ATOM 2512 O O . ARG A 1 53 ? 2.480 -6.247 22.790 1.00 0.00 ? 53 ARG A O 6 ATOM 2513 C CB . ARG A 1 53 ? 0.518 -5.150 19.914 1.00 0.00 ? 53 ARG A CB 6 ATOM 2514 C CG . ARG A 1 53 ? 0.208 -3.837 19.194 1.00 0.00 ? 53 ARG A CG 6 ATOM 2515 C CD . ARG A 1 53 ? -0.900 -4.030 18.156 1.00 0.00 ? 53 ARG A CD 6 ATOM 2516 N NE . ARG A 1 53 ? -0.330 -4.575 16.904 1.00 0.00 ? 53 ARG A NE 6 ATOM 2517 C CZ . ARG A 1 53 ? -0.511 -5.844 16.479 1.00 0.00 ? 53 ARG A CZ 6 ATOM 2518 N NH1 . ARG A 1 53 ? -1.656 -6.171 15.910 1.00 0.00 ? 53 ARG A NH1 6 ATOM 2519 N NH2 . ARG A 1 53 ? 0.465 -6.764 16.635 1.00 0.00 ? 53 ARG A NH2 6 ATOM 2520 O OXT . ARG A 1 53 ? 1.032 -7.219 21.399 1.00 0.00 ? 53 ARG A OXT 6 ATOM 2521 N N . ASN A 1 1 ? -3.796 16.191 2.546 1.00 0.00 ? 1 ASN A N 7 ATOM 2522 C CA . ASN A 1 1 ? -4.826 15.329 3.100 1.00 0.00 ? 1 ASN A CA 7 ATOM 2523 C C . ASN A 1 1 ? -5.022 14.120 2.183 1.00 0.00 ? 1 ASN A C 7 ATOM 2524 O O . ASN A 1 1 ? -5.277 14.276 0.990 1.00 0.00 ? 1 ASN A O 7 ATOM 2525 C CB . ASN A 1 1 ? -6.164 16.065 3.204 1.00 0.00 ? 1 ASN A CB 7 ATOM 2526 C CG . ASN A 1 1 ? -6.238 17.211 2.192 1.00 0.00 ? 1 ASN A CG 7 ATOM 2527 O OD1 . ASN A 1 1 ? -6.601 17.033 1.041 1.00 0.00 ? 1 ASN A OD1 7 ATOM 2528 N ND2 . ASN A 1 1 ? -5.876 18.392 2.686 1.00 0.00 ? 1 ASN A ND2 7 ATOM 2529 N N . SER A 1 2 ? -4.893 12.943 2.776 1.00 0.00 ? 2 SER A N 7 ATOM 2530 C CA . SER A 1 2 ? -5.053 11.708 2.026 1.00 0.00 ? 2 SER A CA 7 ATOM 2531 C C . SER A 1 2 ? -6.537 11.433 1.780 1.00 0.00 ? 2 SER A C 7 ATOM 2532 O O . SER A 1 2 ? -7.375 11.710 2.637 1.00 0.00 ? 2 SER A O 7 ATOM 2533 C CB . SER A 1 2 ? -4.410 10.529 2.763 1.00 0.00 ? 2 SER A CB 7 ATOM 2534 O OG . SER A 1 2 ? -4.402 9.345 1.970 1.00 0.00 ? 2 SER A OG 7 ATOM 2535 N N . TYR A 1 3 ? -6.819 10.889 0.604 1.00 0.00 ? 3 TYR A N 7 ATOM 2536 C CA . TYR A 1 3 ? -8.187 10.575 0.234 1.00 0.00 ? 3 TYR A CA 7 ATOM 2537 C C . TYR A 1 3 ? -8.273 9.200 -0.432 1.00 0.00 ? 3 TYR A C 7 ATOM 2538 O O . TYR A 1 3 ? -7.478 8.885 -1.317 1.00 0.00 ? 3 TYR A O 7 ATOM 2539 C CB . TYR A 1 3 ? -8.609 11.645 -0.776 1.00 0.00 ? 3 TYR A CB 7 ATOM 2540 C CG . TYR A 1 3 ? -10.067 11.536 -1.225 1.00 0.00 ? 3 TYR A CG 7 ATOM 2541 C CD1 . TYR A 1 3 ? -11.063 12.156 -0.496 1.00 0.00 ? 3 TYR A CD1 7 ATOM 2542 C CD2 . TYR A 1 3 ? -10.388 10.818 -2.359 1.00 0.00 ? 3 TYR A CD2 7 ATOM 2543 C CE1 . TYR A 1 3 ? -12.435 12.054 -0.919 1.00 0.00 ? 3 TYR A CE1 7 ATOM 2544 C CE2 . TYR A 1 3 ? -11.761 10.716 -2.783 1.00 0.00 ? 3 TYR A CE2 7 ATOM 2545 C CZ . TYR A 1 3 ? -12.717 11.339 -2.042 1.00 0.00 ? 3 TYR A CZ 7 ATOM 2546 O OH . TYR A 1 3 ? -14.012 11.243 -2.441 1.00 0.00 ? 3 TYR A OH 7 ATOM 2547 N N . PRO A 1 4 ? -9.270 8.398 0.028 1.00 0.00 ? 4 PRO A N 7 ATOM 2548 C CA . PRO A 1 4 ? -9.469 7.065 -0.514 1.00 0.00 ? 4 PRO A CA 7 ATOM 2549 C C . PRO A 1 4 ? -10.114 7.127 -1.899 1.00 0.00 ? 4 PRO A C 7 ATOM 2550 O O . PRO A 1 4 ? -11.296 7.444 -2.025 1.00 0.00 ? 4 PRO A O 7 ATOM 2551 C CB . PRO A 1 4 ? -10.333 6.348 0.511 1.00 0.00 ? 4 PRO A CB 7 ATOM 2552 C CG . PRO A 1 4 ? -10.968 7.440 1.356 1.00 0.00 ? 4 PRO A CG 7 ATOM 2553 C CD . PRO A 1 4 ? -10.230 8.737 1.075 1.00 0.00 ? 4 PRO A CD 7 ATOM 2554 N N . GLY A 1 5 ? -9.308 6.819 -2.907 1.00 0.00 ? 5 GLY A N 7 ATOM 2555 C CA . GLY A 1 5 ? -9.785 6.836 -4.278 1.00 0.00 ? 5 GLY A CA 7 ATOM 2556 C C . GLY A 1 5 ? -8.825 6.085 -5.202 1.00 0.00 ? 5 GLY A C 7 ATOM 2557 O O . GLY A 1 5 ? -7.639 5.959 -4.900 1.00 0.00 ? 5 GLY A O 7 ATOM 2558 N N . CYS A 1 6 ? -9.373 5.605 -6.309 1.00 0.00 ? 6 CYS A N 7 ATOM 2559 C CA . CYS A 1 6 ? -8.580 4.868 -7.278 1.00 0.00 ? 6 CYS A CA 7 ATOM 2560 C C . CYS A 1 6 ? -9.505 4.411 -8.407 1.00 0.00 ? 6 CYS A C 7 ATOM 2561 O O . CYS A 1 6 ? -10.311 3.500 -8.224 1.00 0.00 ? 6 CYS A O 7 ATOM 2562 C CB . CYS A 1 6 ? -7.844 3.692 -6.631 1.00 0.00 ? 6 CYS A CB 7 ATOM 2563 S SG . CYS A 1 6 ? -6.098 4.028 -6.191 1.00 0.00 ? 6 CYS A SG 7 ATOM 2564 N N . PRO A 1 7 ? -9.355 5.081 -9.582 1.00 0.00 ? 7 PRO A N 7 ATOM 2565 C CA . PRO A 1 7 ? -10.168 4.753 -10.741 1.00 0.00 ? 7 PRO A CA 7 ATOM 2566 C C . PRO A 1 7 ? -9.699 3.446 -11.385 1.00 0.00 ? 7 PRO A C 7 ATOM 2567 O O . PRO A 1 7 ? -8.802 2.782 -10.869 1.00 0.00 ? 7 PRO A O 7 ATOM 2568 C CB . PRO A 1 7 ? -10.037 5.952 -11.664 1.00 0.00 ? 7 PRO A CB 7 ATOM 2569 C CG . PRO A 1 7 ? -8.797 6.701 -11.205 1.00 0.00 ? 7 PRO A CG 7 ATOM 2570 C CD . PRO A 1 7 ? -8.411 6.164 -9.834 1.00 0.00 ? 7 PRO A CD 7 ATOM 2571 N N . SER A 1 8 ? -10.326 3.119 -12.506 1.00 0.00 ? 8 SER A N 7 ATOM 2572 C CA . SER A 1 8 ? -9.985 1.906 -13.227 1.00 0.00 ? 8 SER A CA 7 ATOM 2573 C C . SER A 1 8 ? -8.477 1.854 -13.483 1.00 0.00 ? 8 SER A C 7 ATOM 2574 O O . SER A 1 8 ? -7.921 0.784 -13.727 1.00 0.00 ? 8 SER A O 7 ATOM 2575 C CB . SER A 1 8 ? -10.750 1.816 -14.550 1.00 0.00 ? 8 SER A CB 7 ATOM 2576 O OG . SER A 1 8 ? -10.444 2.906 -15.416 1.00 0.00 ? 8 SER A OG 7 ATOM 2577 N N . SER A 1 9 ? -7.857 3.023 -13.414 1.00 0.00 ? 9 SER A N 7 ATOM 2578 C CA . SER A 1 9 ? -6.425 3.125 -13.634 1.00 0.00 ? 9 SER A CA 7 ATOM 2579 C C . SER A 1 9 ? -5.670 2.647 -12.392 1.00 0.00 ? 9 SER A C 7 ATOM 2580 O O . SER A 1 9 ? -4.443 2.725 -12.339 1.00 0.00 ? 9 SER A O 7 ATOM 2581 C CB . SER A 1 9 ? -6.022 4.560 -13.982 1.00 0.00 ? 9 SER A CB 7 ATOM 2582 O OG . SER A 1 9 ? -4.615 4.688 -14.168 1.00 0.00 ? 9 SER A OG 7 ATOM 2583 N N . TYR A 1 10 ? -6.433 2.164 -11.423 1.00 0.00 ? 10 TYR A N 7 ATOM 2584 C CA . TYR A 1 10 ? -5.853 1.674 -10.185 1.00 0.00 ? 10 TYR A CA 7 ATOM 2585 C C . TYR A 1 10 ? -6.620 0.459 -9.662 1.00 0.00 ? 10 TYR A C 7 ATOM 2586 O O . TYR A 1 10 ? -7.497 0.594 -8.809 1.00 0.00 ? 10 TYR A O 7 ATOM 2587 C CB . TYR A 1 10 ? -5.983 2.818 -9.178 1.00 0.00 ? 10 TYR A CB 7 ATOM 2588 C CG . TYR A 1 10 ? -4.957 3.937 -9.368 1.00 0.00 ? 10 TYR A CG 7 ATOM 2589 C CD1 . TYR A 1 10 ? -5.070 4.801 -10.438 1.00 0.00 ? 10 TYR A CD1 7 ATOM 2590 C CD2 . TYR A 1 10 ? -3.918 4.081 -8.471 1.00 0.00 ? 10 TYR A CD2 7 ATOM 2591 C CE1 . TYR A 1 10 ? -4.104 5.855 -10.617 1.00 0.00 ? 10 TYR A CE1 7 ATOM 2592 C CE2 . TYR A 1 10 ? -2.953 5.132 -8.650 1.00 0.00 ? 10 TYR A CE2 7 ATOM 2593 C CZ . TYR A 1 10 ? -3.093 5.968 -9.714 1.00 0.00 ? 10 TYR A CZ 7 ATOM 2594 O OH . TYR A 1 10 ? -2.181 6.963 -9.884 1.00 0.00 ? 10 TYR A OH 7 ATOM 2595 N N . ASP A 1 11 ? -6.262 -0.700 -10.193 1.00 0.00 ? 11 ASP A N 7 ATOM 2596 C CA . ASP A 1 11 ? -6.907 -1.939 -9.791 1.00 0.00 ? 11 ASP A CA 7 ATOM 2597 C C . ASP A 1 11 ? -6.492 -2.282 -8.359 1.00 0.00 ? 11 ASP A C 7 ATOM 2598 O O . ASP A 1 11 ? -5.978 -3.371 -8.103 1.00 0.00 ? 11 ASP A O 7 ATOM 2599 C CB . ASP A 1 11 ? -6.485 -3.099 -10.697 1.00 0.00 ? 11 ASP A CB 7 ATOM 2600 C CG . ASP A 1 11 ? -7.181 -4.430 -10.408 1.00 0.00 ? 11 ASP A CG 7 ATOM 2601 O OD1 . ASP A 1 11 ? -8.335 -4.575 -10.962 1.00 0.00 ? 11 ASP A OD1 7 ATOM 2602 O OD2 . ASP A 1 11 ? -6.645 -5.286 -9.688 1.00 0.00 ? 11 ASP A OD2 7 ATOM 2603 N N . GLY A 1 12 ? -6.729 -1.336 -7.465 1.00 0.00 ? 12 GLY A N 7 ATOM 2604 C CA . GLY A 1 12 ? -6.387 -1.525 -6.066 1.00 0.00 ? 12 GLY A CA 7 ATOM 2605 C C . GLY A 1 12 ? -5.049 -0.859 -5.733 1.00 0.00 ? 12 GLY A C 7 ATOM 2606 O O . GLY A 1 12 ? -4.851 -0.381 -4.617 1.00 0.00 ? 12 GLY A O 7 ATOM 2607 N N . TYR A 1 13 ? -4.169 -0.848 -6.723 1.00 0.00 ? 13 TYR A N 7 ATOM 2608 C CA . TYR A 1 13 ? -2.855 -0.249 -6.549 1.00 0.00 ? 13 TYR A CA 7 ATOM 2609 C C . TYR A 1 13 ? -2.008 -1.058 -5.566 1.00 0.00 ? 13 TYR A C 7 ATOM 2610 O O . TYR A 1 13 ? -0.827 -1.300 -5.811 1.00 0.00 ? 13 TYR A O 7 ATOM 2611 C CB . TYR A 1 13 ? -3.103 1.143 -5.967 1.00 0.00 ? 13 TYR A CB 7 ATOM 2612 C CG . TYR A 1 13 ? -2.085 2.194 -6.416 1.00 0.00 ? 13 TYR A CG 7 ATOM 2613 C CD1 . TYR A 1 13 ? -1.769 2.323 -7.754 1.00 0.00 ? 13 TYR A CD1 7 ATOM 2614 C CD2 . TYR A 1 13 ? -1.483 3.015 -5.484 1.00 0.00 ? 13 TYR A CD2 7 ATOM 2615 C CE1 . TYR A 1 13 ? -0.812 3.312 -8.176 1.00 0.00 ? 13 TYR A CE1 7 ATOM 2616 C CE2 . TYR A 1 13 ? -0.527 4.006 -5.907 1.00 0.00 ? 13 TYR A CE2 7 ATOM 2617 C CZ . TYR A 1 13 ? -0.238 4.105 -7.232 1.00 0.00 ? 13 TYR A CZ 7 ATOM 2618 O OH . TYR A 1 13 ? 0.666 5.039 -7.631 1.00 0.00 ? 13 TYR A OH 7 ATOM 2619 N N . CYS A 1 14 ? -2.645 -1.454 -4.473 1.00 0.00 ? 14 CYS A N 7 ATOM 2620 C CA . CYS A 1 14 ? -1.965 -2.231 -3.451 1.00 0.00 ? 14 CYS A CA 7 ATOM 2621 C C . CYS A 1 14 ? -2.408 -3.689 -3.583 1.00 0.00 ? 14 CYS A C 7 ATOM 2622 O O . CYS A 1 14 ? -3.592 -3.995 -3.453 1.00 0.00 ? 14 CYS A O 7 ATOM 2623 C CB . CYS A 1 14 ? -2.230 -1.676 -2.049 1.00 0.00 ? 14 CYS A CB 7 ATOM 2624 S SG . CYS A 1 14 ? -1.931 0.119 -1.863 1.00 0.00 ? 14 CYS A SG 7 ATOM 2625 N N . LEU A 1 15 ? -1.432 -4.550 -3.835 1.00 0.00 ? 15 LEU A N 7 ATOM 2626 C CA . LEU A 1 15 ? -1.709 -5.968 -3.984 1.00 0.00 ? 15 LEU A CA 7 ATOM 2627 C C . LEU A 1 15 ? -1.329 -6.697 -2.692 1.00 0.00 ? 15 LEU A C 7 ATOM 2628 O O . LEU A 1 15 ? -0.310 -6.388 -2.078 1.00 0.00 ? 15 LEU A O 7 ATOM 2629 C CB . LEU A 1 15 ? -1.011 -6.522 -5.228 1.00 0.00 ? 15 LEU A CB 7 ATOM 2630 C CG . LEU A 1 15 ? -0.111 -5.542 -5.984 1.00 0.00 ? 15 LEU A CG 7 ATOM 2631 C CD1 . LEU A 1 15 ? 1.265 -5.438 -5.325 1.00 0.00 ? 15 LEU A CD1 7 ATOM 2632 C CD2 . LEU A 1 15 ? -0.011 -5.920 -7.464 1.00 0.00 ? 15 LEU A CD2 7 ATOM 2633 N N . ASN A 1 16 ? -2.171 -7.648 -2.319 1.00 0.00 ? 16 ASN A N 7 ATOM 2634 C CA . ASN A 1 16 ? -1.937 -8.421 -1.110 1.00 0.00 ? 16 ASN A CA 7 ATOM 2635 C C . ASN A 1 16 ? -1.235 -7.542 -0.075 1.00 0.00 ? 16 ASN A C 7 ATOM 2636 O O . ASN A 1 16 ? -0.142 -7.870 0.384 1.00 0.00 ? 16 ASN A O 7 ATOM 2637 C CB . ASN A 1 16 ? -1.040 -9.628 -1.394 1.00 0.00 ? 16 ASN A CB 7 ATOM 2638 C CG . ASN A 1 16 ? -0.765 -9.767 -2.892 1.00 0.00 ? 16 ASN A CG 7 ATOM 2639 O OD1 . ASN A 1 16 ? -1.653 -10.015 -3.692 1.00 0.00 ? 16 ASN A OD1 7 ATOM 2640 N ND2 . ASN A 1 16 ? 0.509 -9.594 -3.227 1.00 0.00 ? 16 ASN A ND2 7 ATOM 2641 N N . GLY A 1 17 ? -1.891 -6.442 0.264 1.00 0.00 ? 17 GLY A N 7 ATOM 2642 C CA . GLY A 1 17 ? -1.341 -5.513 1.236 1.00 0.00 ? 17 GLY A CA 7 ATOM 2643 C C . GLY A 1 17 ? -2.152 -4.215 1.273 1.00 0.00 ? 17 GLY A C 7 ATOM 2644 O O . GLY A 1 17 ? -2.057 -3.394 0.363 1.00 0.00 ? 17 GLY A O 7 ATOM 2645 N N . GLY A 1 18 ? -2.930 -4.070 2.336 1.00 0.00 ? 18 GLY A N 7 ATOM 2646 C CA . GLY A 1 18 ? -3.756 -2.886 2.503 1.00 0.00 ? 18 GLY A CA 7 ATOM 2647 C C . GLY A 1 18 ? -4.538 -2.579 1.224 1.00 0.00 ? 18 GLY A C 7 ATOM 2648 O O . GLY A 1 18 ? -4.780 -3.469 0.411 1.00 0.00 ? 18 GLY A O 7 ATOM 2649 N N . VAL A 1 19 ? -4.909 -1.315 1.087 1.00 0.00 ? 19 VAL A N 7 ATOM 2650 C CA . VAL A 1 19 ? -5.659 -0.878 -0.079 1.00 0.00 ? 19 VAL A CA 7 ATOM 2651 C C . VAL A 1 19 ? -5.003 0.377 -0.662 1.00 0.00 ? 19 VAL A C 7 ATOM 2652 O O . VAL A 1 19 ? -3.979 0.835 -0.158 1.00 0.00 ? 19 VAL A O 7 ATOM 2653 C CB . VAL A 1 19 ? -7.128 -0.666 0.292 1.00 0.00 ? 19 VAL A CB 7 ATOM 2654 C CG1 . VAL A 1 19 ? -7.399 0.798 0.642 1.00 0.00 ? 19 VAL A CG1 7 ATOM 2655 C CG2 . VAL A 1 19 ? -8.051 -1.141 -0.831 1.00 0.00 ? 19 VAL A CG2 7 ATOM 2656 N N . CYS A 1 20 ? -5.619 0.895 -1.712 1.00 0.00 ? 20 CYS A N 7 ATOM 2657 C CA . CYS A 1 20 ? -5.108 2.086 -2.368 1.00 0.00 ? 20 CYS A CA 7 ATOM 2658 C C . CYS A 1 20 ? -5.523 3.306 -1.542 1.00 0.00 ? 20 CYS A C 7 ATOM 2659 O O . CYS A 1 20 ? -6.439 3.223 -0.726 1.00 0.00 ? 20 CYS A O 7 ATOM 2660 C CB . CYS A 1 20 ? -5.592 2.186 -3.817 1.00 0.00 ? 20 CYS A CB 7 ATOM 2661 S SG . CYS A 1 20 ? -5.830 3.894 -4.429 1.00 0.00 ? 20 CYS A SG 7 ATOM 2662 N N . MET A 1 21 ? -4.830 4.408 -1.783 1.00 0.00 ? 21 MET A N 7 ATOM 2663 C CA . MET A 1 21 ? -5.115 5.642 -1.071 1.00 0.00 ? 21 MET A CA 7 ATOM 2664 C C . MET A 1 21 ? -4.683 6.860 -1.891 1.00 0.00 ? 21 MET A C 7 ATOM 2665 O O . MET A 1 21 ? -3.490 7.118 -2.043 1.00 0.00 ? 21 MET A O 7 ATOM 2666 C CB . MET A 1 21 ? -4.378 5.641 0.270 1.00 0.00 ? 21 MET A CB 7 ATOM 2667 C CG . MET A 1 21 ? -5.313 5.226 1.408 1.00 0.00 ? 21 MET A CG 7 ATOM 2668 S SD . MET A 1 21 ? -4.774 5.967 2.940 1.00 0.00 ? 21 MET A SD 7 ATOM 2669 C CE . MET A 1 21 ? -6.184 7.000 3.298 1.00 0.00 ? 21 MET A CE 7 ATOM 2670 N N . HIS A 1 22 ? -5.677 7.576 -2.395 1.00 0.00 ? 22 HIS A N 7 ATOM 2671 C CA . HIS A 1 22 ? -5.414 8.761 -3.195 1.00 0.00 ? 22 HIS A CA 7 ATOM 2672 C C . HIS A 1 22 ? -4.963 9.905 -2.284 1.00 0.00 ? 22 HIS A C 7 ATOM 2673 O O . HIS A 1 22 ? -5.359 9.971 -1.122 1.00 0.00 ? 22 HIS A O 7 ATOM 2674 C CB . HIS A 1 22 ? -6.634 9.125 -4.043 1.00 0.00 ? 22 HIS A CB 7 ATOM 2675 C CG . HIS A 1 22 ? -6.362 10.180 -5.088 1.00 0.00 ? 22 HIS A CG 7 ATOM 2676 N ND1 . HIS A 1 22 ? -7.206 11.253 -5.308 1.00 0.00 ? 22 HIS A ND1 7 ATOM 2677 C CD2 . HIS A 1 22 ? -5.333 10.314 -5.972 1.00 0.00 ? 22 HIS A CD2 7 ATOM 2678 C CE1 . HIS A 1 22 ? -6.698 11.993 -6.281 1.00 0.00 ? 22 HIS A CE1 7 ATOM 2679 N NE2 . HIS A 1 22 ? -5.536 11.409 -6.693 1.00 0.00 ? 22 HIS A NE2 7 ATOM 2680 N N . ILE A 1 23 ? -4.139 10.777 -2.847 1.00 0.00 ? 23 ILE A N 7 ATOM 2681 C CA . ILE A 1 23 ? -3.629 11.914 -2.102 1.00 0.00 ? 23 ILE A CA 7 ATOM 2682 C C . ILE A 1 23 ? -4.189 13.205 -2.702 1.00 0.00 ? 23 ILE A C 7 ATOM 2683 O O . ILE A 1 23 ? -4.694 13.204 -3.823 1.00 0.00 ? 23 ILE A O 7 ATOM 2684 C CB . ILE A 1 23 ? -2.101 11.875 -2.043 1.00 0.00 ? 23 ILE A CB 7 ATOM 2685 C CG1 . ILE A 1 23 ? -1.576 10.470 -2.344 1.00 0.00 ? 23 ILE A CG1 7 ATOM 2686 C CG2 . ILE A 1 23 ? -1.590 12.404 -0.700 1.00 0.00 ? 23 ILE A CG2 7 ATOM 2687 C CD1 . ILE A 1 23 ? -0.053 10.473 -2.488 1.00 0.00 ? 23 ILE A CD1 7 ATOM 2688 N N . GLU A 1 24 ? -4.083 14.276 -1.928 1.00 0.00 ? 24 GLU A N 7 ATOM 2689 C CA . GLU A 1 24 ? -4.572 15.570 -2.370 1.00 0.00 ? 24 GLU A CA 7 ATOM 2690 C C . GLU A 1 24 ? -3.412 16.558 -2.505 1.00 0.00 ? 24 GLU A C 7 ATOM 2691 O O . GLU A 1 24 ? -3.591 17.667 -3.005 1.00 0.00 ? 24 GLU A O 7 ATOM 2692 C CB . GLU A 1 24 ? -5.641 16.107 -1.417 1.00 0.00 ? 24 GLU A CB 7 ATOM 2693 C CG . GLU A 1 24 ? -6.974 15.382 -1.623 1.00 0.00 ? 24 GLU A CG 7 ATOM 2694 C CD . GLU A 1 24 ? -8.101 16.079 -0.858 1.00 0.00 ? 24 GLU A CD 7 ATOM 2695 O OE1 . GLU A 1 24 ? -8.602 17.121 -1.306 1.00 0.00 ? 24 GLU A OE1 7 ATOM 2696 O OE2 . GLU A 1 24 ? -8.454 15.500 0.239 1.00 0.00 ? 24 GLU A OE2 7 ATOM 2697 N N . SER A 1 25 ? -2.246 16.120 -2.049 1.00 0.00 ? 25 SER A N 7 ATOM 2698 C CA . SER A 1 25 ? -1.058 16.952 -2.112 1.00 0.00 ? 25 SER A CA 7 ATOM 2699 C C . SER A 1 25 ? -0.740 17.300 -3.567 1.00 0.00 ? 25 SER A C 7 ATOM 2700 O O . SER A 1 25 ? -0.166 18.352 -3.848 1.00 0.00 ? 25 SER A O 7 ATOM 2701 C CB . SER A 1 25 ? 0.137 16.255 -1.459 1.00 0.00 ? 25 SER A CB 7 ATOM 2702 O OG . SER A 1 25 ? -0.113 15.931 -0.096 1.00 0.00 ? 25 SER A OG 7 ATOM 2703 N N . LEU A 1 26 ? -1.125 16.397 -4.457 1.00 0.00 ? 26 LEU A N 7 ATOM 2704 C CA . LEU A 1 26 ? -0.889 16.595 -5.876 1.00 0.00 ? 26 LEU A CA 7 ATOM 2705 C C . LEU A 1 26 ? -1.841 15.706 -6.677 1.00 0.00 ? 26 LEU A C 7 ATOM 2706 O O . LEU A 1 26 ? -1.551 15.348 -7.819 1.00 0.00 ? 26 LEU A O 7 ATOM 2707 C CB . LEU A 1 26 ? 0.587 16.370 -6.210 1.00 0.00 ? 26 LEU A CB 7 ATOM 2708 C CG . LEU A 1 26 ? 1.365 17.603 -6.679 1.00 0.00 ? 26 LEU A CG 7 ATOM 2709 C CD1 . LEU A 1 26 ? 2.872 17.331 -6.684 1.00 0.00 ? 26 LEU A CD1 7 ATOM 2710 C CD2 . LEU A 1 26 ? 0.864 18.082 -8.042 1.00 0.00 ? 26 LEU A CD2 7 ATOM 2711 N N . ASP A 1 27 ? -2.960 15.375 -6.050 1.00 0.00 ? 27 ASP A N 7 ATOM 2712 C CA . ASP A 1 27 ? -3.958 14.535 -6.689 1.00 0.00 ? 27 ASP A CA 7 ATOM 2713 C C . ASP A 1 27 ? -3.314 13.209 -7.101 1.00 0.00 ? 27 ASP A C 7 ATOM 2714 O O . ASP A 1 27 ? -3.770 12.559 -8.039 1.00 0.00 ? 27 ASP A O 7 ATOM 2715 C CB . ASP A 1 27 ? -4.513 15.201 -7.949 1.00 0.00 ? 27 ASP A CB 7 ATOM 2716 C CG . ASP A 1 27 ? -6.034 15.139 -8.098 1.00 0.00 ? 27 ASP A CG 7 ATOM 2717 O OD1 . ASP A 1 27 ? -6.771 15.892 -7.446 1.00 0.00 ? 27 ASP A OD1 7 ATOM 2718 O OD2 . ASP A 1 27 ? -6.464 14.257 -8.938 1.00 0.00 ? 27 ASP A OD2 7 ATOM 2719 N N . SER A 1 28 ? -2.265 12.848 -6.376 1.00 0.00 ? 28 SER A N 7 ATOM 2720 C CA . SER A 1 28 ? -1.554 11.612 -6.654 1.00 0.00 ? 28 SER A CA 7 ATOM 2721 C C . SER A 1 28 ? -2.217 10.450 -5.912 1.00 0.00 ? 28 SER A C 7 ATOM 2722 O O . SER A 1 28 ? -2.999 10.665 -4.987 1.00 0.00 ? 28 SER A O 7 ATOM 2723 C CB . SER A 1 28 ? -0.080 11.723 -6.257 1.00 0.00 ? 28 SER A CB 7 ATOM 2724 O OG . SER A 1 28 ? 0.608 10.484 -6.409 1.00 0.00 ? 28 SER A OG 7 ATOM 2725 N N . TYR A 1 29 ? -1.880 9.244 -6.344 1.00 0.00 ? 29 TYR A N 7 ATOM 2726 C CA . TYR A 1 29 ? -2.432 8.047 -5.732 1.00 0.00 ? 29 TYR A CA 7 ATOM 2727 C C . TYR A 1 29 ? -1.339 7.228 -5.046 1.00 0.00 ? 29 TYR A C 7 ATOM 2728 O O . TYR A 1 29 ? -0.408 6.755 -5.699 1.00 0.00 ? 29 TYR A O 7 ATOM 2729 C CB . TYR A 1 29 ? -3.027 7.226 -6.876 1.00 0.00 ? 29 TYR A CB 7 ATOM 2730 C CG . TYR A 1 29 ? -4.367 7.754 -7.392 1.00 0.00 ? 29 TYR A CG 7 ATOM 2731 C CD1 . TYR A 1 29 ? -4.397 8.678 -8.416 1.00 0.00 ? 29 TYR A CD1 7 ATOM 2732 C CD2 . TYR A 1 29 ? -5.547 7.305 -6.833 1.00 0.00 ? 29 TYR A CD2 7 ATOM 2733 C CE1 . TYR A 1 29 ? -5.659 9.175 -8.900 1.00 0.00 ? 29 TYR A CE1 7 ATOM 2734 C CE2 . TYR A 1 29 ? -6.808 7.803 -7.316 1.00 0.00 ? 29 TYR A CE2 7 ATOM 2735 C CZ . TYR A 1 29 ? -6.802 8.714 -8.327 1.00 0.00 ? 29 TYR A CZ 7 ATOM 2736 O OH . TYR A 1 29 ? -7.993 9.182 -8.785 1.00 0.00 ? 29 TYR A OH 7 ATOM 2737 N N . THR A 1 30 ? -1.485 7.082 -3.737 1.00 0.00 ? 30 THR A N 7 ATOM 2738 C CA . THR A 1 30 ? -0.521 6.327 -2.954 1.00 0.00 ? 30 THR A CA 7 ATOM 2739 C C . THR A 1 30 ? -1.059 4.926 -2.654 1.00 0.00 ? 30 THR A C 7 ATOM 2740 O O . THR A 1 30 ? -2.163 4.578 -3.071 1.00 0.00 ? 30 THR A O 7 ATOM 2741 C CB . THR A 1 30 ? -0.196 7.134 -1.696 1.00 0.00 ? 30 THR A CB 7 ATOM 2742 O OG1 . THR A 1 30 ? 0.868 6.410 -1.084 1.00 0.00 ? 30 THR A OG1 7 ATOM 2743 C CG2 . THR A 1 30 ? -1.323 7.090 -0.663 1.00 0.00 ? 30 THR A CG2 7 ATOM 2744 N N . CYS A 1 31 ? -0.253 4.160 -1.935 1.00 0.00 ? 31 CYS A N 7 ATOM 2745 C CA . CYS A 1 31 ? -0.633 2.804 -1.573 1.00 0.00 ? 31 CYS A CA 7 ATOM 2746 C C . CYS A 1 31 ? -0.314 2.594 -0.093 1.00 0.00 ? 31 CYS A C 7 ATOM 2747 O O . CYS A 1 31 ? 0.792 2.893 0.357 1.00 0.00 ? 31 CYS A O 7 ATOM 2748 C CB . CYS A 1 31 ? 0.061 1.768 -2.459 1.00 0.00 ? 31 CYS A CB 7 ATOM 2749 S SG . CYS A 1 31 ? -1.067 0.600 -3.302 1.00 0.00 ? 31 CYS A SG 7 ATOM 2750 N N . ASN A 1 32 ? -1.303 2.083 0.625 1.00 0.00 ? 32 ASN A N 7 ATOM 2751 C CA . ASN A 1 32 ? -1.142 1.828 2.048 1.00 0.00 ? 32 ASN A CA 7 ATOM 2752 C C . ASN A 1 32 ? -1.399 0.346 2.329 1.00 0.00 ? 32 ASN A C 7 ATOM 2753 O O . ASN A 1 32 ? -2.549 -0.072 2.469 1.00 0.00 ? 32 ASN A O 7 ATOM 2754 C CB . ASN A 1 32 ? -2.141 2.646 2.869 1.00 0.00 ? 32 ASN A CB 7 ATOM 2755 C CG . ASN A 1 32 ? -3.498 2.725 2.165 1.00 0.00 ? 32 ASN A CG 7 ATOM 2756 O OD1 . ASN A 1 32 ? -3.591 2.904 0.963 1.00 0.00 ? 32 ASN A OD1 7 ATOM 2757 N ND2 . ASN A 1 32 ? -4.538 2.583 2.980 1.00 0.00 ? 32 ASN A ND2 7 ATOM 2758 N N . CYS A 1 33 ? -0.312 -0.406 2.403 1.00 0.00 ? 33 CYS A N 7 ATOM 2759 C CA . CYS A 1 33 ? -0.405 -1.832 2.667 1.00 0.00 ? 33 CYS A CA 7 ATOM 2760 C C . CYS A 1 33 ? -0.483 -2.037 4.181 1.00 0.00 ? 33 CYS A C 7 ATOM 2761 O O . CYS A 1 33 ? -1.424 -1.577 4.826 1.00 0.00 ? 33 CYS A O 7 ATOM 2762 C CB . CYS A 1 33 ? 0.763 -2.600 2.045 1.00 0.00 ? 33 CYS A CB 7 ATOM 2763 S SG . CYS A 1 33 ? 0.945 -2.391 0.237 1.00 0.00 ? 33 CYS A SG 7 ATOM 2764 N N . VAL A 1 34 ? 0.517 -2.730 4.704 1.00 0.00 ? 34 VAL A N 7 ATOM 2765 C CA . VAL A 1 34 ? 0.575 -3.003 6.131 1.00 0.00 ? 34 VAL A CA 7 ATOM 2766 C C . VAL A 1 34 ? 2.032 -2.964 6.594 1.00 0.00 ? 34 VAL A C 7 ATOM 2767 O O . VAL A 1 34 ? 2.914 -2.544 5.847 1.00 0.00 ? 34 VAL A O 7 ATOM 2768 C CB . VAL A 1 34 ? -0.115 -4.334 6.436 1.00 0.00 ? 34 VAL A CB 7 ATOM 2769 C CG1 . VAL A 1 34 ? -1.613 -4.132 6.682 1.00 0.00 ? 34 VAL A CG1 7 ATOM 2770 C CG2 . VAL A 1 34 ? 0.125 -5.347 5.316 1.00 0.00 ? 34 VAL A CG2 7 ATOM 2771 N N . ILE A 1 35 ? 2.239 -3.408 7.826 1.00 0.00 ? 35 ILE A N 7 ATOM 2772 C CA . ILE A 1 35 ? 3.574 -3.428 8.399 1.00 0.00 ? 35 ILE A CA 7 ATOM 2773 C C . ILE A 1 35 ? 4.523 -4.153 7.442 1.00 0.00 ? 35 ILE A C 7 ATOM 2774 O O . ILE A 1 35 ? 4.153 -5.162 6.843 1.00 0.00 ? 35 ILE A O 7 ATOM 2775 C CB . ILE A 1 35 ? 3.542 -4.028 9.807 1.00 0.00 ? 35 ILE A CB 7 ATOM 2776 C CG1 . ILE A 1 35 ? 3.445 -5.554 9.752 1.00 0.00 ? 35 ILE A CG1 7 ATOM 2777 C CG2 . ILE A 1 35 ? 2.418 -3.411 10.641 1.00 0.00 ? 35 ILE A CG2 7 ATOM 2778 C CD1 . ILE A 1 35 ? 4.219 -6.194 10.905 1.00 0.00 ? 35 ILE A CD1 7 ATOM 2779 N N . GLY A 1 36 ? 5.726 -3.612 7.332 1.00 0.00 ? 36 GLY A N 7 ATOM 2780 C CA . GLY A 1 36 ? 6.732 -4.194 6.458 1.00 0.00 ? 36 GLY A CA 7 ATOM 2781 C C . GLY A 1 36 ? 6.188 -4.375 5.039 1.00 0.00 ? 36 GLY A C 7 ATOM 2782 O O . GLY A 1 36 ? 6.821 -5.018 4.205 1.00 0.00 ? 36 GLY A O 7 ATOM 2783 N N . TYR A 1 37 ? 5.019 -3.795 4.811 1.00 0.00 ? 37 TYR A N 7 ATOM 2784 C CA . TYR A 1 37 ? 4.382 -3.882 3.507 1.00 0.00 ? 37 TYR A CA 7 ATOM 2785 C C . TYR A 1 37 ? 4.051 -2.490 2.965 1.00 0.00 ? 37 TYR A C 7 ATOM 2786 O O . TYR A 1 37 ? 3.286 -1.748 3.576 1.00 0.00 ? 37 TYR A O 7 ATOM 2787 C CB . TYR A 1 37 ? 3.080 -4.654 3.724 1.00 0.00 ? 37 TYR A CB 7 ATOM 2788 C CG . TYR A 1 37 ? 3.222 -6.171 3.569 1.00 0.00 ? 37 TYR A CG 7 ATOM 2789 C CD1 . TYR A 1 37 ? 4.144 -6.860 4.331 1.00 0.00 ? 37 TYR A CD1 7 ATOM 2790 C CD2 . TYR A 1 37 ? 2.429 -6.849 2.666 1.00 0.00 ? 37 TYR A CD2 7 ATOM 2791 C CE1 . TYR A 1 37 ? 4.276 -8.285 4.185 1.00 0.00 ? 37 TYR A CE1 7 ATOM 2792 C CE2 . TYR A 1 37 ? 2.563 -8.274 2.520 1.00 0.00 ? 37 TYR A CE2 7 ATOM 2793 C CZ . TYR A 1 37 ? 3.480 -8.922 3.286 1.00 0.00 ? 37 TYR A CZ 7 ATOM 2794 O OH . TYR A 1 37 ? 3.606 -10.270 3.148 1.00 0.00 ? 37 TYR A OH 7 ATOM 2795 N N . SER A 1 38 ? 4.644 -2.181 1.820 1.00 0.00 ? 38 SER A N 7 ATOM 2796 C CA . SER A 1 38 ? 4.421 -0.892 1.186 1.00 0.00 ? 38 SER A CA 7 ATOM 2797 C C . SER A 1 38 ? 4.950 -0.915 -0.248 1.00 0.00 ? 38 SER A C 7 ATOM 2798 O O . SER A 1 38 ? 5.160 -1.985 -0.819 1.00 0.00 ? 38 SER A O 7 ATOM 2799 C CB . SER A 1 38 ? 5.088 0.233 1.980 1.00 0.00 ? 38 SER A CB 7 ATOM 2800 O OG . SER A 1 38 ? 4.604 1.517 1.596 1.00 0.00 ? 38 SER A OG 7 ATOM 2801 N N . GLY A 1 39 ? 5.153 0.278 -0.790 1.00 0.00 ? 39 GLY A N 7 ATOM 2802 C CA . GLY A 1 39 ? 5.654 0.407 -2.148 1.00 0.00 ? 39 GLY A CA 7 ATOM 2803 C C . GLY A 1 39 ? 4.562 0.923 -3.088 1.00 0.00 ? 39 GLY A C 7 ATOM 2804 O O . GLY A 1 39 ? 3.392 0.983 -2.712 1.00 0.00 ? 39 GLY A O 7 ATOM 2805 N N . ASP A 1 40 ? 4.984 1.281 -4.292 1.00 0.00 ? 40 ASP A N 7 ATOM 2806 C CA . ASP A 1 40 ? 4.057 1.789 -5.289 1.00 0.00 ? 40 ASP A CA 7 ATOM 2807 C C . ASP A 1 40 ? 2.736 1.024 -5.187 1.00 0.00 ? 40 ASP A C 7 ATOM 2808 O O . ASP A 1 40 ? 1.672 1.575 -5.469 1.00 0.00 ? 40 ASP A O 7 ATOM 2809 C CB . ASP A 1 40 ? 4.609 1.596 -6.703 1.00 0.00 ? 40 ASP A CB 7 ATOM 2810 C CG . ASP A 1 40 ? 5.339 0.272 -6.936 1.00 0.00 ? 40 ASP A CG 7 ATOM 2811 O OD1 . ASP A 1 40 ? 6.591 0.279 -6.626 1.00 0.00 ? 40 ASP A OD1 7 ATOM 2812 O OD2 . ASP A 1 40 ? 4.743 -0.717 -7.390 1.00 0.00 ? 40 ASP A OD2 7 ATOM 2813 N N . ARG A 1 41 ? 2.847 -0.233 -4.783 1.00 0.00 ? 41 ARG A N 7 ATOM 2814 C CA . ARG A 1 41 ? 1.673 -1.078 -4.642 1.00 0.00 ? 41 ARG A CA 7 ATOM 2815 C C . ARG A 1 41 ? 1.701 -1.803 -3.295 1.00 0.00 ? 41 ARG A C 7 ATOM 2816 O O . ARG A 1 41 ? 0.837 -1.580 -2.447 1.00 0.00 ? 41 ARG A O 7 ATOM 2817 C CB . ARG A 1 41 ? 1.600 -2.113 -5.767 1.00 0.00 ? 41 ARG A CB 7 ATOM 2818 C CG . ARG A 1 41 ? 1.434 -1.432 -7.127 1.00 0.00 ? 41 ARG A CG 7 ATOM 2819 C CD . ARG A 1 41 ? 0.765 -2.370 -8.132 1.00 0.00 ? 41 ARG A CD 7 ATOM 2820 N NE . ARG A 1 41 ? 1.773 -3.275 -8.730 1.00 0.00 ? 41 ARG A NE 7 ATOM 2821 C CZ . ARG A 1 41 ? 2.200 -3.192 -10.008 1.00 0.00 ? 41 ARG A CZ 7 ATOM 2822 N NH1 . ARG A 1 41 ? 3.205 -2.353 -10.342 1.00 0.00 ? 41 ARG A NH1 7 ATOM 2823 N NH2 . ARG A 1 41 ? 1.623 -3.944 -10.926 1.00 0.00 ? 41 ARG A NH2 7 ATOM 2824 N N . CYS A 1 42 ? 2.703 -2.657 -3.138 1.00 0.00 ? 42 CYS A N 7 ATOM 2825 C CA . CYS A 1 42 ? 2.854 -3.414 -1.908 1.00 0.00 ? 42 CYS A CA 7 ATOM 2826 C C . CYS A 1 42 ? 3.997 -4.414 -2.098 1.00 0.00 ? 42 CYS A C 7 ATOM 2827 O O . CYS A 1 42 ? 4.063 -5.428 -1.403 1.00 0.00 ? 42 CYS A O 7 ATOM 2828 C CB . CYS A 1 42 ? 1.551 -4.108 -1.507 1.00 0.00 ? 42 CYS A CB 7 ATOM 2829 S SG . CYS A 1 42 ? 0.555 -3.209 -0.261 1.00 0.00 ? 42 CYS A SG 7 ATOM 2830 N N . GLN A 1 43 ? 4.869 -4.095 -3.043 1.00 0.00 ? 43 GLN A N 7 ATOM 2831 C CA . GLN A 1 43 ? 6.006 -4.952 -3.332 1.00 0.00 ? 43 GLN A CA 7 ATOM 2832 C C . GLN A 1 43 ? 6.964 -4.986 -2.139 1.00 0.00 ? 43 GLN A C 7 ATOM 2833 O O . GLN A 1 43 ? 7.643 -5.986 -1.913 1.00 0.00 ? 43 GLN A O 7 ATOM 2834 C CB . GLN A 1 43 ? 6.728 -4.495 -4.601 1.00 0.00 ? 43 GLN A CB 7 ATOM 2835 C CG . GLN A 1 43 ? 8.124 -5.113 -4.690 1.00 0.00 ? 43 GLN A CG 7 ATOM 2836 C CD . GLN A 1 43 ? 8.829 -4.693 -5.983 1.00 0.00 ? 43 GLN A CD 7 ATOM 2837 O OE1 . GLN A 1 43 ? 8.678 -5.303 -7.028 1.00 0.00 ? 43 GLN A OE1 7 ATOM 2838 N NE2 . GLN A 1 43 ? 9.604 -3.619 -5.853 1.00 0.00 ? 43 GLN A NE2 7 ATOM 2839 N N . THR A 1 44 ? 6.987 -3.881 -1.407 1.00 0.00 ? 44 THR A N 7 ATOM 2840 C CA . THR A 1 44 ? 7.849 -3.772 -0.244 1.00 0.00 ? 44 THR A CA 7 ATOM 2841 C C . THR A 1 44 ? 7.401 -4.749 0.844 1.00 0.00 ? 44 THR A C 7 ATOM 2842 O O . THR A 1 44 ? 7.013 -4.336 1.935 1.00 0.00 ? 44 THR A O 7 ATOM 2843 C CB . THR A 1 44 ? 7.844 -2.311 0.212 1.00 0.00 ? 44 THR A CB 7 ATOM 2844 O OG1 . THR A 1 44 ? 7.960 -1.568 -0.998 1.00 0.00 ? 44 THR A OG1 7 ATOM 2845 C CG2 . THR A 1 44 ? 9.104 -1.940 0.998 1.00 0.00 ? 44 THR A CG2 7 ATOM 2846 N N . ARG A 1 45 ? 7.473 -6.030 0.510 1.00 0.00 ? 45 ARG A N 7 ATOM 2847 C CA . ARG A 1 45 ? 7.080 -7.071 1.446 1.00 0.00 ? 45 ARG A CA 7 ATOM 2848 C C . ARG A 1 45 ? 8.120 -7.201 2.560 1.00 0.00 ? 45 ARG A C 7 ATOM 2849 O O . ARG A 1 45 ? 9.320 -7.235 2.295 1.00 0.00 ? 45 ARG A O 7 ATOM 2850 C CB . ARG A 1 45 ? 6.928 -8.418 0.739 1.00 0.00 ? 45 ARG A CB 7 ATOM 2851 C CG . ARG A 1 45 ? 5.511 -8.971 0.908 1.00 0.00 ? 45 ARG A CG 7 ATOM 2852 C CD . ARG A 1 45 ? 5.374 -10.343 0.247 1.00 0.00 ? 45 ARG A CD 7 ATOM 2853 N NE . ARG A 1 45 ? 5.879 -11.396 1.154 1.00 0.00 ? 45 ARG A NE 7 ATOM 2854 C CZ . ARG A 1 45 ? 6.966 -12.154 0.906 1.00 0.00 ? 45 ARG A CZ 7 ATOM 2855 N NH1 . ARG A 1 45 ? 6.837 -13.227 0.147 1.00 0.00 ? 45 ARG A NH1 7 ATOM 2856 N NH2 . ARG A 1 45 ? 8.168 -11.821 1.423 1.00 0.00 ? 45 ARG A NH2 7 ATOM 2857 N N . ASP A 1 46 ? 7.621 -7.272 3.787 1.00 0.00 ? 46 ASP A N 7 ATOM 2858 C CA . ASP A 1 46 ? 8.490 -7.398 4.942 1.00 0.00 ? 46 ASP A CA 7 ATOM 2859 C C . ASP A 1 46 ? 9.312 -8.681 4.819 1.00 0.00 ? 46 ASP A C 7 ATOM 2860 O O . ASP A 1 46 ? 9.688 -9.081 3.716 1.00 0.00 ? 46 ASP A O 7 ATOM 2861 C CB . ASP A 1 46 ? 7.679 -7.479 6.237 1.00 0.00 ? 46 ASP A CB 7 ATOM 2862 C CG . ASP A 1 46 ? 8.388 -6.939 7.480 1.00 0.00 ? 46 ASP A CG 7 ATOM 2863 O OD1 . ASP A 1 46 ? 9.580 -6.599 7.439 1.00 0.00 ? 46 ASP A OD1 7 ATOM 2864 O OD2 . ASP A 1 46 ? 7.655 -6.872 8.540 1.00 0.00 ? 46 ASP A OD2 7 ATOM 2865 N N . LEU A 1 47 ? 9.569 -9.296 5.964 1.00 0.00 ? 47 LEU A N 7 ATOM 2866 C CA . LEU A 1 47 ? 10.340 -10.526 5.999 1.00 0.00 ? 47 LEU A CA 7 ATOM 2867 C C . LEU A 1 47 ? 9.602 -11.561 6.852 1.00 0.00 ? 47 LEU A C 7 ATOM 2868 O O . LEU A 1 47 ? 10.225 -12.298 7.615 1.00 0.00 ? 47 LEU A O 7 ATOM 2869 C CB . LEU A 1 47 ? 11.771 -10.251 6.465 1.00 0.00 ? 47 LEU A CB 7 ATOM 2870 C CG . LEU A 1 47 ? 12.349 -8.886 6.084 1.00 0.00 ? 47 LEU A CG 7 ATOM 2871 C CD1 . LEU A 1 47 ? 12.350 -7.937 7.283 1.00 0.00 ? 47 LEU A CD1 7 ATOM 2872 C CD2 . LEU A 1 47 ? 13.743 -9.036 5.469 1.00 0.00 ? 47 LEU A CD2 7 ATOM 2873 N N . ARG A 1 48 ? 8.287 -11.584 6.694 1.00 0.00 ? 48 ARG A N 7 ATOM 2874 C CA . ARG A 1 48 ? 7.460 -12.514 7.440 1.00 0.00 ? 48 ARG A CA 7 ATOM 2875 C C . ARG A 1 48 ? 7.480 -12.168 8.931 1.00 0.00 ? 48 ARG A C 7 ATOM 2876 O O . ARG A 1 48 ? 7.773 -13.020 9.766 1.00 0.00 ? 48 ARG A O 7 ATOM 2877 C CB . ARG A 1 48 ? 7.942 -13.955 7.252 1.00 0.00 ? 48 ARG A CB 7 ATOM 2878 C CG . ARG A 1 48 ? 6.761 -14.921 7.145 1.00 0.00 ? 48 ARG A CG 7 ATOM 2879 C CD . ARG A 1 48 ? 6.476 -15.279 5.687 1.00 0.00 ? 48 ARG A CD 7 ATOM 2880 N NE . ARG A 1 48 ? 5.224 -16.063 5.592 1.00 0.00 ? 48 ARG A NE 7 ATOM 2881 C CZ . ARG A 1 48 ? 4.074 -15.592 5.067 1.00 0.00 ? 48 ARG A CZ 7 ATOM 2882 N NH1 . ARG A 1 48 ? 3.191 -14.922 5.838 1.00 0.00 ? 48 ARG A NH1 7 ATOM 2883 N NH2 . ARG A 1 48 ? 3.824 -15.798 3.787 1.00 0.00 ? 48 ARG A NH2 7 ATOM 2884 N N . TRP A 1 49 ? 7.165 -10.912 9.218 1.00 0.00 ? 49 TRP A N 7 ATOM 2885 C CA . TRP A 1 49 ? 7.145 -10.442 10.592 1.00 0.00 ? 49 TRP A CA 7 ATOM 2886 C C . TRP A 1 49 ? 5.959 -11.103 11.299 1.00 0.00 ? 49 TRP A C 7 ATOM 2887 O O . TRP A 1 49 ? 5.829 -11.007 12.519 1.00 0.00 ? 49 TRP A O 7 ATOM 2888 C CB . TRP A 1 49 ? 7.098 -8.914 10.648 1.00 0.00 ? 49 TRP A CB 7 ATOM 2889 C CG . TRP A 1 49 ? 6.662 -8.354 12.002 1.00 0.00 ? 49 TRP A CG 7 ATOM 2890 C CD1 . TRP A 1 49 ? 5.464 -8.461 12.592 1.00 0.00 ? 49 TRP A CD1 7 ATOM 2891 C CD2 . TRP A 1 49 ? 7.473 -7.588 12.919 1.00 0.00 ? 49 TRP A CD2 7 ATOM 2892 N NE1 . TRP A 1 49 ? 5.444 -7.825 13.817 1.00 0.00 ? 49 TRP A NE1 7 ATOM 2893 C CE2 . TRP A 1 49 ? 6.704 -7.277 14.022 1.00 0.00 ? 49 TRP A CE2 7 ATOM 2894 C CE3 . TRP A 1 49 ? 8.813 -7.173 12.819 1.00 0.00 ? 49 TRP A CE3 7 ATOM 2895 C CZ2 . TRP A 1 49 ? 7.188 -6.537 15.108 1.00 0.00 ? 49 TRP A CZ2 7 ATOM 2896 C CZ3 . TRP A 1 49 ? 9.279 -6.434 13.912 1.00 0.00 ? 49 TRP A CZ3 7 ATOM 2897 C CH2 . TRP A 1 49 ? 8.519 -6.112 15.029 1.00 0.00 ? 49 TRP A CH2 7 ATOM 2898 N N . TRP A 1 50 ? 5.127 -11.756 10.504 1.00 0.00 ? 50 TRP A N 7 ATOM 2899 C CA . TRP A 1 50 ? 3.956 -12.434 11.039 1.00 0.00 ? 50 TRP A CA 7 ATOM 2900 C C . TRP A 1 50 ? 4.413 -13.762 11.642 1.00 0.00 ? 50 TRP A C 7 ATOM 2901 O O . TRP A 1 50 ? 3.914 -14.180 12.686 1.00 0.00 ? 50 TRP A O 7 ATOM 2902 C CB . TRP A 1 50 ? 2.881 -12.601 9.964 1.00 0.00 ? 50 TRP A CB 7 ATOM 2903 C CG . TRP A 1 50 ? 3.043 -11.660 8.769 1.00 0.00 ? 50 TRP A CG 7 ATOM 2904 C CD1 . TRP A 1 50 ? 3.830 -11.818 7.696 1.00 0.00 ? 50 TRP A CD1 7 ATOM 2905 C CD2 . TRP A 1 50 ? 2.367 -10.402 8.566 1.00 0.00 ? 50 TRP A CD2 7 ATOM 2906 N NE1 . TRP A 1 50 ? 3.711 -10.759 6.821 1.00 0.00 ? 50 TRP A NE1 7 ATOM 2907 C CE2 . TRP A 1 50 ? 2.793 -9.870 7.367 1.00 0.00 ? 50 TRP A CE2 7 ATOM 2908 C CE3 . TRP A 1 50 ? 1.426 -9.735 9.371 1.00 0.00 ? 50 TRP A CE3 7 ATOM 2909 C CZ2 . TRP A 1 50 ? 2.332 -8.647 6.865 1.00 0.00 ? 50 TRP A CZ2 7 ATOM 2910 C CZ3 . TRP A 1 50 ? 0.976 -8.514 8.855 1.00 0.00 ? 50 TRP A CZ3 7 ATOM 2911 C CH2 . TRP A 1 50 ? 1.395 -7.964 7.648 1.00 0.00 ? 50 TRP A CH2 7 ATOM 2912 N N . GLU A 1 51 ? 5.359 -14.391 10.959 1.00 0.00 ? 51 GLU A N 7 ATOM 2913 C CA . GLU A 1 51 ? 5.888 -15.666 11.413 1.00 0.00 ? 51 GLU A CA 7 ATOM 2914 C C . GLU A 1 51 ? 7.165 -15.450 12.230 1.00 0.00 ? 51 GLU A C 7 ATOM 2915 O O . GLU A 1 51 ? 7.982 -14.593 11.895 1.00 0.00 ? 51 GLU A O 7 ATOM 2916 C CB . GLU A 1 51 ? 6.146 -16.606 10.234 1.00 0.00 ? 51 GLU A CB 7 ATOM 2917 C CG . GLU A 1 51 ? 4.920 -16.684 9.320 1.00 0.00 ? 51 GLU A CG 7 ATOM 2918 C CD . GLU A 1 51 ? 4.989 -17.920 8.419 1.00 0.00 ? 51 GLU A CD 7 ATOM 2919 O OE1 . GLU A 1 51 ? 5.555 -17.855 7.318 1.00 0.00 ? 51 GLU A OE1 7 ATOM 2920 O OE2 . GLU A 1 51 ? 4.424 -18.976 8.900 1.00 0.00 ? 51 GLU A OE2 7 ATOM 2921 N N . LEU A 1 52 ? 7.296 -16.240 13.285 1.00 0.00 ? 52 LEU A N 7 ATOM 2922 C CA . LEU A 1 52 ? 8.458 -16.146 14.151 1.00 0.00 ? 52 LEU A CA 7 ATOM 2923 C C . LEU A 1 52 ? 9.493 -17.188 13.723 1.00 0.00 ? 52 LEU A C 7 ATOM 2924 O O . LEU A 1 52 ? 10.663 -16.861 13.524 1.00 0.00 ? 52 LEU A O 7 ATOM 2925 C CB . LEU A 1 52 ? 8.043 -16.258 15.619 1.00 0.00 ? 52 LEU A CB 7 ATOM 2926 C CG . LEU A 1 52 ? 8.867 -15.438 16.615 1.00 0.00 ? 52 LEU A CG 7 ATOM 2927 C CD1 . LEU A 1 52 ? 10.353 -15.790 16.517 1.00 0.00 ? 52 LEU A CD1 7 ATOM 2928 C CD2 . LEU A 1 52 ? 8.618 -13.940 16.428 1.00 0.00 ? 52 LEU A CD2 7 ATOM 2929 N N . ARG A 1 53 ? 9.026 -18.420 13.594 1.00 0.00 ? 53 ARG A N 7 ATOM 2930 C CA . ARG A 1 53 ? 9.897 -19.513 13.194 1.00 0.00 ? 53 ARG A CA 7 ATOM 2931 C C . ARG A 1 53 ? 10.416 -19.284 11.772 1.00 0.00 ? 53 ARG A C 7 ATOM 2932 O O . ARG A 1 53 ? 11.623 -19.298 11.538 1.00 0.00 ? 53 ARG A O 7 ATOM 2933 C CB . ARG A 1 53 ? 9.163 -20.853 13.251 1.00 0.00 ? 53 ARG A CB 7 ATOM 2934 C CG . ARG A 1 53 ? 8.065 -20.923 12.188 1.00 0.00 ? 53 ARG A CG 7 ATOM 2935 C CD . ARG A 1 53 ? 8.383 -21.993 11.142 1.00 0.00 ? 53 ARG A CD 7 ATOM 2936 N NE . ARG A 1 53 ? 7.331 -22.012 10.100 1.00 0.00 ? 53 ARG A NE 7 ATOM 2937 C CZ . ARG A 1 53 ? 6.285 -22.865 10.095 1.00 0.00 ? 53 ARG A CZ 7 ATOM 2938 N NH1 . ARG A 1 53 ? 6.406 -24.096 9.556 1.00 0.00 ? 53 ARG A NH1 7 ATOM 2939 N NH2 . ARG A 1 53 ? 5.141 -22.477 10.630 1.00 0.00 ? 53 ARG A NH2 7 ATOM 2940 O OXT . ARG A 1 53 ? 9.502 -19.084 10.885 1.00 0.00 ? 53 ARG A OXT 7 ATOM 2941 N N . ASN A 1 1 ? -1.394 15.027 1.726 1.00 0.00 ? 1 ASN A N 8 ATOM 2942 C CA . ASN A 1 1 ? -2.540 14.521 2.462 1.00 0.00 ? 1 ASN A CA 8 ATOM 2943 C C . ASN A 1 1 ? -2.967 13.176 1.871 1.00 0.00 ? 1 ASN A C 8 ATOM 2944 O O . ASN A 1 1 ? -2.588 12.838 0.751 1.00 0.00 ? 1 ASN A O 8 ATOM 2945 C CB . ASN A 1 1 ? -3.728 15.480 2.360 1.00 0.00 ? 1 ASN A CB 8 ATOM 2946 C CG . ASN A 1 1 ? -3.544 16.680 3.295 1.00 0.00 ? 1 ASN A CG 8 ATOM 2947 O OD1 . ASN A 1 1 ? -3.757 16.604 4.492 1.00 0.00 ? 1 ASN A OD1 8 ATOM 2948 N ND2 . ASN A 1 1 ? -3.139 17.786 2.678 1.00 0.00 ? 1 ASN A ND2 8 ATOM 2949 N N . SER A 1 2 ? -3.751 12.444 2.650 1.00 0.00 ? 2 SER A N 8 ATOM 2950 C CA . SER A 1 2 ? -4.232 11.144 2.219 1.00 0.00 ? 2 SER A CA 8 ATOM 2951 C C . SER A 1 2 ? -5.754 11.181 2.045 1.00 0.00 ? 2 SER A C 8 ATOM 2952 O O . SER A 1 2 ? -6.476 11.575 2.961 1.00 0.00 ? 2 SER A O 8 ATOM 2953 C CB . SER A 1 2 ? -3.838 10.051 3.212 1.00 0.00 ? 2 SER A CB 8 ATOM 2954 O OG . SER A 1 2 ? -2.487 9.633 3.038 1.00 0.00 ? 2 SER A OG 8 ATOM 2955 N N . TYR A 1 3 ? -6.193 10.765 0.867 1.00 0.00 ? 3 TYR A N 8 ATOM 2956 C CA . TYR A 1 3 ? -7.615 10.746 0.563 1.00 0.00 ? 3 TYR A CA 8 ATOM 2957 C C . TYR A 1 3 ? -8.020 9.416 -0.076 1.00 0.00 ? 3 TYR A C 8 ATOM 2958 O O . TYR A 1 3 ? -7.289 8.871 -0.901 1.00 0.00 ? 3 TYR A O 8 ATOM 2959 C CB . TYR A 1 3 ? -7.844 11.874 -0.443 1.00 0.00 ? 3 TYR A CB 8 ATOM 2960 C CG . TYR A 1 3 ? -9.235 11.861 -1.083 1.00 0.00 ? 3 TYR A CG 8 ATOM 2961 C CD1 . TYR A 1 3 ? -10.281 12.525 -0.473 1.00 0.00 ? 3 TYR A CD1 8 ATOM 2962 C CD2 . TYR A 1 3 ? -9.445 11.188 -2.269 1.00 0.00 ? 3 TYR A CD2 8 ATOM 2963 C CE1 . TYR A 1 3 ? -11.590 12.514 -1.075 1.00 0.00 ? 3 TYR A CE1 8 ATOM 2964 C CE2 . TYR A 1 3 ? -10.752 11.176 -2.870 1.00 0.00 ? 3 TYR A CE2 8 ATOM 2965 C CZ . TYR A 1 3 ? -11.761 11.840 -2.244 1.00 0.00 ? 3 TYR A CZ 8 ATOM 2966 O OH . TYR A 1 3 ? -12.996 11.829 -2.811 1.00 0.00 ? 3 TYR A OH 8 ATOM 2967 N N . PRO A 1 4 ? -9.216 8.920 0.341 1.00 0.00 ? 4 PRO A N 8 ATOM 2968 C CA . PRO A 1 4 ? -9.728 7.665 -0.182 1.00 0.00 ? 4 PRO A CA 8 ATOM 2969 C C . PRO A 1 4 ? -10.256 7.839 -1.607 1.00 0.00 ? 4 PRO A C 8 ATOM 2970 O O . PRO A 1 4 ? -11.199 8.597 -1.834 1.00 0.00 ? 4 PRO A O 8 ATOM 2971 C CB . PRO A 1 4 ? -10.803 7.238 0.803 1.00 0.00 ? 4 PRO A CB 8 ATOM 2972 C CG . PRO A 1 4 ? -11.177 8.489 1.582 1.00 0.00 ? 4 PRO A CG 8 ATOM 2973 C CD . PRO A 1 4 ? -10.108 9.538 1.316 1.00 0.00 ? 4 PRO A CD 8 ATOM 2974 N N . GLY A 1 5 ? -9.628 7.125 -2.529 1.00 0.00 ? 5 GLY A N 8 ATOM 2975 C CA . GLY A 1 5 ? -10.023 7.193 -3.926 1.00 0.00 ? 5 GLY A CA 8 ATOM 2976 C C . GLY A 1 5 ? -9.220 6.202 -4.771 1.00 0.00 ? 5 GLY A C 8 ATOM 2977 O O . GLY A 1 5 ? -8.079 5.883 -4.441 1.00 0.00 ? 5 GLY A O 8 ATOM 2978 N N . CYS A 1 6 ? -9.849 5.743 -5.845 1.00 0.00 ? 6 CYS A N 8 ATOM 2979 C CA . CYS A 1 6 ? -9.205 4.796 -6.739 1.00 0.00 ? 6 CYS A CA 8 ATOM 2980 C C . CYS A 1 6 ? -10.101 4.611 -7.966 1.00 0.00 ? 6 CYS A C 8 ATOM 2981 O O . CYS A 1 6 ? -11.084 3.874 -7.915 1.00 0.00 ? 6 CYS A O 8 ATOM 2982 C CB . CYS A 1 6 ? -8.913 3.466 -6.040 1.00 0.00 ? 6 CYS A CB 8 ATOM 2983 S SG . CYS A 1 6 ? -10.069 3.038 -4.690 1.00 0.00 ? 6 CYS A SG 8 ATOM 2984 N N . PRO A 1 7 ? -9.719 5.311 -9.069 1.00 0.00 ? 7 PRO A N 8 ATOM 2985 C CA . PRO A 1 7 ? -10.476 5.230 -10.306 1.00 0.00 ? 7 PRO A CA 8 ATOM 2986 C C . PRO A 1 7 ? -10.222 3.901 -11.019 1.00 0.00 ? 7 PRO A C 8 ATOM 2987 O O . PRO A 1 7 ? -9.470 3.062 -10.525 1.00 0.00 ? 7 PRO A O 8 ATOM 2988 C CB . PRO A 1 7 ? -10.031 6.434 -11.119 1.00 0.00 ? 7 PRO A CB 8 ATOM 2989 C CG . PRO A 1 7 ? -8.712 6.882 -10.510 1.00 0.00 ? 7 PRO A CG 8 ATOM 2990 C CD . PRO A 1 7 ? -8.559 6.193 -9.165 1.00 0.00 ? 7 PRO A CD 8 ATOM 2991 N N . SER A 1 8 ? -10.864 3.750 -12.167 1.00 0.00 ? 8 SER A N 8 ATOM 2992 C CA . SER A 1 8 ? -10.718 2.537 -12.954 1.00 0.00 ? 8 SER A CA 8 ATOM 2993 C C . SER A 1 8 ? -9.496 2.651 -13.869 1.00 0.00 ? 8 SER A C 8 ATOM 2994 O O . SER A 1 8 ? -9.326 1.848 -14.784 1.00 0.00 ? 8 SER A O 8 ATOM 2995 C CB . SER A 1 8 ? -11.975 2.260 -13.780 1.00 0.00 ? 8 SER A CB 8 ATOM 2996 O OG . SER A 1 8 ? -12.215 3.280 -14.746 1.00 0.00 ? 8 SER A OG 8 ATOM 2997 N N . SER A 1 9 ? -8.679 3.655 -13.589 1.00 0.00 ? 9 SER A N 8 ATOM 2998 C CA . SER A 1 9 ? -7.478 3.886 -14.376 1.00 0.00 ? 9 SER A CA 8 ATOM 2999 C C . SER A 1 9 ? -6.477 2.754 -14.142 1.00 0.00 ? 9 SER A C 8 ATOM 3000 O O . SER A 1 9 ? -5.932 2.196 -15.094 1.00 0.00 ? 9 SER A O 8 ATOM 3001 C CB . SER A 1 9 ? -6.845 5.236 -14.032 1.00 0.00 ? 9 SER A CB 8 ATOM 3002 O OG . SER A 1 9 ? -7.744 6.318 -14.253 1.00 0.00 ? 9 SER A OG 8 ATOM 3003 N N . TYR A 1 10 ? -6.262 2.448 -12.872 1.00 0.00 ? 10 TYR A N 8 ATOM 3004 C CA . TYR A 1 10 ? -5.335 1.392 -12.501 1.00 0.00 ? 10 TYR A CA 8 ATOM 3005 C C . TYR A 1 10 ? -6.076 0.086 -12.209 1.00 0.00 ? 10 TYR A C 8 ATOM 3006 O O . TYR A 1 10 ? -5.822 -0.933 -12.847 1.00 0.00 ? 10 TYR A O 8 ATOM 3007 C CB . TYR A 1 10 ? -4.642 1.868 -11.223 1.00 0.00 ? 10 TYR A CB 8 ATOM 3008 C CG . TYR A 1 10 ? -4.227 3.340 -11.252 1.00 0.00 ? 10 TYR A CG 8 ATOM 3009 C CD1 . TYR A 1 10 ? -3.103 3.728 -11.954 1.00 0.00 ? 10 TYR A CD1 8 ATOM 3010 C CD2 . TYR A 1 10 ? -4.976 4.282 -10.576 1.00 0.00 ? 10 TYR A CD2 8 ATOM 3011 C CE1 . TYR A 1 10 ? -2.713 5.114 -11.981 1.00 0.00 ? 10 TYR A CE1 8 ATOM 3012 C CE2 . TYR A 1 10 ? -4.584 5.667 -10.603 1.00 0.00 ? 10 TYR A CE2 8 ATOM 3013 C CZ . TYR A 1 10 ? -3.473 6.014 -11.304 1.00 0.00 ? 10 TYR A CZ 8 ATOM 3014 O OH . TYR A 1 10 ? -3.104 7.323 -11.330 1.00 0.00 ? 10 TYR A OH 8 ATOM 3015 N N . ASP A 1 11 ? -6.981 0.160 -11.243 1.00 0.00 ? 11 ASP A N 8 ATOM 3016 C CA . ASP A 1 11 ? -7.762 -1.001 -10.858 1.00 0.00 ? 11 ASP A CA 8 ATOM 3017 C C . ASP A 1 11 ? -6.820 -2.116 -10.399 1.00 0.00 ? 11 ASP A C 8 ATOM 3018 O O . ASP A 1 11 ? -6.551 -3.054 -11.148 1.00 0.00 ? 11 ASP A O 8 ATOM 3019 C CB . ASP A 1 11 ? -8.581 -1.530 -12.038 1.00 0.00 ? 11 ASP A CB 8 ATOM 3020 C CG . ASP A 1 11 ? -9.862 -0.751 -12.337 1.00 0.00 ? 11 ASP A CG 8 ATOM 3021 O OD1 . ASP A 1 11 ? -10.803 -0.891 -11.465 1.00 0.00 ? 11 ASP A OD1 8 ATOM 3022 O OD2 . ASP A 1 11 ? -9.959 -0.045 -13.351 1.00 0.00 ? 11 ASP A OD2 8 ATOM 3023 N N . GLY A 1 12 ? -6.342 -1.975 -9.171 1.00 0.00 ? 12 GLY A N 8 ATOM 3024 C CA . GLY A 1 12 ? -5.435 -2.958 -8.604 1.00 0.00 ? 12 GLY A CA 8 ATOM 3025 C C . GLY A 1 12 ? -4.137 -2.299 -8.135 1.00 0.00 ? 12 GLY A C 8 ATOM 3026 O O . GLY A 1 12 ? -3.051 -2.846 -8.328 1.00 0.00 ? 12 GLY A O 8 ATOM 3027 N N . TYR A 1 13 ? -4.289 -1.131 -7.527 1.00 0.00 ? 13 TYR A N 8 ATOM 3028 C CA . TYR A 1 13 ? -3.142 -0.390 -7.028 1.00 0.00 ? 13 TYR A CA 8 ATOM 3029 C C . TYR A 1 13 ? -2.788 -0.822 -5.603 1.00 0.00 ? 13 TYR A C 8 ATOM 3030 O O . TYR A 1 13 ? -2.116 -0.090 -4.879 1.00 0.00 ? 13 TYR A O 8 ATOM 3031 C CB . TYR A 1 13 ? -3.563 1.080 -7.015 1.00 0.00 ? 13 TYR A CB 8 ATOM 3032 C CG . TYR A 1 13 ? -2.432 2.054 -7.355 1.00 0.00 ? 13 TYR A CG 8 ATOM 3033 C CD1 . TYR A 1 13 ? -2.190 2.397 -8.669 1.00 0.00 ? 13 TYR A CD1 8 ATOM 3034 C CD2 . TYR A 1 13 ? -1.656 2.588 -6.347 1.00 0.00 ? 13 TYR A CD2 8 ATOM 3035 C CE1 . TYR A 1 13 ? -1.126 3.314 -8.990 1.00 0.00 ? 13 TYR A CE1 8 ATOM 3036 C CE2 . TYR A 1 13 ? -0.592 3.505 -6.667 1.00 0.00 ? 13 TYR A CE2 8 ATOM 3037 C CZ . TYR A 1 13 ? -0.380 3.823 -7.973 1.00 0.00 ? 13 TYR A CZ 8 ATOM 3038 O OH . TYR A 1 13 ? 0.624 4.688 -8.276 1.00 0.00 ? 13 TYR A OH 8 ATOM 3039 N N . CYS A 1 14 ? -3.257 -2.008 -5.244 1.00 0.00 ? 14 CYS A N 8 ATOM 3040 C CA . CYS A 1 14 ? -3.000 -2.544 -3.919 1.00 0.00 ? 14 CYS A CA 8 ATOM 3041 C C . CYS A 1 14 ? -2.720 -4.044 -4.054 1.00 0.00 ? 14 CYS A C 8 ATOM 3042 O O . CYS A 1 14 ? -3.442 -4.752 -4.756 1.00 0.00 ? 14 CYS A O 8 ATOM 3043 C CB . CYS A 1 14 ? -4.158 -2.264 -2.961 1.00 0.00 ? 14 CYS A CB 8 ATOM 3044 S SG . CYS A 1 14 ? -5.261 -0.896 -3.468 1.00 0.00 ? 14 CYS A SG 8 ATOM 3045 N N . LEU A 1 15 ? -1.673 -4.483 -3.370 1.00 0.00 ? 15 LEU A N 8 ATOM 3046 C CA . LEU A 1 15 ? -1.291 -5.883 -3.405 1.00 0.00 ? 15 LEU A CA 8 ATOM 3047 C C . LEU A 1 15 ? -0.794 -6.306 -2.022 1.00 0.00 ? 15 LEU A C 8 ATOM 3048 O O . LEU A 1 15 ? -0.665 -5.475 -1.124 1.00 0.00 ? 15 LEU A O 8 ATOM 3049 C CB . LEU A 1 15 ? -0.280 -6.136 -4.525 1.00 0.00 ? 15 LEU A CB 8 ATOM 3050 C CG . LEU A 1 15 ? -0.524 -5.377 -5.832 1.00 0.00 ? 15 LEU A CG 8 ATOM 3051 C CD1 . LEU A 1 15 ? 0.781 -5.195 -6.611 1.00 0.00 ? 15 LEU A CD1 8 ATOM 3052 C CD2 . LEU A 1 15 ? -1.602 -6.062 -6.671 1.00 0.00 ? 15 LEU A CD2 8 ATOM 3053 N N . ASN A 1 16 ? -0.529 -7.598 -1.892 1.00 0.00 ? 16 ASN A N 8 ATOM 3054 C CA . ASN A 1 16 ? -0.049 -8.142 -0.632 1.00 0.00 ? 16 ASN A CA 8 ATOM 3055 C C . ASN A 1 16 ? -0.822 -7.499 0.523 1.00 0.00 ? 16 ASN A C 8 ATOM 3056 O O . ASN A 1 16 ? -0.223 -6.949 1.445 1.00 0.00 ? 16 ASN A O 8 ATOM 3057 C CB . ASN A 1 16 ? 1.437 -7.839 -0.432 1.00 0.00 ? 16 ASN A CB 8 ATOM 3058 C CG . ASN A 1 16 ? 2.197 -7.926 -1.757 1.00 0.00 ? 16 ASN A CG 8 ATOM 3059 O OD1 . ASN A 1 16 ? 1.948 -8.782 -2.591 1.00 0.00 ? 16 ASN A OD1 8 ATOM 3060 N ND2 . ASN A 1 16 ? 3.137 -6.996 -1.903 1.00 0.00 ? 16 ASN A ND2 8 ATOM 3061 N N . GLY A 1 17 ? -2.141 -7.591 0.433 1.00 0.00 ? 17 GLY A N 8 ATOM 3062 C CA . GLY A 1 17 ? -3.001 -7.028 1.459 1.00 0.00 ? 17 GLY A CA 8 ATOM 3063 C C . GLY A 1 17 ? -2.833 -5.509 1.540 1.00 0.00 ? 17 GLY A C 8 ATOM 3064 O O . GLY A 1 17 ? -2.168 -5.002 2.441 1.00 0.00 ? 17 GLY A O 8 ATOM 3065 N N . GLY A 1 18 ? -3.450 -4.826 0.587 1.00 0.00 ? 18 GLY A N 8 ATOM 3066 C CA . GLY A 1 18 ? -3.378 -3.376 0.539 1.00 0.00 ? 18 GLY A CA 8 ATOM 3067 C C . GLY A 1 18 ? -4.735 -2.770 0.177 1.00 0.00 ? 18 GLY A C 8 ATOM 3068 O O . GLY A 1 18 ? -5.384 -3.216 -0.769 1.00 0.00 ? 18 GLY A O 8 ATOM 3069 N N . VAL A 1 19 ? -5.123 -1.763 0.944 1.00 0.00 ? 19 VAL A N 8 ATOM 3070 C CA . VAL A 1 19 ? -6.391 -1.093 0.714 1.00 0.00 ? 19 VAL A CA 8 ATOM 3071 C C . VAL A 1 19 ? -6.181 0.067 -0.262 1.00 0.00 ? 19 VAL A C 8 ATOM 3072 O O . VAL A 1 19 ? -5.046 0.421 -0.575 1.00 0.00 ? 19 VAL A O 8 ATOM 3073 C CB . VAL A 1 19 ? -6.996 -0.648 2.048 1.00 0.00 ? 19 VAL A CB 8 ATOM 3074 C CG1 . VAL A 1 19 ? -6.743 0.840 2.298 1.00 0.00 ? 19 VAL A CG1 8 ATOM 3075 C CG2 . VAL A 1 19 ? -8.492 -0.965 2.105 1.00 0.00 ? 19 VAL A CG2 8 ATOM 3076 N N . CYS A 1 20 ? -7.293 0.626 -0.716 1.00 0.00 ? 20 CYS A N 8 ATOM 3077 C CA . CYS A 1 20 ? -7.244 1.737 -1.651 1.00 0.00 ? 20 CYS A CA 8 ATOM 3078 C C . CYS A 1 20 ? -6.982 3.019 -0.858 1.00 0.00 ? 20 CYS A C 8 ATOM 3079 O O . CYS A 1 20 ? -7.552 3.218 0.215 1.00 0.00 ? 20 CYS A O 8 ATOM 3080 C CB . CYS A 1 20 ? -8.525 1.832 -2.483 1.00 0.00 ? 20 CYS A CB 8 ATOM 3081 S SG . CYS A 1 20 ? -8.839 3.474 -3.223 1.00 0.00 ? 20 CYS A SG 8 ATOM 3082 N N . MET A 1 21 ? -6.121 3.855 -1.417 1.00 0.00 ? 21 MET A N 8 ATOM 3083 C CA . MET A 1 21 ? -5.775 5.114 -0.777 1.00 0.00 ? 21 MET A CA 8 ATOM 3084 C C . MET A 1 21 ? -5.163 6.091 -1.782 1.00 0.00 ? 21 MET A C 8 ATOM 3085 O O . MET A 1 21 ? -4.075 5.852 -2.301 1.00 0.00 ? 21 MET A O 8 ATOM 3086 C CB . MET A 1 21 ? -4.779 4.854 0.355 1.00 0.00 ? 21 MET A CB 8 ATOM 3087 C CG . MET A 1 21 ? -5.407 5.150 1.718 1.00 0.00 ? 21 MET A CG 8 ATOM 3088 S SD . MET A 1 21 ? -6.061 6.811 1.740 1.00 0.00 ? 21 MET A SD 8 ATOM 3089 C CE . MET A 1 21 ? -4.626 7.716 1.183 1.00 0.00 ? 21 MET A CE 8 ATOM 3090 N N . HIS A 1 22 ? -5.890 7.172 -2.024 1.00 0.00 ? 22 HIS A N 8 ATOM 3091 C CA . HIS A 1 22 ? -5.432 8.187 -2.958 1.00 0.00 ? 22 HIS A CA 8 ATOM 3092 C C . HIS A 1 22 ? -4.653 9.266 -2.203 1.00 0.00 ? 22 HIS A C 8 ATOM 3093 O O . HIS A 1 22 ? -5.103 9.750 -1.166 1.00 0.00 ? 22 HIS A O 8 ATOM 3094 C CB . HIS A 1 22 ? -6.604 8.755 -3.762 1.00 0.00 ? 22 HIS A CB 8 ATOM 3095 C CG . HIS A 1 22 ? -6.208 9.820 -4.756 1.00 0.00 ? 22 HIS A CG 8 ATOM 3096 N ND1 . HIS A 1 22 ? -6.778 11.081 -4.770 1.00 0.00 ? 22 HIS A ND1 8 ATOM 3097 C CD2 . HIS A 1 22 ? -5.294 9.798 -5.768 1.00 0.00 ? 22 HIS A CD2 8 ATOM 3098 C CE1 . HIS A 1 22 ? -6.224 11.778 -5.753 1.00 0.00 ? 22 HIS A CE1 8 ATOM 3099 N NE2 . HIS A 1 22 ? -5.306 10.980 -6.370 1.00 0.00 ? 22 HIS A NE2 8 ATOM 3100 N N . ILE A 1 23 ? -3.497 9.608 -2.752 1.00 0.00 ? 23 ILE A N 8 ATOM 3101 C CA . ILE A 1 23 ? -2.651 10.622 -2.143 1.00 0.00 ? 23 ILE A CA 8 ATOM 3102 C C . ILE A 1 23 ? -3.138 12.008 -2.565 1.00 0.00 ? 23 ILE A C 8 ATOM 3103 O O . ILE A 1 23 ? -3.754 12.160 -3.619 1.00 0.00 ? 23 ILE A O 8 ATOM 3104 C CB . ILE A 1 23 ? -1.180 10.358 -2.472 1.00 0.00 ? 23 ILE A CB 8 ATOM 3105 C CG1 . ILE A 1 23 ? -0.978 8.931 -2.983 1.00 0.00 ? 23 ILE A CG1 8 ATOM 3106 C CG2 . ILE A 1 23 ? -0.285 10.668 -1.270 1.00 0.00 ? 23 ILE A CG2 8 ATOM 3107 C CD1 . ILE A 1 23 ? 0.478 8.494 -2.831 1.00 0.00 ? 23 ILE A CD1 8 ATOM 3108 N N . GLU A 1 24 ? -2.841 12.986 -1.723 1.00 0.00 ? 24 GLU A N 8 ATOM 3109 C CA . GLU A 1 24 ? -3.240 14.356 -1.996 1.00 0.00 ? 24 GLU A CA 8 ATOM 3110 C C . GLU A 1 24 ? -2.012 15.269 -2.047 1.00 0.00 ? 24 GLU A C 8 ATOM 3111 O O . GLU A 1 24 ? -2.119 16.440 -2.404 1.00 0.00 ? 24 GLU A O 8 ATOM 3112 C CB . GLU A 1 24 ? -4.249 14.853 -0.956 1.00 0.00 ? 24 GLU A CB 8 ATOM 3113 C CG . GLU A 1 24 ? -5.684 14.573 -1.407 1.00 0.00 ? 24 GLU A CG 8 ATOM 3114 C CD . GLU A 1 24 ? -6.682 15.409 -0.606 1.00 0.00 ? 24 GLU A CD 8 ATOM 3115 O OE1 . GLU A 1 24 ? -6.981 15.080 0.552 1.00 0.00 ? 24 GLU A OE1 8 ATOM 3116 O OE2 . GLU A 1 24 ? -7.155 16.437 -1.226 1.00 0.00 ? 24 GLU A OE2 8 ATOM 3117 N N . SER A 1 25 ? -0.875 14.693 -1.685 1.00 0.00 ? 25 SER A N 8 ATOM 3118 C CA . SER A 1 25 ? 0.373 15.441 -1.684 1.00 0.00 ? 25 SER A CA 8 ATOM 3119 C C . SER A 1 25 ? 0.788 15.765 -3.121 1.00 0.00 ? 25 SER A C 8 ATOM 3120 O O . SER A 1 25 ? 1.291 16.854 -3.394 1.00 0.00 ? 25 SER A O 8 ATOM 3121 C CB . SER A 1 25 ? 1.480 14.660 -0.976 1.00 0.00 ? 25 SER A CB 8 ATOM 3122 O OG . SER A 1 25 ? 2.689 15.409 -0.886 1.00 0.00 ? 25 SER A OG 8 ATOM 3123 N N . LEU A 1 26 ? 0.562 14.802 -4.001 1.00 0.00 ? 26 LEU A N 8 ATOM 3124 C CA . LEU A 1 26 ? 0.908 14.971 -5.402 1.00 0.00 ? 26 LEU A CA 8 ATOM 3125 C C . LEU A 1 26 ? -0.293 14.586 -6.269 1.00 0.00 ? 26 LEU A C 8 ATOM 3126 O O . LEU A 1 26 ? -0.163 14.425 -7.480 1.00 0.00 ? 26 LEU A O 8 ATOM 3127 C CB . LEU A 1 26 ? 2.182 14.196 -5.740 1.00 0.00 ? 26 LEU A CB 8 ATOM 3128 C CG . LEU A 1 26 ? 3.479 15.008 -5.752 1.00 0.00 ? 26 LEU A CG 8 ATOM 3129 C CD1 . LEU A 1 26 ? 3.775 15.545 -7.154 1.00 0.00 ? 26 LEU A CD1 8 ATOM 3130 C CD2 . LEU A 1 26 ? 3.435 16.126 -4.708 1.00 0.00 ? 26 LEU A CD2 8 ATOM 3131 N N . ASP A 1 27 ? -1.436 14.448 -5.612 1.00 0.00 ? 27 ASP A N 8 ATOM 3132 C CA . ASP A 1 27 ? -2.660 14.086 -6.308 1.00 0.00 ? 27 ASP A CA 8 ATOM 3133 C C . ASP A 1 27 ? -2.485 12.709 -6.954 1.00 0.00 ? 27 ASP A C 8 ATOM 3134 O O . ASP A 1 27 ? -3.120 12.408 -7.963 1.00 0.00 ? 27 ASP A O 8 ATOM 3135 C CB . ASP A 1 27 ? -2.983 15.089 -7.416 1.00 0.00 ? 27 ASP A CB 8 ATOM 3136 C CG . ASP A 1 27 ? -4.378 15.709 -7.339 1.00 0.00 ? 27 ASP A CG 8 ATOM 3137 O OD1 . ASP A 1 27 ? -4.496 16.691 -6.509 1.00 0.00 ? 27 ASP A OD1 8 ATOM 3138 O OD2 . ASP A 1 27 ? -5.309 15.277 -8.037 1.00 0.00 ? 27 ASP A OD2 8 ATOM 3139 N N . SER A 1 28 ? -1.620 11.910 -6.345 1.00 0.00 ? 28 SER A N 8 ATOM 3140 C CA . SER A 1 28 ? -1.354 10.575 -6.847 1.00 0.00 ? 28 SER A CA 8 ATOM 3141 C C . SER A 1 28 ? -2.218 9.553 -6.105 1.00 0.00 ? 28 SER A C 8 ATOM 3142 O O . SER A 1 28 ? -2.863 9.886 -5.112 1.00 0.00 ? 28 SER A O 8 ATOM 3143 C CB . SER A 1 28 ? 0.127 10.217 -6.705 1.00 0.00 ? 28 SER A CB 8 ATOM 3144 O OG . SER A 1 28 ? 0.352 8.813 -6.811 1.00 0.00 ? 28 SER A OG 8 ATOM 3145 N N . TYR A 1 29 ? -2.205 8.330 -6.616 1.00 0.00 ? 29 TYR A N 8 ATOM 3146 C CA . TYR A 1 29 ? -2.980 7.260 -6.013 1.00 0.00 ? 29 TYR A CA 8 ATOM 3147 C C . TYR A 1 29 ? -2.065 6.213 -5.375 1.00 0.00 ? 29 TYR A C 8 ATOM 3148 O O . TYR A 1 29 ? -1.006 5.898 -5.913 1.00 0.00 ? 29 TYR A O 8 ATOM 3149 C CB . TYR A 1 29 ? -3.761 6.609 -7.158 1.00 0.00 ? 29 TYR A CB 8 ATOM 3150 C CG . TYR A 1 29 ? -4.709 7.562 -7.886 1.00 0.00 ? 29 TYR A CG 8 ATOM 3151 C CD1 . TYR A 1 29 ? -4.259 8.290 -8.969 1.00 0.00 ? 29 TYR A CD1 8 ATOM 3152 C CD2 . TYR A 1 29 ? -6.014 7.697 -7.460 1.00 0.00 ? 29 TYR A CD2 8 ATOM 3153 C CE1 . TYR A 1 29 ? -5.151 9.186 -9.656 1.00 0.00 ? 29 TYR A CE1 8 ATOM 3154 C CE2 . TYR A 1 29 ? -6.907 8.594 -8.146 1.00 0.00 ? 29 TYR A CE2 8 ATOM 3155 C CZ . TYR A 1 29 ? -6.432 9.295 -9.209 1.00 0.00 ? 29 TYR A CZ 8 ATOM 3156 O OH . TYR A 1 29 ? -7.274 10.143 -9.857 1.00 0.00 ? 29 TYR A OH 8 ATOM 3157 N N . THR A 1 30 ? -2.508 5.703 -4.236 1.00 0.00 ? 30 THR A N 8 ATOM 3158 C CA . THR A 1 30 ? -1.743 4.697 -3.517 1.00 0.00 ? 30 THR A CA 8 ATOM 3159 C C . THR A 1 30 ? -2.675 3.630 -2.938 1.00 0.00 ? 30 THR A C 8 ATOM 3160 O O . THR A 1 30 ? -3.824 3.511 -3.356 1.00 0.00 ? 30 THR A O 8 ATOM 3161 C CB . THR A 1 30 ? -0.902 5.411 -2.457 1.00 0.00 ? 30 THR A CB 8 ATOM 3162 O OG1 . THR A 1 30 ? 0.012 4.414 -2.011 1.00 0.00 ? 30 THR A OG1 8 ATOM 3163 C CG2 . THR A 1 30 ? -1.711 5.762 -1.208 1.00 0.00 ? 30 THR A CG2 8 ATOM 3164 N N . CYS A 1 31 ? -2.143 2.882 -1.985 1.00 0.00 ? 31 CYS A N 8 ATOM 3165 C CA . CYS A 1 31 ? -2.911 1.829 -1.342 1.00 0.00 ? 31 CYS A CA 8 ATOM 3166 C C . CYS A 1 31 ? -2.333 1.594 0.055 1.00 0.00 ? 31 CYS A C 8 ATOM 3167 O O . CYS A 1 31 ? -1.118 1.490 0.218 1.00 0.00 ? 31 CYS A O 8 ATOM 3168 C CB . CYS A 1 31 ? -2.922 0.547 -2.177 1.00 0.00 ? 31 CYS A CB 8 ATOM 3169 S SG . CYS A 1 31 ? -4.353 0.378 -3.307 1.00 0.00 ? 31 CYS A SG 8 ATOM 3170 N N . ASN A 1 32 ? -3.230 1.518 1.027 1.00 0.00 ? 32 ASN A N 8 ATOM 3171 C CA . ASN A 1 32 ? -2.825 1.297 2.403 1.00 0.00 ? 32 ASN A CA 8 ATOM 3172 C C . ASN A 1 32 ? -2.332 -0.143 2.561 1.00 0.00 ? 32 ASN A C 8 ATOM 3173 O O . ASN A 1 32 ? -3.123 -1.083 2.510 1.00 0.00 ? 32 ASN A O 8 ATOM 3174 C CB . ASN A 1 32 ? -3.999 1.502 3.364 1.00 0.00 ? 32 ASN A CB 8 ATOM 3175 C CG . ASN A 1 32 ? -3.504 1.863 4.765 1.00 0.00 ? 32 ASN A CG 8 ATOM 3176 O OD1 . ASN A 1 32 ? -2.431 1.472 5.193 1.00 0.00 ? 32 ASN A OD1 8 ATOM 3177 N ND2 . ASN A 1 32 ? -4.345 2.627 5.456 1.00 0.00 ? 32 ASN A ND2 8 ATOM 3178 N N . CYS A 1 33 ? -1.026 -0.270 2.751 1.00 0.00 ? 33 CYS A N 8 ATOM 3179 C CA . CYS A 1 33 ? -0.419 -1.578 2.917 1.00 0.00 ? 33 CYS A CA 8 ATOM 3180 C C . CYS A 1 33 ? -0.441 -1.934 4.405 1.00 0.00 ? 33 CYS A C 8 ATOM 3181 O O . CYS A 1 33 ? -1.293 -1.451 5.150 1.00 0.00 ? 33 CYS A O 8 ATOM 3182 C CB . CYS A 1 33 ? 0.999 -1.621 2.341 1.00 0.00 ? 33 CYS A CB 8 ATOM 3183 S SG . CYS A 1 33 ? 1.185 -0.833 0.701 1.00 0.00 ? 33 CYS A SG 8 ATOM 3184 N N . VAL A 1 34 ? 0.507 -2.774 4.795 1.00 0.00 ? 34 VAL A N 8 ATOM 3185 C CA . VAL A 1 34 ? 0.607 -3.198 6.181 1.00 0.00 ? 34 VAL A CA 8 ATOM 3186 C C . VAL A 1 34 ? 2.076 -3.433 6.533 1.00 0.00 ? 34 VAL A C 8 ATOM 3187 O O . VAL A 1 34 ? 2.960 -3.225 5.702 1.00 0.00 ? 34 VAL A O 8 ATOM 3188 C CB . VAL A 1 34 ? -0.268 -4.432 6.414 1.00 0.00 ? 34 VAL A CB 8 ATOM 3189 C CG1 . VAL A 1 34 ? -1.650 -4.251 5.782 1.00 0.00 ? 34 VAL A CG1 8 ATOM 3190 C CG2 . VAL A 1 34 ? 0.413 -5.696 5.888 1.00 0.00 ? 34 VAL A CG2 8 ATOM 3191 N N . ILE A 1 35 ? 2.295 -3.866 7.767 1.00 0.00 ? 35 ILE A N 8 ATOM 3192 C CA . ILE A 1 35 ? 3.643 -4.132 8.239 1.00 0.00 ? 35 ILE A CA 8 ATOM 3193 C C . ILE A 1 35 ? 4.402 -4.931 7.179 1.00 0.00 ? 35 ILE A C 8 ATOM 3194 O O . ILE A 1 35 ? 3.792 -5.579 6.329 1.00 0.00 ? 35 ILE A O 8 ATOM 3195 C CB . ILE A 1 35 ? 3.606 -4.810 9.611 1.00 0.00 ? 35 ILE A CB 8 ATOM 3196 C CG1 . ILE A 1 35 ? 2.585 -4.135 10.528 1.00 0.00 ? 35 ILE A CG1 8 ATOM 3197 C CG2 . ILE A 1 35 ? 5.000 -4.851 10.239 1.00 0.00 ? 35 ILE A CG2 8 ATOM 3198 C CD1 . ILE A 1 35 ? 3.054 -4.162 11.984 1.00 0.00 ? 35 ILE A CD1 8 ATOM 3199 N N . GLY A 1 36 ? 5.722 -4.859 7.261 1.00 0.00 ? 36 GLY A N 8 ATOM 3200 C CA . GLY A 1 36 ? 6.571 -5.568 6.318 1.00 0.00 ? 36 GLY A CA 8 ATOM 3201 C C . GLY A 1 36 ? 5.971 -5.543 4.913 1.00 0.00 ? 36 GLY A C 8 ATOM 3202 O O . GLY A 1 36 ? 6.123 -6.495 4.150 1.00 0.00 ? 36 GLY A O 8 ATOM 3203 N N . TYR A 1 37 ? 5.297 -4.441 4.611 1.00 0.00 ? 37 TYR A N 8 ATOM 3204 C CA . TYR A 1 37 ? 4.673 -4.278 3.309 1.00 0.00 ? 37 TYR A CA 8 ATOM 3205 C C . TYR A 1 37 ? 4.360 -2.807 3.032 1.00 0.00 ? 37 TYR A C 8 ATOM 3206 O O . TYR A 1 37 ? 3.394 -2.263 3.567 1.00 0.00 ? 37 TYR A O 8 ATOM 3207 C CB . TYR A 1 37 ? 3.362 -5.065 3.371 1.00 0.00 ? 37 TYR A CB 8 ATOM 3208 C CG . TYR A 1 37 ? 3.505 -6.544 3.005 1.00 0.00 ? 37 TYR A CG 8 ATOM 3209 C CD1 . TYR A 1 37 ? 3.756 -6.911 1.698 1.00 0.00 ? 37 TYR A CD1 8 ATOM 3210 C CD2 . TYR A 1 37 ? 3.384 -7.511 3.983 1.00 0.00 ? 37 TYR A CD2 8 ATOM 3211 C CE1 . TYR A 1 37 ? 3.892 -8.303 1.355 1.00 0.00 ? 37 TYR A CE1 8 ATOM 3212 C CE2 . TYR A 1 37 ? 3.518 -8.903 3.638 1.00 0.00 ? 37 TYR A CE2 8 ATOM 3213 C CZ . TYR A 1 37 ? 3.765 -9.230 2.342 1.00 0.00 ? 37 TYR A CZ 8 ATOM 3214 O OH . TYR A 1 37 ? 3.895 -10.544 2.018 1.00 0.00 ? 37 TYR A OH 8 ATOM 3215 N N . SER A 1 38 ? 5.191 -2.205 2.195 1.00 0.00 ? 38 SER A N 8 ATOM 3216 C CA . SER A 1 38 ? 5.015 -0.808 1.840 1.00 0.00 ? 38 SER A CA 8 ATOM 3217 C C . SER A 1 38 ? 5.767 -0.497 0.544 1.00 0.00 ? 38 SER A C 8 ATOM 3218 O O . SER A 1 38 ? 6.570 -1.306 0.080 1.00 0.00 ? 38 SER A O 8 ATOM 3219 C CB . SER A 1 38 ? 5.494 0.113 2.965 1.00 0.00 ? 38 SER A CB 8 ATOM 3220 O OG . SER A 1 38 ? 6.909 0.059 3.131 1.00 0.00 ? 38 SER A OG 8 ATOM 3221 N N . GLY A 1 39 ? 5.481 0.674 -0.004 1.00 0.00 ? 39 GLY A N 8 ATOM 3222 C CA . GLY A 1 39 ? 6.120 1.102 -1.236 1.00 0.00 ? 39 GLY A CA 8 ATOM 3223 C C . GLY A 1 39 ? 5.089 1.290 -2.351 1.00 0.00 ? 39 GLY A C 8 ATOM 3224 O O . GLY A 1 39 ? 5.335 0.914 -3.497 1.00 0.00 ? 39 GLY A O 8 ATOM 3225 N N . ASP A 1 40 ? 3.958 1.869 -1.977 1.00 0.00 ? 40 ASP A N 8 ATOM 3226 C CA . ASP A 1 40 ? 2.891 2.113 -2.932 1.00 0.00 ? 40 ASP A CA 8 ATOM 3227 C C . ASP A 1 40 ? 2.416 0.777 -3.510 1.00 0.00 ? 40 ASP A C 8 ATOM 3228 O O . ASP A 1 40 ? 3.184 0.073 -4.165 1.00 0.00 ? 40 ASP A O 8 ATOM 3229 C CB . ASP A 1 40 ? 3.375 2.986 -4.091 1.00 0.00 ? 40 ASP A CB 8 ATOM 3230 C CG . ASP A 1 40 ? 2.270 3.508 -5.012 1.00 0.00 ? 40 ASP A CG 8 ATOM 3231 O OD1 . ASP A 1 40 ? 1.695 4.591 -4.611 1.00 0.00 ? 40 ASP A OD1 8 ATOM 3232 O OD2 . ASP A 1 40 ? 1.976 2.912 -6.058 1.00 0.00 ? 40 ASP A OD2 8 ATOM 3233 N N . ARG A 1 41 ? 1.155 0.470 -3.250 1.00 0.00 ? 41 ARG A N 8 ATOM 3234 C CA . ARG A 1 41 ? 0.570 -0.768 -3.737 1.00 0.00 ? 41 ARG A CA 8 ATOM 3235 C C . ARG A 1 41 ? 1.107 -1.958 -2.939 1.00 0.00 ? 41 ARG A C 8 ATOM 3236 O O . ARG A 1 41 ? 0.760 -3.104 -3.220 1.00 0.00 ? 41 ARG A O 8 ATOM 3237 C CB . ARG A 1 41 ? 0.878 -0.975 -5.221 1.00 0.00 ? 41 ARG A CB 8 ATOM 3238 C CG . ARG A 1 41 ? 0.123 -2.186 -5.774 1.00 0.00 ? 41 ARG A CG 8 ATOM 3239 C CD . ARG A 1 41 ? 0.043 -2.131 -7.300 1.00 0.00 ? 41 ARG A CD 8 ATOM 3240 N NE . ARG A 1 41 ? 1.400 -2.244 -7.882 1.00 0.00 ? 41 ARG A NE 8 ATOM 3241 C CZ . ARG A 1 41 ? 2.011 -1.259 -8.573 1.00 0.00 ? 41 ARG A CZ 8 ATOM 3242 N NH1 . ARG A 1 41 ? 1.762 -1.132 -9.863 1.00 0.00 ? 41 ARG A NH1 8 ATOM 3243 N NH2 . ARG A 1 41 ? 2.864 -0.416 -7.954 1.00 0.00 ? 41 ARG A NH2 8 ATOM 3244 N N . CYS A 1 42 ? 1.944 -1.645 -1.962 1.00 0.00 ? 42 CYS A N 8 ATOM 3245 C CA . CYS A 1 42 ? 2.531 -2.675 -1.122 1.00 0.00 ? 42 CYS A CA 8 ATOM 3246 C C . CYS A 1 42 ? 3.438 -3.546 -1.993 1.00 0.00 ? 42 CYS A C 8 ATOM 3247 O O . CYS A 1 42 ? 2.999 -4.562 -2.529 1.00 0.00 ? 42 CYS A O 8 ATOM 3248 C CB . CYS A 1 42 ? 1.462 -3.502 -0.407 1.00 0.00 ? 42 CYS A CB 8 ATOM 3249 S SG . CYS A 1 42 ? -0.081 -2.594 -0.024 1.00 0.00 ? 42 CYS A SG 8 ATOM 3250 N N . GLN A 1 43 ? 4.687 -3.116 -2.108 1.00 0.00 ? 43 GLN A N 8 ATOM 3251 C CA . GLN A 1 43 ? 5.658 -3.844 -2.905 1.00 0.00 ? 43 GLN A CA 8 ATOM 3252 C C . GLN A 1 43 ? 6.820 -4.315 -2.027 1.00 0.00 ? 43 GLN A C 8 ATOM 3253 O O . GLN A 1 43 ? 7.230 -5.471 -2.101 1.00 0.00 ? 43 GLN A O 8 ATOM 3254 C CB . GLN A 1 43 ? 6.162 -2.989 -4.070 1.00 0.00 ? 43 GLN A CB 8 ATOM 3255 C CG . GLN A 1 43 ? 5.662 -3.537 -5.407 1.00 0.00 ? 43 GLN A CG 8 ATOM 3256 C CD . GLN A 1 43 ? 5.540 -2.420 -6.447 1.00 0.00 ? 43 GLN A CD 8 ATOM 3257 O OE1 . GLN A 1 43 ? 5.003 -2.598 -7.528 1.00 0.00 ? 43 GLN A OE1 8 ATOM 3258 N NE2 . GLN A 1 43 ? 6.067 -1.263 -6.060 1.00 0.00 ? 43 GLN A NE2 8 ATOM 3259 N N . THR A 1 44 ? 7.317 -3.392 -1.216 1.00 0.00 ? 44 THR A N 8 ATOM 3260 C CA . THR A 1 44 ? 8.424 -3.697 -0.326 1.00 0.00 ? 44 THR A CA 8 ATOM 3261 C C . THR A 1 44 ? 7.998 -4.727 0.721 1.00 0.00 ? 44 THR A C 8 ATOM 3262 O O . THR A 1 44 ? 7.374 -4.378 1.724 1.00 0.00 ? 44 THR A O 8 ATOM 3263 C CB . THR A 1 44 ? 8.919 -2.383 0.282 1.00 0.00 ? 44 THR A CB 8 ATOM 3264 O OG1 . THR A 1 44 ? 8.825 -1.448 -0.790 1.00 0.00 ? 44 THR A OG1 8 ATOM 3265 C CG2 . THR A 1 44 ? 10.410 -2.418 0.617 1.00 0.00 ? 44 THR A CG2 8 ATOM 3266 N N . ARG A 1 45 ? 8.346 -5.977 0.453 1.00 0.00 ? 45 ARG A N 8 ATOM 3267 C CA . ARG A 1 45 ? 8.008 -7.060 1.359 1.00 0.00 ? 45 ARG A CA 8 ATOM 3268 C C . ARG A 1 45 ? 8.963 -7.073 2.554 1.00 0.00 ? 45 ARG A C 8 ATOM 3269 O O . ARG A 1 45 ? 10.181 -7.087 2.379 1.00 0.00 ? 45 ARG A O 8 ATOM 3270 C CB . ARG A 1 45 ? 8.072 -8.413 0.650 1.00 0.00 ? 45 ARG A CB 8 ATOM 3271 C CG . ARG A 1 45 ? 6.882 -9.294 1.035 1.00 0.00 ? 45 ARG A CG 8 ATOM 3272 C CD . ARG A 1 45 ? 7.175 -10.769 0.751 1.00 0.00 ? 45 ARG A CD 8 ATOM 3273 N NE . ARG A 1 45 ? 6.229 -11.626 1.498 1.00 0.00 ? 45 ARG A NE 8 ATOM 3274 C CZ . ARG A 1 45 ? 6.504 -12.198 2.692 1.00 0.00 ? 45 ARG A CZ 8 ATOM 3275 N NH1 . ARG A 1 45 ? 6.276 -11.528 3.841 1.00 0.00 ? 45 ARG A NH1 8 ATOM 3276 N NH2 . ARG A 1 45 ? 7.000 -13.420 2.715 1.00 0.00 ? 45 ARG A NH2 8 ATOM 3277 N N . ASP A 1 46 ? 8.375 -7.065 3.742 1.00 0.00 ? 46 ASP A N 8 ATOM 3278 C CA . ASP A 1 46 ? 9.160 -7.076 4.964 1.00 0.00 ? 46 ASP A CA 8 ATOM 3279 C C . ASP A 1 46 ? 10.365 -6.146 4.800 1.00 0.00 ? 46 ASP A C 8 ATOM 3280 O O . ASP A 1 46 ? 10.320 -5.198 4.019 1.00 0.00 ? 46 ASP A O 8 ATOM 3281 C CB . ASP A 1 46 ? 9.684 -8.480 5.272 1.00 0.00 ? 46 ASP A CB 8 ATOM 3282 C CG . ASP A 1 46 ? 9.881 -8.786 6.758 1.00 0.00 ? 46 ASP A CG 8 ATOM 3283 O OD1 . ASP A 1 46 ? 10.447 -7.848 7.437 1.00 0.00 ? 46 ASP A OD1 8 ATOM 3284 O OD2 . ASP A 1 46 ? 9.510 -9.866 7.242 1.00 0.00 ? 46 ASP A OD2 8 ATOM 3285 N N . LEU A 1 47 ? 11.414 -6.453 5.550 1.00 0.00 ? 47 LEU A N 8 ATOM 3286 C CA . LEU A 1 47 ? 12.629 -5.657 5.497 1.00 0.00 ? 47 LEU A CA 8 ATOM 3287 C C . LEU A 1 47 ? 12.270 -4.177 5.631 1.00 0.00 ? 47 LEU A C 8 ATOM 3288 O O . LEU A 1 47 ? 12.342 -3.426 4.661 1.00 0.00 ? 47 LEU A O 8 ATOM 3289 C CB . LEU A 1 47 ? 13.427 -5.983 4.233 1.00 0.00 ? 47 LEU A CB 8 ATOM 3290 C CG . LEU A 1 47 ? 14.117 -7.349 4.208 1.00 0.00 ? 47 LEU A CG 8 ATOM 3291 C CD1 . LEU A 1 47 ? 13.097 -8.480 4.367 1.00 0.00 ? 47 LEU A CD1 8 ATOM 3292 C CD2 . LEU A 1 47 ? 14.964 -7.514 2.944 1.00 0.00 ? 47 LEU A CD2 8 ATOM 3293 N N . ARG A 1 48 ? 11.892 -3.801 6.845 1.00 0.00 ? 48 ARG A N 8 ATOM 3294 C CA . ARG A 1 48 ? 11.521 -2.424 7.120 1.00 0.00 ? 48 ARG A CA 8 ATOM 3295 C C . ARG A 1 48 ? 10.876 -2.314 8.503 1.00 0.00 ? 48 ARG A C 8 ATOM 3296 O O . ARG A 1 48 ? 9.651 -2.290 8.619 1.00 0.00 ? 48 ARG A O 8 ATOM 3297 C CB . ARG A 1 48 ? 10.547 -1.894 6.066 1.00 0.00 ? 48 ARG A CB 8 ATOM 3298 C CG . ARG A 1 48 ? 11.259 -0.968 5.077 1.00 0.00 ? 48 ARG A CG 8 ATOM 3299 C CD . ARG A 1 48 ? 11.155 0.493 5.520 1.00 0.00 ? 48 ARG A CD 8 ATOM 3300 N NE . ARG A 1 48 ? 11.959 1.352 4.625 1.00 0.00 ? 48 ARG A NE 8 ATOM 3301 C CZ . ARG A 1 48 ? 13.220 1.751 4.888 1.00 0.00 ? 48 ARG A CZ 8 ATOM 3302 N NH1 . ARG A 1 48 ? 14.270 0.981 4.534 1.00 0.00 ? 48 ARG A NH1 8 ATOM 3303 N NH2 . ARG A 1 48 ? 13.411 2.905 5.499 1.00 0.00 ? 48 ARG A NH2 8 ATOM 3304 N N . TRP A 1 49 ? 11.726 -2.249 9.515 1.00 0.00 ? 49 TRP A N 8 ATOM 3305 C CA . TRP A 1 49 ? 11.255 -2.141 10.886 1.00 0.00 ? 49 TRP A CA 8 ATOM 3306 C C . TRP A 1 49 ? 10.394 -3.369 11.187 1.00 0.00 ? 49 TRP A C 8 ATOM 3307 O O . TRP A 1 49 ? 9.623 -3.814 10.338 1.00 0.00 ? 49 TRP A O 8 ATOM 3308 C CB . TRP A 1 49 ? 10.512 -0.822 11.107 1.00 0.00 ? 49 TRP A CB 8 ATOM 3309 C CG . TRP A 1 49 ? 9.042 -0.992 11.495 1.00 0.00 ? 49 TRP A CG 8 ATOM 3310 C CD1 . TRP A 1 49 ? 8.533 -1.716 12.502 1.00 0.00 ? 49 TRP A CD1 8 ATOM 3311 C CD2 . TRP A 1 49 ? 7.905 -0.398 10.834 1.00 0.00 ? 49 TRP A CD2 8 ATOM 3312 N NE1 . TRP A 1 49 ? 7.155 -1.629 12.539 1.00 0.00 ? 49 TRP A NE1 8 ATOM 3313 C CE2 . TRP A 1 49 ? 6.761 -0.803 11.493 1.00 0.00 ? 49 TRP A CE2 8 ATOM 3314 C CE3 . TRP A 1 49 ? 7.843 0.453 9.717 1.00 0.00 ? 49 TRP A CE3 8 ATOM 3315 C CZ2 . TRP A 1 49 ? 5.475 -0.406 11.110 1.00 0.00 ? 49 TRP A CZ2 8 ATOM 3316 C CZ3 . TRP A 1 49 ? 6.551 0.841 9.347 1.00 0.00 ? 49 TRP A CZ3 8 ATOM 3317 C CH2 . TRP A 1 49 ? 5.391 0.443 9.999 1.00 0.00 ? 49 TRP A CH2 8 ATOM 3318 N N . TRP A 1 50 ? 10.555 -3.884 12.397 1.00 0.00 ? 50 TRP A N 8 ATOM 3319 C CA . TRP A 1 50 ? 9.804 -5.052 12.819 1.00 0.00 ? 50 TRP A CA 8 ATOM 3320 C C . TRP A 1 50 ? 10.077 -5.276 14.308 1.00 0.00 ? 50 TRP A C 8 ATOM 3321 O O . TRP A 1 50 ? 9.455 -4.640 15.159 1.00 0.00 ? 50 TRP A O 8 ATOM 3322 C CB . TRP A 1 50 ? 10.150 -6.269 11.959 1.00 0.00 ? 50 TRP A CB 8 ATOM 3323 C CG . TRP A 1 50 ? 9.206 -6.484 10.774 1.00 0.00 ? 50 TRP A CG 8 ATOM 3324 C CD1 . TRP A 1 50 ? 9.416 -6.184 9.486 1.00 0.00 ? 50 TRP A CD1 8 ATOM 3325 C CD2 . TRP A 1 50 ? 7.884 -7.060 10.824 1.00 0.00 ? 50 TRP A CD2 8 ATOM 3326 N NE1 . TRP A 1 50 ? 8.331 -6.523 8.704 1.00 0.00 ? 50 TRP A NE1 8 ATOM 3327 C CE2 . TRP A 1 50 ? 7.370 -7.073 9.544 1.00 0.00 ? 50 TRP A CE2 8 ATOM 3328 C CE3 . TRP A 1 50 ? 7.146 -7.554 11.915 1.00 0.00 ? 50 TRP A CE3 8 ATOM 3329 C CZ2 . TRP A 1 50 ? 6.098 -7.570 9.232 1.00 0.00 ? 50 TRP A CZ2 8 ATOM 3330 C CZ3 . TRP A 1 50 ? 5.877 -8.047 11.587 1.00 0.00 ? 50 TRP A CZ3 8 ATOM 3331 C CH2 . TRP A 1 50 ? 5.346 -8.068 10.303 1.00 0.00 ? 50 TRP A CH2 8 ATOM 3332 N N . GLU A 1 51 ? 11.004 -6.182 14.578 1.00 0.00 ? 51 GLU A N 8 ATOM 3333 C CA . GLU A 1 51 ? 11.367 -6.498 15.949 1.00 0.00 ? 51 GLU A CA 8 ATOM 3334 C C . GLU A 1 51 ? 12.886 -6.452 16.122 1.00 0.00 ? 51 GLU A C 8 ATOM 3335 O O . GLU A 1 51 ? 13.627 -6.868 15.233 1.00 0.00 ? 51 GLU A O 8 ATOM 3336 C CB . GLU A 1 51 ? 10.809 -7.861 16.363 1.00 0.00 ? 51 GLU A CB 8 ATOM 3337 C CG . GLU A 1 51 ? 9.864 -8.415 15.295 1.00 0.00 ? 51 GLU A CG 8 ATOM 3338 C CD . GLU A 1 51 ? 8.997 -9.541 15.860 1.00 0.00 ? 51 GLU A CD 8 ATOM 3339 O OE1 . GLU A 1 51 ? 7.921 -9.276 16.414 1.00 0.00 ? 51 GLU A OE1 8 ATOM 3340 O OE2 . GLU A 1 51 ? 9.477 -10.729 15.707 1.00 0.00 ? 51 GLU A OE2 8 ATOM 3341 N N . LEU A 1 52 ? 13.304 -5.943 17.271 1.00 0.00 ? 52 LEU A N 8 ATOM 3342 C CA . LEU A 1 52 ? 14.722 -5.838 17.570 1.00 0.00 ? 52 LEU A CA 8 ATOM 3343 C C . LEU A 1 52 ? 14.971 -6.299 19.009 1.00 0.00 ? 52 LEU A C 8 ATOM 3344 O O . LEU A 1 52 ? 14.237 -5.921 19.921 1.00 0.00 ? 52 LEU A O 8 ATOM 3345 C CB . LEU A 1 52 ? 15.226 -4.422 17.282 1.00 0.00 ? 52 LEU A CB 8 ATOM 3346 C CG . LEU A 1 52 ? 16.734 -4.204 17.431 1.00 0.00 ? 52 LEU A CG 8 ATOM 3347 C CD1 . LEU A 1 52 ? 17.304 -3.474 16.213 1.00 0.00 ? 52 LEU A CD1 8 ATOM 3348 C CD2 . LEU A 1 52 ? 17.057 -3.477 18.739 1.00 0.00 ? 52 LEU A CD2 8 ATOM 3349 N N . ARG A 1 53 ? 16.007 -7.107 19.166 1.00 0.00 ? 53 ARG A N 8 ATOM 3350 C CA . ARG A 1 53 ? 16.361 -7.623 20.478 1.00 0.00 ? 53 ARG A CA 8 ATOM 3351 C C . ARG A 1 53 ? 17.210 -6.603 21.238 1.00 0.00 ? 53 ARG A C 8 ATOM 3352 O O . ARG A 1 53 ? 18.098 -5.977 20.661 1.00 0.00 ? 53 ARG A O 8 ATOM 3353 C CB . ARG A 1 53 ? 17.139 -8.937 20.361 1.00 0.00 ? 53 ARG A CB 8 ATOM 3354 C CG . ARG A 1 53 ? 16.245 -10.055 19.816 1.00 0.00 ? 53 ARG A CG 8 ATOM 3355 C CD . ARG A 1 53 ? 17.019 -11.371 19.715 1.00 0.00 ? 53 ARG A CD 8 ATOM 3356 N NE . ARG A 1 53 ? 17.291 -11.904 21.069 1.00 0.00 ? 53 ARG A NE 8 ATOM 3357 C CZ . ARG A 1 53 ? 18.221 -12.843 21.340 1.00 0.00 ? 53 ARG A CZ 8 ATOM 3358 N NH1 . ARG A 1 53 ? 18.124 -14.079 20.806 1.00 0.00 ? 53 ARG A NH1 8 ATOM 3359 N NH2 . ARG A 1 53 ? 19.230 -12.535 22.133 1.00 0.00 ? 53 ARG A NH2 8 ATOM 3360 O OXT . ARG A 1 53 ? 16.916 -6.472 22.487 1.00 0.00 ? 53 ARG A OXT 8 ATOM 3361 N N . ASN A 1 1 ? -1.629 15.164 2.222 1.00 0.00 ? 1 ASN A N 9 ATOM 3362 C CA . ASN A 1 1 ? -2.712 14.537 2.959 1.00 0.00 ? 1 ASN A CA 9 ATOM 3363 C C . ASN A 1 1 ? -3.197 13.303 2.195 1.00 0.00 ? 1 ASN A C 9 ATOM 3364 O O . ASN A 1 1 ? -3.315 13.334 0.970 1.00 0.00 ? 1 ASN A O 9 ATOM 3365 C CB . ASN A 1 1 ? -3.898 15.491 3.115 1.00 0.00 ? 1 ASN A CB 9 ATOM 3366 C CG . ASN A 1 1 ? -3.533 16.678 4.010 1.00 0.00 ? 1 ASN A CG 9 ATOM 3367 O OD1 . ASN A 1 1 ? -3.498 16.584 5.226 1.00 0.00 ? 1 ASN A OD1 9 ATOM 3368 N ND2 . ASN A 1 1 ? -3.263 17.796 3.342 1.00 0.00 ? 1 ASN A ND2 9 ATOM 3369 N N . SER A 1 2 ? -3.464 12.247 2.949 1.00 0.00 ? 2 SER A N 9 ATOM 3370 C CA . SER A 1 2 ? -3.932 11.005 2.357 1.00 0.00 ? 2 SER A CA 9 ATOM 3371 C C . SER A 1 2 ? -5.444 11.071 2.129 1.00 0.00 ? 2 SER A C 9 ATOM 3372 O O . SER A 1 2 ? -6.193 11.461 3.023 1.00 0.00 ? 2 SER A O 9 ATOM 3373 C CB . SER A 1 2 ? -3.581 9.807 3.241 1.00 0.00 ? 2 SER A CB 9 ATOM 3374 O OG . SER A 1 2 ? -2.178 9.707 3.472 1.00 0.00 ? 2 SER A OG 9 ATOM 3375 N N . TYR A 1 3 ? -5.846 10.685 0.928 1.00 0.00 ? 3 TYR A N 9 ATOM 3376 C CA . TYR A 1 3 ? -7.255 10.695 0.571 1.00 0.00 ? 3 TYR A CA 9 ATOM 3377 C C . TYR A 1 3 ? -7.668 9.368 -0.069 1.00 0.00 ? 3 TYR A C 9 ATOM 3378 O O . TYR A 1 3 ? -6.983 8.864 -0.958 1.00 0.00 ? 3 TYR A O 9 ATOM 3379 C CB . TYR A 1 3 ? -7.422 11.817 -0.455 1.00 0.00 ? 3 TYR A CB 9 ATOM 3380 C CG . TYR A 1 3 ? -8.795 11.845 -1.130 1.00 0.00 ? 3 TYR A CG 9 ATOM 3381 C CD1 . TYR A 1 3 ? -9.848 12.498 -0.524 1.00 0.00 ? 3 TYR A CD1 9 ATOM 3382 C CD2 . TYR A 1 3 ? -8.979 11.215 -2.344 1.00 0.00 ? 3 TYR A CD2 9 ATOM 3383 C CE1 . TYR A 1 3 ? -11.140 12.524 -1.159 1.00 0.00 ? 3 TYR A CE1 9 ATOM 3384 C CE2 . TYR A 1 3 ? -10.271 11.241 -2.979 1.00 0.00 ? 3 TYR A CE2 9 ATOM 3385 C CZ . TYR A 1 3 ? -11.288 11.894 -2.355 1.00 0.00 ? 3 TYR A CZ 9 ATOM 3386 O OH . TYR A 1 3 ? -12.508 11.918 -2.956 1.00 0.00 ? 3 TYR A OH 9 ATOM 3387 N N . PRO A 1 4 ? -8.816 8.828 0.419 1.00 0.00 ? 4 PRO A N 9 ATOM 3388 C CA . PRO A 1 4 ? -9.330 7.570 -0.097 1.00 0.00 ? 4 PRO A CA 9 ATOM 3389 C C . PRO A 1 4 ? -9.964 7.761 -1.476 1.00 0.00 ? 4 PRO A C 9 ATOM 3390 O O . PRO A 1 4 ? -10.974 8.452 -1.608 1.00 0.00 ? 4 PRO A O 9 ATOM 3391 C CB . PRO A 1 4 ? -10.320 7.090 0.951 1.00 0.00 ? 4 PRO A CB 9 ATOM 3392 C CG . PRO A 1 4 ? -10.672 8.313 1.785 1.00 0.00 ? 4 PRO A CG 9 ATOM 3393 C CD . PRO A 1 4 ? -9.654 9.398 1.469 1.00 0.00 ? 4 PRO A CD 9 ATOM 3394 N N . GLY A 1 5 ? -9.347 7.135 -2.467 1.00 0.00 ? 5 GLY A N 9 ATOM 3395 C CA . GLY A 1 5 ? -9.839 7.227 -3.832 1.00 0.00 ? 5 GLY A CA 9 ATOM 3396 C C . GLY A 1 5 ? -8.997 6.367 -4.777 1.00 0.00 ? 5 GLY A C 9 ATOM 3397 O O . GLY A 1 5 ? -7.841 6.065 -4.484 1.00 0.00 ? 5 GLY A O 9 ATOM 3398 N N . CYS A 1 6 ? -9.609 5.999 -5.893 1.00 0.00 ? 6 CYS A N 9 ATOM 3399 C CA . CYS A 1 6 ? -8.930 5.180 -6.883 1.00 0.00 ? 6 CYS A CA 9 ATOM 3400 C C . CYS A 1 6 ? -9.948 4.775 -7.950 1.00 0.00 ? 6 CYS A C 9 ATOM 3401 O O . CYS A 1 6 ? -10.831 3.957 -7.693 1.00 0.00 ? 6 CYS A O 9 ATOM 3402 C CB . CYS A 1 6 ? -8.256 3.963 -6.246 1.00 0.00 ? 6 CYS A CB 9 ATOM 3403 S SG . CYS A 1 6 ? -9.039 3.375 -4.699 1.00 0.00 ? 6 CYS A SG 9 ATOM 3404 N N . PRO A 1 7 ? -9.788 5.380 -9.157 1.00 0.00 ? 7 PRO A N 9 ATOM 3405 C CA . PRO A 1 7 ? -10.683 5.091 -10.265 1.00 0.00 ? 7 PRO A CA 9 ATOM 3406 C C . PRO A 1 7 ? -10.377 3.721 -10.873 1.00 0.00 ? 7 PRO A C 9 ATOM 3407 O O . PRO A 1 7 ? -9.422 3.057 -10.470 1.00 0.00 ? 7 PRO A O 9 ATOM 3408 C CB . PRO A 1 7 ? -10.479 6.234 -11.246 1.00 0.00 ? 7 PRO A CB 9 ATOM 3409 C CG . PRO A 1 7 ? -9.150 6.871 -10.871 1.00 0.00 ? 7 PRO A CG 9 ATOM 3410 C CD . PRO A 1 7 ? -8.754 6.353 -9.498 1.00 0.00 ? 7 PRO A CD 9 ATOM 3411 N N . SER A 1 8 ? -11.204 3.337 -11.834 1.00 0.00 ? 8 SER A N 9 ATOM 3412 C CA . SER A 1 8 ? -11.035 2.057 -12.501 1.00 0.00 ? 8 SER A CA 9 ATOM 3413 C C . SER A 1 8 ? -9.589 1.903 -12.976 1.00 0.00 ? 8 SER A C 9 ATOM 3414 O O . SER A 1 8 ? -9.093 0.785 -13.114 1.00 0.00 ? 8 SER A O 9 ATOM 3415 C CB . SER A 1 8 ? -11.998 1.920 -13.682 1.00 0.00 ? 8 SER A CB 9 ATOM 3416 O OG . SER A 1 8 ? -13.359 2.045 -13.278 1.00 0.00 ? 8 SER A OG 9 ATOM 3417 N N . SER A 1 9 ? -8.952 3.040 -13.212 1.00 0.00 ? 9 SER A N 9 ATOM 3418 C CA . SER A 1 9 ? -7.572 3.045 -13.668 1.00 0.00 ? 9 SER A CA 9 ATOM 3419 C C . SER A 1 9 ? -6.656 2.501 -12.569 1.00 0.00 ? 9 SER A C 9 ATOM 3420 O O . SER A 1 9 ? -5.588 1.964 -12.857 1.00 0.00 ? 9 SER A O 9 ATOM 3421 C CB . SER A 1 9 ? -7.133 4.452 -14.077 1.00 0.00 ? 9 SER A CB 9 ATOM 3422 O OG . SER A 1 9 ? -5.790 4.474 -14.552 1.00 0.00 ? 9 SER A OG 9 ATOM 3423 N N . TYR A 1 10 ? -7.109 2.659 -11.334 1.00 0.00 ? 10 TYR A N 9 ATOM 3424 C CA . TYR A 1 10 ? -6.343 2.190 -10.191 1.00 0.00 ? 10 TYR A CA 9 ATOM 3425 C C . TYR A 1 10 ? -7.106 1.104 -9.429 1.00 0.00 ? 10 TYR A C 9 ATOM 3426 O O . TYR A 1 10 ? -7.214 1.159 -8.205 1.00 0.00 ? 10 TYR A O 9 ATOM 3427 C CB . TYR A 1 10 ? -6.162 3.404 -9.279 1.00 0.00 ? 10 TYR A CB 9 ATOM 3428 C CG . TYR A 1 10 ? -5.235 4.479 -9.849 1.00 0.00 ? 10 TYR A CG 9 ATOM 3429 C CD1 . TYR A 1 10 ? -5.703 5.358 -10.805 1.00 0.00 ? 10 TYR A CD1 9 ATOM 3430 C CD2 . TYR A 1 10 ? -3.929 4.570 -9.409 1.00 0.00 ? 10 TYR A CD2 9 ATOM 3431 C CE1 . TYR A 1 10 ? -4.830 6.370 -11.343 1.00 0.00 ? 10 TYR A CE1 9 ATOM 3432 C CE2 . TYR A 1 10 ? -3.057 5.581 -9.947 1.00 0.00 ? 10 TYR A CE2 9 ATOM 3433 C CZ . TYR A 1 10 ? -3.550 6.431 -10.886 1.00 0.00 ? 10 TYR A CZ 9 ATOM 3434 O OH . TYR A 1 10 ? -2.727 7.387 -11.395 1.00 0.00 ? 10 TYR A OH 9 ATOM 3435 N N . ASP A 1 11 ? -7.614 0.142 -10.184 1.00 0.00 ? 11 ASP A N 9 ATOM 3436 C CA . ASP A 1 11 ? -8.363 -0.956 -9.596 1.00 0.00 ? 11 ASP A CA 9 ATOM 3437 C C . ASP A 1 11 ? -7.450 -2.175 -9.461 1.00 0.00 ? 11 ASP A C 9 ATOM 3438 O O . ASP A 1 11 ? -7.836 -3.287 -9.820 1.00 0.00 ? 11 ASP A O 9 ATOM 3439 C CB . ASP A 1 11 ? -9.549 -1.347 -10.478 1.00 0.00 ? 11 ASP A CB 9 ATOM 3440 C CG . ASP A 1 11 ? -10.510 -2.364 -9.855 1.00 0.00 ? 11 ASP A CG 9 ATOM 3441 O OD1 . ASP A 1 11 ? -11.328 -1.878 -8.985 1.00 0.00 ? 11 ASP A OD1 9 ATOM 3442 O OD2 . ASP A 1 11 ? -10.477 -3.558 -10.186 1.00 0.00 ? 11 ASP A OD2 9 ATOM 3443 N N . GLY A 1 12 ? -6.256 -1.927 -8.943 1.00 0.00 ? 12 GLY A N 9 ATOM 3444 C CA . GLY A 1 12 ? -5.285 -2.992 -8.757 1.00 0.00 ? 12 GLY A CA 9 ATOM 3445 C C . GLY A 1 12 ? -3.927 -2.428 -8.335 1.00 0.00 ? 12 GLY A C 9 ATOM 3446 O O . GLY A 1 12 ? -2.885 -2.921 -8.766 1.00 0.00 ? 12 GLY A O 9 ATOM 3447 N N . TYR A 1 13 ? -3.981 -1.401 -7.500 1.00 0.00 ? 13 TYR A N 9 ATOM 3448 C CA . TYR A 1 13 ? -2.768 -0.763 -7.018 1.00 0.00 ? 13 TYR A CA 9 ATOM 3449 C C . TYR A 1 13 ? -2.403 -1.269 -5.620 1.00 0.00 ? 13 TYR A C 9 ATOM 3450 O O . TYR A 1 13 ? -1.542 -0.696 -4.954 1.00 0.00 ? 13 TYR A O 9 ATOM 3451 C CB . TYR A 1 13 ? -3.079 0.733 -6.940 1.00 0.00 ? 13 TYR A CB 9 ATOM 3452 C CG . TYR A 1 13 ? -1.930 1.631 -7.400 1.00 0.00 ? 13 TYR A CG 9 ATOM 3453 C CD1 . TYR A 1 13 ? -1.594 1.693 -8.738 1.00 0.00 ? 13 TYR A CD1 9 ATOM 3454 C CD2 . TYR A 1 13 ? -1.228 2.380 -6.478 1.00 0.00 ? 13 TYR A CD2 9 ATOM 3455 C CE1 . TYR A 1 13 ? -0.512 2.540 -9.171 1.00 0.00 ? 13 TYR A CE1 9 ATOM 3456 C CE2 . TYR A 1 13 ? -0.145 3.226 -6.911 1.00 0.00 ? 13 TYR A CE2 9 ATOM 3457 C CZ . TYR A 1 13 ? 0.159 3.264 -8.235 1.00 0.00 ? 13 TYR A CZ 9 ATOM 3458 O OH . TYR A 1 13 ? 1.181 4.063 -8.644 1.00 0.00 ? 13 TYR A OH 9 ATOM 3459 N N . CYS A 1 14 ? -3.075 -2.337 -5.217 1.00 0.00 ? 14 CYS A N 9 ATOM 3460 C CA . CYS A 1 14 ? -2.833 -2.926 -3.911 1.00 0.00 ? 14 CYS A CA 9 ATOM 3461 C C . CYS A 1 14 ? -2.888 -4.448 -4.053 1.00 0.00 ? 14 CYS A C 9 ATOM 3462 O O . CYS A 1 14 ? -3.895 -4.997 -4.501 1.00 0.00 ? 14 CYS A O 9 ATOM 3463 C CB . CYS A 1 14 ? -3.825 -2.413 -2.866 1.00 0.00 ? 14 CYS A CB 9 ATOM 3464 S SG . CYS A 1 14 ? -4.665 -0.848 -3.308 1.00 0.00 ? 14 CYS A SG 9 ATOM 3465 N N . LEU A 1 15 ? -1.796 -5.087 -3.663 1.00 0.00 ? 15 LEU A N 9 ATOM 3466 C CA . LEU A 1 15 ? -1.708 -6.536 -3.741 1.00 0.00 ? 15 LEU A CA 9 ATOM 3467 C C . LEU A 1 15 ? -1.239 -7.087 -2.394 1.00 0.00 ? 15 LEU A C 9 ATOM 3468 O O . LEU A 1 15 ? -0.892 -6.324 -1.493 1.00 0.00 ? 15 LEU A O 9 ATOM 3469 C CB . LEU A 1 15 ? -0.826 -6.957 -4.919 1.00 0.00 ? 15 LEU A CB 9 ATOM 3470 C CG . LEU A 1 15 ? -0.999 -6.151 -6.208 1.00 0.00 ? 15 LEU A CG 9 ATOM 3471 C CD1 . LEU A 1 15 ? 0.358 -5.769 -6.801 1.00 0.00 ? 15 LEU A CD1 9 ATOM 3472 C CD2 . LEU A 1 15 ? -1.873 -6.904 -7.212 1.00 0.00 ? 15 LEU A CD2 9 ATOM 3473 N N . ASN A 1 16 ? -1.243 -8.408 -2.296 1.00 0.00 ? 16 ASN A N 9 ATOM 3474 C CA . ASN A 1 16 ? -0.822 -9.071 -1.074 1.00 0.00 ? 16 ASN A CA 9 ATOM 3475 C C . ASN A 1 16 ? -1.450 -8.362 0.127 1.00 0.00 ? 16 ASN A C 9 ATOM 3476 O O . ASN A 1 16 ? -0.745 -7.772 0.943 1.00 0.00 ? 16 ASN A O 9 ATOM 3477 C CB . ASN A 1 16 ? 0.699 -9.015 -0.913 1.00 0.00 ? 16 ASN A CB 9 ATOM 3478 C CG . ASN A 1 16 ? 1.396 -9.845 -1.993 1.00 0.00 ? 16 ASN A CG 9 ATOM 3479 O OD1 . ASN A 1 16 ? 0.995 -10.951 -2.317 1.00 0.00 ? 16 ASN A OD1 9 ATOM 3480 N ND2 . ASN A 1 16 ? 2.457 -9.251 -2.532 1.00 0.00 ? 16 ASN A ND2 9 ATOM 3481 N N . GLY A 1 17 ? -2.771 -8.444 0.198 1.00 0.00 ? 17 GLY A N 9 ATOM 3482 C CA . GLY A 1 17 ? -3.503 -7.818 1.286 1.00 0.00 ? 17 GLY A CA 9 ATOM 3483 C C . GLY A 1 17 ? -3.117 -6.345 1.429 1.00 0.00 ? 17 GLY A C 9 ATOM 3484 O O . GLY A 1 17 ? -2.366 -5.981 2.332 1.00 0.00 ? 17 GLY A O 9 ATOM 3485 N N . GLY A 1 18 ? -3.650 -5.535 0.525 1.00 0.00 ? 18 GLY A N 9 ATOM 3486 C CA . GLY A 1 18 ? -3.370 -4.110 0.539 1.00 0.00 ? 18 GLY A CA 9 ATOM 3487 C C . GLY A 1 18 ? -4.647 -3.299 0.307 1.00 0.00 ? 18 GLY A C 9 ATOM 3488 O O . GLY A 1 18 ? -5.532 -3.725 -0.433 1.00 0.00 ? 18 GLY A O 9 ATOM 3489 N N . VAL A 1 19 ? -4.702 -2.143 0.953 1.00 0.00 ? 19 VAL A N 9 ATOM 3490 C CA . VAL A 1 19 ? -5.855 -1.269 0.827 1.00 0.00 ? 19 VAL A CA 9 ATOM 3491 C C . VAL A 1 19 ? -5.570 -0.207 -0.237 1.00 0.00 ? 19 VAL A C 9 ATOM 3492 O O . VAL A 1 19 ? -4.424 -0.026 -0.648 1.00 0.00 ? 19 VAL A O 9 ATOM 3493 C CB . VAL A 1 19 ? -6.210 -0.670 2.189 1.00 0.00 ? 19 VAL A CB 9 ATOM 3494 C CG1 . VAL A 1 19 ? -5.493 0.665 2.405 1.00 0.00 ? 19 VAL A CG1 9 ATOM 3495 C CG2 . VAL A 1 19 ? -7.723 -0.510 2.340 1.00 0.00 ? 19 VAL A CG2 9 ATOM 3496 N N . CYS A 1 20 ? -6.632 0.467 -0.654 1.00 0.00 ? 20 CYS A N 9 ATOM 3497 C CA . CYS A 1 20 ? -6.511 1.506 -1.662 1.00 0.00 ? 20 CYS A CA 9 ATOM 3498 C C . CYS A 1 20 ? -6.477 2.861 -0.954 1.00 0.00 ? 20 CYS A C 9 ATOM 3499 O O . CYS A 1 20 ? -7.246 3.099 -0.024 1.00 0.00 ? 20 CYS A O 9 ATOM 3500 C CB . CYS A 1 20 ? -7.639 1.428 -2.693 1.00 0.00 ? 20 CYS A CB 9 ATOM 3501 S SG . CYS A 1 20 ? -7.244 2.169 -4.320 1.00 0.00 ? 20 CYS A SG 9 ATOM 3502 N N . MET A 1 21 ? -5.579 3.716 -1.421 1.00 0.00 ? 21 MET A N 9 ATOM 3503 C CA . MET A 1 21 ? -5.436 5.042 -0.843 1.00 0.00 ? 21 MET A CA 9 ATOM 3504 C C . MET A 1 21 ? -4.829 6.017 -1.855 1.00 0.00 ? 21 MET A C 9 ATOM 3505 O O . MET A 1 21 ? -3.824 5.709 -2.493 1.00 0.00 ? 21 MET A O 9 ATOM 3506 C CB . MET A 1 21 ? -4.539 4.965 0.394 1.00 0.00 ? 21 MET A CB 9 ATOM 3507 C CG . MET A 1 21 ? -4.990 5.967 1.459 1.00 0.00 ? 21 MET A CG 9 ATOM 3508 S SD . MET A 1 21 ? -6.274 5.247 2.470 1.00 0.00 ? 21 MET A SD 9 ATOM 3509 C CE . MET A 1 21 ? -6.577 6.598 3.596 1.00 0.00 ? 21 MET A CE 9 ATOM 3510 N N . HIS A 1 22 ? -5.464 7.174 -1.967 1.00 0.00 ? 22 HIS A N 9 ATOM 3511 C CA . HIS A 1 22 ? -4.999 8.197 -2.888 1.00 0.00 ? 22 HIS A CA 9 ATOM 3512 C C . HIS A 1 22 ? -4.285 9.304 -2.109 1.00 0.00 ? 22 HIS A C 9 ATOM 3513 O O . HIS A 1 22 ? -4.760 9.733 -1.059 1.00 0.00 ? 22 HIS A O 9 ATOM 3514 C CB . HIS A 1 22 ? -6.154 8.723 -3.743 1.00 0.00 ? 22 HIS A CB 9 ATOM 3515 C CG . HIS A 1 22 ? -5.738 9.744 -4.775 1.00 0.00 ? 22 HIS A CG 9 ATOM 3516 N ND1 . HIS A 1 22 ? -6.349 10.980 -4.895 1.00 0.00 ? 22 HIS A ND1 9 ATOM 3517 C CD2 . HIS A 1 22 ? -4.767 9.699 -5.732 1.00 0.00 ? 22 HIS A CD2 9 ATOM 3518 C CE1 . HIS A 1 22 ? -5.765 11.641 -5.883 1.00 0.00 ? 22 HIS A CE1 9 ATOM 3519 N NE2 . HIS A 1 22 ? -4.785 10.846 -6.402 1.00 0.00 ? 22 HIS A NE2 9 ATOM 3520 N N . ILE A 1 23 ? -3.158 9.735 -2.655 1.00 0.00 ? 23 ILE A N 9 ATOM 3521 C CA . ILE A 1 23 ? -2.374 10.784 -2.025 1.00 0.00 ? 23 ILE A CA 9 ATOM 3522 C C . ILE A 1 23 ? -2.809 12.142 -2.579 1.00 0.00 ? 23 ILE A C 9 ATOM 3523 O O . ILE A 1 23 ? -3.417 12.215 -3.646 1.00 0.00 ? 23 ILE A O 9 ATOM 3524 C CB . ILE A 1 23 ? -0.879 10.504 -2.185 1.00 0.00 ? 23 ILE A CB 9 ATOM 3525 C CG1 . ILE A 1 23 ? -0.634 9.056 -2.615 1.00 0.00 ? 23 ILE A CG1 9 ATOM 3526 C CG2 . ILE A 1 23 ? -0.116 10.859 -0.907 1.00 0.00 ? 23 ILE A CG2 9 ATOM 3527 C CD1 . ILE A 1 23 ? 0.834 8.667 -2.422 1.00 0.00 ? 23 ILE A CD1 9 ATOM 3528 N N . GLU A 1 24 ? -2.478 13.184 -1.830 1.00 0.00 ? 24 GLU A N 9 ATOM 3529 C CA . GLU A 1 24 ? -2.827 14.535 -2.233 1.00 0.00 ? 24 GLU A CA 9 ATOM 3530 C C . GLU A 1 24 ? -1.562 15.373 -2.432 1.00 0.00 ? 24 GLU A C 9 ATOM 3531 O O . GLU A 1 24 ? -1.628 16.494 -2.934 1.00 0.00 ? 24 GLU A O 9 ATOM 3532 C CB . GLU A 1 24 ? -3.761 15.189 -1.213 1.00 0.00 ? 24 GLU A CB 9 ATOM 3533 C CG . GLU A 1 24 ? -5.110 14.467 -1.165 1.00 0.00 ? 24 GLU A CG 9 ATOM 3534 C CD . GLU A 1 24 ? -6.086 15.191 -0.235 1.00 0.00 ? 24 GLU A CD 9 ATOM 3535 O OE1 . GLU A 1 24 ? -6.073 14.956 0.982 1.00 0.00 ? 24 GLU A OE1 9 ATOM 3536 O OE2 . GLU A 1 24 ? -6.878 16.026 -0.820 1.00 0.00 ? 24 GLU A OE2 9 ATOM 3537 N N . SER A 1 25 ? -0.440 14.795 -2.029 1.00 0.00 ? 25 SER A N 9 ATOM 3538 C CA . SER A 1 25 ? 0.839 15.475 -2.158 1.00 0.00 ? 25 SER A CA 9 ATOM 3539 C C . SER A 1 25 ? 1.070 15.885 -3.613 1.00 0.00 ? 25 SER A C 9 ATOM 3540 O O . SER A 1 25 ? 1.721 16.893 -3.881 1.00 0.00 ? 25 SER A O 9 ATOM 3541 C CB . SER A 1 25 ? 1.985 14.587 -1.669 1.00 0.00 ? 25 SER A CB 9 ATOM 3542 O OG . SER A 1 25 ? 1.810 14.188 -0.312 1.00 0.00 ? 25 SER A OG 9 ATOM 3543 N N . LEU A 1 26 ? 0.523 15.084 -4.516 1.00 0.00 ? 26 LEU A N 9 ATOM 3544 C CA . LEU A 1 26 ? 0.661 15.351 -5.937 1.00 0.00 ? 26 LEU A CA 9 ATOM 3545 C C . LEU A 1 26 ? -0.477 14.663 -6.694 1.00 0.00 ? 26 LEU A C 9 ATOM 3546 O O . LEU A 1 26 ? -0.348 14.368 -7.881 1.00 0.00 ? 26 LEU A O 9 ATOM 3547 C CB . LEU A 1 26 ? 2.055 14.951 -6.424 1.00 0.00 ? 26 LEU A CB 9 ATOM 3548 C CG . LEU A 1 26 ? 2.952 16.094 -6.903 1.00 0.00 ? 26 LEU A CG 9 ATOM 3549 C CD1 . LEU A 1 26 ? 4.387 15.611 -7.120 1.00 0.00 ? 26 LEU A CD1 9 ATOM 3550 C CD2 . LEU A 1 26 ? 2.374 16.758 -8.155 1.00 0.00 ? 26 LEU A CD2 9 ATOM 3551 N N . ASP A 1 27 ? -1.565 14.427 -5.976 1.00 0.00 ? 27 ASP A N 9 ATOM 3552 C CA . ASP A 1 27 ? -2.724 13.779 -6.565 1.00 0.00 ? 27 ASP A CA 9 ATOM 3553 C C . ASP A 1 27 ? -2.342 12.366 -7.009 1.00 0.00 ? 27 ASP A C 9 ATOM 3554 O O . ASP A 1 27 ? -2.963 11.805 -7.911 1.00 0.00 ? 27 ASP A O 9 ATOM 3555 C CB . ASP A 1 27 ? -3.216 14.544 -7.795 1.00 0.00 ? 27 ASP A CB 9 ATOM 3556 C CG . ASP A 1 27 ? -4.733 14.727 -7.878 1.00 0.00 ? 27 ASP A CG 9 ATOM 3557 O OD1 . ASP A 1 27 ? -5.322 15.527 -7.137 1.00 0.00 ? 27 ASP A OD1 9 ATOM 3558 O OD2 . ASP A 1 27 ? -5.323 13.995 -8.763 1.00 0.00 ? 27 ASP A OD2 9 ATOM 3559 N N . SER A 1 28 ? -1.322 11.830 -6.355 1.00 0.00 ? 28 SER A N 9 ATOM 3560 C CA . SER A 1 28 ? -0.850 10.492 -6.671 1.00 0.00 ? 28 SER A CA 9 ATOM 3561 C C . SER A 1 28 ? -1.685 9.452 -5.922 1.00 0.00 ? 28 SER A C 9 ATOM 3562 O O . SER A 1 28 ? -2.374 9.782 -4.958 1.00 0.00 ? 28 SER A O 9 ATOM 3563 C CB . SER A 1 28 ? 0.631 10.335 -6.324 1.00 0.00 ? 28 SER A CB 9 ATOM 3564 O OG . SER A 1 28 ? 1.019 8.966 -6.244 1.00 0.00 ? 28 SER A OG 9 ATOM 3565 N N . TYR A 1 29 ? -1.594 8.217 -6.393 1.00 0.00 ? 29 TYR A N 9 ATOM 3566 C CA . TYR A 1 29 ? -2.333 7.126 -5.779 1.00 0.00 ? 29 TYR A CA 9 ATOM 3567 C C . TYR A 1 29 ? -1.385 6.137 -5.099 1.00 0.00 ? 29 TYR A C 9 ATOM 3568 O O . TYR A 1 29 ? -0.327 5.815 -5.639 1.00 0.00 ? 29 TYR A O 9 ATOM 3569 C CB . TYR A 1 29 ? -3.061 6.415 -6.921 1.00 0.00 ? 29 TYR A CB 9 ATOM 3570 C CG . TYR A 1 29 ? -4.221 7.217 -7.515 1.00 0.00 ? 29 TYR A CG 9 ATOM 3571 C CD1 . TYR A 1 29 ? -3.992 8.093 -8.557 1.00 0.00 ? 29 TYR A CD1 9 ATOM 3572 C CD2 . TYR A 1 29 ? -5.496 7.065 -7.008 1.00 0.00 ? 29 TYR A CD2 9 ATOM 3573 C CE1 . TYR A 1 29 ? -5.084 8.848 -9.116 1.00 0.00 ? 29 TYR A CE1 9 ATOM 3574 C CE2 . TYR A 1 29 ? -6.587 7.820 -7.568 1.00 0.00 ? 29 TYR A CE2 9 ATOM 3575 C CZ . TYR A 1 29 ? -6.327 8.674 -8.593 1.00 0.00 ? 29 TYR A CZ 9 ATOM 3576 O OH . TYR A 1 29 ? -7.359 9.387 -9.121 1.00 0.00 ? 29 TYR A OH 9 ATOM 3577 N N . THR A 1 30 ? -1.798 5.681 -3.927 1.00 0.00 ? 30 THR A N 9 ATOM 3578 C CA . THR A 1 30 ? -0.998 4.734 -3.168 1.00 0.00 ? 30 THR A CA 9 ATOM 3579 C C . THR A 1 30 ? -1.850 3.532 -2.749 1.00 0.00 ? 30 THR A C 9 ATOM 3580 O O . THR A 1 30 ? -2.996 3.401 -3.175 1.00 0.00 ? 30 THR A O 9 ATOM 3581 C CB . THR A 1 30 ? -0.377 5.480 -1.985 1.00 0.00 ? 30 THR A CB 9 ATOM 3582 O OG1 . THR A 1 30 ? 0.607 4.579 -1.486 1.00 0.00 ? 30 THR A OG1 9 ATOM 3583 C CG2 . THR A 1 30 ? -1.355 5.647 -0.820 1.00 0.00 ? 30 THR A CG2 9 ATOM 3584 N N . CYS A 1 31 ? -1.255 2.687 -1.921 1.00 0.00 ? 31 CYS A N 9 ATOM 3585 C CA . CYS A 1 31 ? -1.944 1.502 -1.439 1.00 0.00 ? 31 CYS A CA 9 ATOM 3586 C C . CYS A 1 31 ? -1.224 1.003 -0.185 1.00 0.00 ? 31 CYS A C 9 ATOM 3587 O O . CYS A 1 31 ? 0.003 0.921 -0.160 1.00 0.00 ? 31 CYS A O 9 ATOM 3588 C CB . CYS A 1 31 ? -2.027 0.420 -2.518 1.00 0.00 ? 31 CYS A CB 9 ATOM 3589 S SG . CYS A 1 31 ? -3.618 0.355 -3.420 1.00 0.00 ? 31 CYS A SG 9 ATOM 3590 N N . ASN A 1 32 ? -2.018 0.683 0.827 1.00 0.00 ? 32 ASN A N 9 ATOM 3591 C CA . ASN A 1 32 ? -1.471 0.194 2.081 1.00 0.00 ? 32 ASN A CA 9 ATOM 3592 C C . ASN A 1 32 ? -1.520 -1.335 2.092 1.00 0.00 ? 32 ASN A C 9 ATOM 3593 O O . ASN A 1 32 ? -2.547 -1.924 2.425 1.00 0.00 ? 32 ASN A O 9 ATOM 3594 C CB . ASN A 1 32 ? -2.287 0.703 3.272 1.00 0.00 ? 32 ASN A CB 9 ATOM 3595 C CG . ASN A 1 32 ? -2.850 2.098 2.996 1.00 0.00 ? 32 ASN A CG 9 ATOM 3596 O OD1 . ASN A 1 32 ? -2.408 2.809 2.108 1.00 0.00 ? 32 ASN A OD1 9 ATOM 3597 N ND2 . ASN A 1 32 ? -3.846 2.449 3.804 1.00 0.00 ? 32 ASN A ND2 9 ATOM 3598 N N . CYS A 1 33 ? -0.396 -1.933 1.725 1.00 0.00 ? 33 CYS A N 9 ATOM 3599 C CA . CYS A 1 33 ? -0.297 -3.383 1.690 1.00 0.00 ? 33 CYS A CA 9 ATOM 3600 C C . CYS A 1 33 ? -0.556 -3.917 3.099 1.00 0.00 ? 33 CYS A C 9 ATOM 3601 O O . CYS A 1 33 ? -1.617 -3.674 3.674 1.00 0.00 ? 33 CYS A O 9 ATOM 3602 C CB . CYS A 1 33 ? 1.056 -3.843 1.144 1.00 0.00 ? 33 CYS A CB 9 ATOM 3603 S SG . CYS A 1 33 ? 1.036 -5.480 0.325 1.00 0.00 ? 33 CYS A SG 9 ATOM 3604 N N . VAL A 1 34 ? 0.430 -4.634 3.616 1.00 0.00 ? 34 VAL A N 9 ATOM 3605 C CA . VAL A 1 34 ? 0.322 -5.205 4.948 1.00 0.00 ? 34 VAL A CA 9 ATOM 3606 C C . VAL A 1 34 ? 1.707 -5.238 5.598 1.00 0.00 ? 34 VAL A C 9 ATOM 3607 O O . VAL A 1 34 ? 2.586 -4.458 5.235 1.00 0.00 ? 34 VAL A O 9 ATOM 3608 C CB . VAL A 1 34 ? -0.337 -6.584 4.875 1.00 0.00 ? 34 VAL A CB 9 ATOM 3609 C CG1 . VAL A 1 34 ? 0.709 -7.681 4.670 1.00 0.00 ? 34 VAL A CG1 9 ATOM 3610 C CG2 . VAL A 1 34 ? -1.179 -6.857 6.123 1.00 0.00 ? 34 VAL A CG2 9 ATOM 3611 N N . ILE A 1 35 ? 1.858 -6.150 6.548 1.00 0.00 ? 35 ILE A N 9 ATOM 3612 C CA . ILE A 1 35 ? 3.121 -6.294 7.252 1.00 0.00 ? 35 ILE A CA 9 ATOM 3613 C C . ILE A 1 35 ? 4.262 -6.362 6.235 1.00 0.00 ? 35 ILE A C 9 ATOM 3614 O O . ILE A 1 35 ? 4.080 -6.861 5.125 1.00 0.00 ? 35 ILE A O 9 ATOM 3615 C CB . ILE A 1 35 ? 3.071 -7.494 8.201 1.00 0.00 ? 35 ILE A CB 9 ATOM 3616 C CG1 . ILE A 1 35 ? 1.913 -7.361 9.192 1.00 0.00 ? 35 ILE A CG1 9 ATOM 3617 C CG2 . ILE A 1 35 ? 4.413 -7.688 8.909 1.00 0.00 ? 35 ILE A CG2 9 ATOM 3618 C CD1 . ILE A 1 35 ? 1.664 -8.681 9.924 1.00 0.00 ? 35 ILE A CD1 9 ATOM 3619 N N . GLY A 1 36 ? 5.412 -5.853 6.650 1.00 0.00 ? 36 GLY A N 9 ATOM 3620 C CA . GLY A 1 36 ? 6.582 -5.848 5.789 1.00 0.00 ? 36 GLY A CA 9 ATOM 3621 C C . GLY A 1 36 ? 6.183 -5.700 4.319 1.00 0.00 ? 36 GLY A C 9 ATOM 3622 O O . GLY A 1 36 ? 6.772 -6.332 3.445 1.00 0.00 ? 36 GLY A O 9 ATOM 3623 N N . TYR A 1 37 ? 5.182 -4.860 4.094 1.00 0.00 ? 37 TYR A N 9 ATOM 3624 C CA . TYR A 1 37 ? 4.696 -4.620 2.746 1.00 0.00 ? 37 TYR A CA 9 ATOM 3625 C C . TYR A 1 37 ? 3.966 -3.279 2.658 1.00 0.00 ? 37 TYR A C 9 ATOM 3626 O O . TYR A 1 37 ? 3.032 -3.025 3.417 1.00 0.00 ? 37 TYR A O 9 ATOM 3627 C CB . TYR A 1 37 ? 3.705 -5.747 2.448 1.00 0.00 ? 37 TYR A CB 9 ATOM 3628 C CG . TYR A 1 37 ? 4.357 -7.020 1.903 1.00 0.00 ? 37 TYR A CG 9 ATOM 3629 C CD1 . TYR A 1 37 ? 5.143 -6.962 0.771 1.00 0.00 ? 37 TYR A CD1 9 ATOM 3630 C CD2 . TYR A 1 37 ? 4.157 -8.226 2.544 1.00 0.00 ? 37 TYR A CD2 9 ATOM 3631 C CE1 . TYR A 1 37 ? 5.757 -8.159 0.258 1.00 0.00 ? 37 TYR A CE1 9 ATOM 3632 C CE2 . TYR A 1 37 ? 4.770 -9.424 2.031 1.00 0.00 ? 37 TYR A CE2 9 ATOM 3633 C CZ . TYR A 1 37 ? 5.539 -9.331 0.913 1.00 0.00 ? 37 TYR A CZ 9 ATOM 3634 O OH . TYR A 1 37 ? 6.118 -10.463 0.428 1.00 0.00 ? 37 TYR A OH 9 ATOM 3635 N N . SER A 1 38 ? 4.417 -2.455 1.722 1.00 0.00 ? 38 SER A N 9 ATOM 3636 C CA . SER A 1 38 ? 3.818 -1.147 1.525 1.00 0.00 ? 38 SER A CA 9 ATOM 3637 C C . SER A 1 38 ? 4.348 -0.518 0.234 1.00 0.00 ? 38 SER A C 9 ATOM 3638 O O . SER A 1 38 ? 4.860 -1.220 -0.636 1.00 0.00 ? 38 SER A O 9 ATOM 3639 C CB . SER A 1 38 ? 4.098 -0.227 2.716 1.00 0.00 ? 38 SER A CB 9 ATOM 3640 O OG . SER A 1 38 ? 3.890 -0.888 3.961 1.00 0.00 ? 38 SER A OG 9 ATOM 3641 N N . GLY A 1 39 ? 4.204 0.796 0.151 1.00 0.00 ? 39 GLY A N 9 ATOM 3642 C CA . GLY A 1 39 ? 4.661 1.526 -1.019 1.00 0.00 ? 39 GLY A CA 9 ATOM 3643 C C . GLY A 1 39 ? 3.478 2.022 -1.853 1.00 0.00 ? 39 GLY A C 9 ATOM 3644 O O . GLY A 1 39 ? 2.343 2.032 -1.380 1.00 0.00 ? 39 GLY A O 9 ATOM 3645 N N . ASP A 1 40 ? 3.784 2.420 -3.078 1.00 0.00 ? 40 ASP A N 9 ATOM 3646 C CA . ASP A 1 40 ? 2.760 2.916 -3.983 1.00 0.00 ? 40 ASP A CA 9 ATOM 3647 C C . ASP A 1 40 ? 1.757 1.797 -4.272 1.00 0.00 ? 40 ASP A C 9 ATOM 3648 O O . ASP A 1 40 ? 0.680 2.048 -4.810 1.00 0.00 ? 40 ASP A O 9 ATOM 3649 C CB . ASP A 1 40 ? 3.369 3.362 -5.313 1.00 0.00 ? 40 ASP A CB 9 ATOM 3650 C CG . ASP A 1 40 ? 4.348 4.533 -5.216 1.00 0.00 ? 40 ASP A CG 9 ATOM 3651 O OD1 . ASP A 1 40 ? 4.658 5.018 -4.118 1.00 0.00 ? 40 ASP A OD1 9 ATOM 3652 O OD2 . ASP A 1 40 ? 4.806 4.956 -6.346 1.00 0.00 ? 40 ASP A OD2 9 ATOM 3653 N N . ARG A 1 41 ? 2.148 0.585 -3.904 1.00 0.00 ? 41 ARG A N 9 ATOM 3654 C CA . ARG A 1 41 ? 1.297 -0.572 -4.117 1.00 0.00 ? 41 ARG A CA 9 ATOM 3655 C C . ARG A 1 41 ? 1.407 -1.538 -2.936 1.00 0.00 ? 41 ARG A C 9 ATOM 3656 O O . ARG A 1 41 ? 0.617 -1.465 -1.995 1.00 0.00 ? 41 ARG A O 9 ATOM 3657 C CB . ARG A 1 41 ? 1.679 -1.307 -5.404 1.00 0.00 ? 41 ARG A CB 9 ATOM 3658 C CG . ARG A 1 41 ? 1.197 -0.541 -6.637 1.00 0.00 ? 41 ARG A CG 9 ATOM 3659 C CD . ARG A 1 41 ? 2.003 -0.934 -7.877 1.00 0.00 ? 41 ARG A CD 9 ATOM 3660 N NE . ARG A 1 41 ? 1.800 -2.368 -8.179 1.00 0.00 ? 41 ARG A NE 9 ATOM 3661 C CZ . ARG A 1 41 ? 0.885 -2.835 -9.055 1.00 0.00 ? 41 ARG A CZ 9 ATOM 3662 N NH1 . ARG A 1 41 ? -0.382 -3.080 -8.658 1.00 0.00 ? 41 ARG A NH1 9 ATOM 3663 N NH2 . ARG A 1 41 ? 1.248 -3.048 -10.307 1.00 0.00 ? 41 ARG A NH2 9 ATOM 3664 N N . CYS A 1 42 ? 2.392 -2.418 -3.022 1.00 0.00 ? 42 CYS A N 9 ATOM 3665 C CA . CYS A 1 42 ? 2.615 -3.397 -1.970 1.00 0.00 ? 42 CYS A CA 9 ATOM 3666 C C . CYS A 1 42 ? 3.766 -4.309 -2.400 1.00 0.00 ? 42 CYS A C 9 ATOM 3667 O O . CYS A 1 42 ? 3.776 -5.496 -2.077 1.00 0.00 ? 42 CYS A O 9 ATOM 3668 C CB . CYS A 1 42 ? 1.344 -4.190 -1.657 1.00 0.00 ? 42 CYS A CB 9 ATOM 3669 S SG . CYS A 1 42 ? 1.562 -5.535 -0.437 1.00 0.00 ? 42 CYS A SG 9 ATOM 3670 N N . GLN A 1 43 ? 4.708 -3.720 -3.122 1.00 0.00 ? 43 GLN A N 9 ATOM 3671 C CA . GLN A 1 43 ? 5.861 -4.465 -3.598 1.00 0.00 ? 43 GLN A CA 9 ATOM 3672 C C . GLN A 1 43 ? 7.106 -4.090 -2.792 1.00 0.00 ? 43 GLN A C 9 ATOM 3673 O O . GLN A 1 43 ? 8.198 -4.584 -3.066 1.00 0.00 ? 43 GLN A O 9 ATOM 3674 C CB . GLN A 1 43 ? 6.085 -4.230 -5.094 1.00 0.00 ? 43 GLN A CB 9 ATOM 3675 C CG . GLN A 1 43 ? 5.557 -2.858 -5.519 1.00 0.00 ? 43 GLN A CG 9 ATOM 3676 C CD . GLN A 1 43 ? 5.839 -2.597 -7.000 1.00 0.00 ? 43 GLN A CD 9 ATOM 3677 O OE1 . GLN A 1 43 ? 5.452 -3.354 -7.875 1.00 0.00 ? 43 GLN A OE1 9 ATOM 3678 N NE2 . GLN A 1 43 ? 6.534 -1.486 -7.230 1.00 0.00 ? 43 GLN A NE2 9 ATOM 3679 N N . THR A 1 44 ? 6.898 -3.219 -1.816 1.00 0.00 ? 44 THR A N 9 ATOM 3680 C CA . THR A 1 44 ? 7.991 -2.772 -0.967 1.00 0.00 ? 44 THR A CA 9 ATOM 3681 C C . THR A 1 44 ? 7.797 -3.280 0.462 1.00 0.00 ? 44 THR A C 9 ATOM 3682 O O . THR A 1 44 ? 6.742 -3.075 1.060 1.00 0.00 ? 44 THR A O 9 ATOM 3683 C CB . THR A 1 44 ? 8.071 -1.247 -1.066 1.00 0.00 ? 44 THR A CB 9 ATOM 3684 O OG1 . THR A 1 44 ? 8.634 -1.011 -2.353 1.00 0.00 ? 44 THR A OG1 9 ATOM 3685 C CG2 . THR A 1 44 ? 9.095 -0.652 -0.097 1.00 0.00 ? 44 THR A CG2 9 ATOM 3686 N N . ARG A 1 45 ? 8.832 -3.933 0.969 1.00 0.00 ? 45 ARG A N 9 ATOM 3687 C CA . ARG A 1 45 ? 8.790 -4.472 2.318 1.00 0.00 ? 45 ARG A CA 9 ATOM 3688 C C . ARG A 1 45 ? 9.243 -3.413 3.327 1.00 0.00 ? 45 ARG A C 9 ATOM 3689 O O . ARG A 1 45 ? 10.432 -3.120 3.432 1.00 0.00 ? 45 ARG A O 9 ATOM 3690 C CB . ARG A 1 45 ? 9.686 -5.705 2.447 1.00 0.00 ? 45 ARG A CB 9 ATOM 3691 C CG . ARG A 1 45 ? 9.489 -6.652 1.261 1.00 0.00 ? 45 ARG A CG 9 ATOM 3692 C CD . ARG A 1 45 ? 10.404 -7.873 1.376 1.00 0.00 ? 45 ARG A CD 9 ATOM 3693 N NE . ARG A 1 45 ? 9.791 -8.883 2.265 1.00 0.00 ? 45 ARG A NE 9 ATOM 3694 C CZ . ARG A 1 45 ? 10.100 -10.198 2.243 1.00 0.00 ? 45 ARG A CZ 9 ATOM 3695 N NH1 . ARG A 1 45 ? 9.520 -11.023 1.345 1.00 0.00 ? 45 ARG A NH1 9 ATOM 3696 N NH2 . ARG A 1 45 ? 10.977 -10.664 3.113 1.00 0.00 ? 45 ARG A NH2 9 ATOM 3697 N N . ASP A 1 46 ? 8.269 -2.870 4.043 1.00 0.00 ? 46 ASP A N 9 ATOM 3698 C CA . ASP A 1 46 ? 8.553 -1.851 5.039 1.00 0.00 ? 46 ASP A CA 9 ATOM 3699 C C . ASP A 1 46 ? 8.998 -2.524 6.339 1.00 0.00 ? 46 ASP A C 9 ATOM 3700 O O . ASP A 1 46 ? 10.171 -2.465 6.703 1.00 0.00 ? 46 ASP A O 9 ATOM 3701 C CB . ASP A 1 46 ? 7.307 -1.016 5.343 1.00 0.00 ? 46 ASP A CB 9 ATOM 3702 C CG . ASP A 1 46 ? 7.530 0.498 5.348 1.00 0.00 ? 46 ASP A CG 9 ATOM 3703 O OD1 . ASP A 1 46 ? 7.477 1.060 4.188 1.00 0.00 ? 46 ASP A OD1 9 ATOM 3704 O OD2 . ASP A 1 46 ? 7.743 1.109 6.405 1.00 0.00 ? 46 ASP A OD2 9 ATOM 3705 N N . LEU A 1 47 ? 8.037 -3.150 7.003 1.00 0.00 ? 47 LEU A N 9 ATOM 3706 C CA . LEU A 1 47 ? 8.316 -3.834 8.254 1.00 0.00 ? 47 LEU A CA 9 ATOM 3707 C C . LEU A 1 47 ? 8.838 -5.241 7.956 1.00 0.00 ? 47 LEU A C 9 ATOM 3708 O O . LEU A 1 47 ? 9.266 -5.524 6.838 1.00 0.00 ? 47 LEU A O 9 ATOM 3709 C CB . LEU A 1 47 ? 7.084 -3.815 9.161 1.00 0.00 ? 47 LEU A CB 9 ATOM 3710 C CG . LEU A 1 47 ? 6.086 -2.683 8.913 1.00 0.00 ? 47 LEU A CG 9 ATOM 3711 C CD1 . LEU A 1 47 ? 4.889 -3.176 8.096 1.00 0.00 ? 47 LEU A CD1 9 ATOM 3712 C CD2 . LEU A 1 47 ? 5.653 -2.035 10.229 1.00 0.00 ? 47 LEU A CD2 9 ATOM 3713 N N . ARG A 1 48 ? 8.787 -6.086 8.976 1.00 0.00 ? 48 ARG A N 9 ATOM 3714 C CA . ARG A 1 48 ? 9.249 -7.456 8.837 1.00 0.00 ? 48 ARG A CA 9 ATOM 3715 C C . ARG A 1 48 ? 9.074 -8.211 10.156 1.00 0.00 ? 48 ARG A C 9 ATOM 3716 O O . ARG A 1 48 ? 10.045 -8.711 10.723 1.00 0.00 ? 48 ARG A O 9 ATOM 3717 C CB . ARG A 1 48 ? 10.722 -7.501 8.424 1.00 0.00 ? 48 ARG A CB 9 ATOM 3718 C CG . ARG A 1 48 ? 10.969 -8.607 7.397 1.00 0.00 ? 48 ARG A CG 9 ATOM 3719 C CD . ARG A 1 48 ? 12.387 -8.521 6.828 1.00 0.00 ? 48 ARG A CD 9 ATOM 3720 N NE . ARG A 1 48 ? 12.481 -7.395 5.872 1.00 0.00 ? 48 ARG A NE 9 ATOM 3721 C CZ . ARG A 1 48 ? 13.266 -6.311 6.054 1.00 0.00 ? 48 ARG A CZ 9 ATOM 3722 N NH1 . ARG A 1 48 ? 14.545 -6.388 5.737 1.00 0.00 ? 48 ARG A NH1 9 ATOM 3723 N NH2 . ARG A 1 48 ? 12.751 -5.167 6.552 1.00 0.00 ? 48 ARG A NH2 9 ATOM 3724 N N . TRP A 1 49 ? 7.829 -8.271 10.606 1.00 0.00 ? 49 TRP A N 9 ATOM 3725 C CA . TRP A 1 49 ? 7.514 -8.957 11.848 1.00 0.00 ? 49 TRP A CA 9 ATOM 3726 C C . TRP A 1 49 ? 8.027 -10.394 11.737 1.00 0.00 ? 49 TRP A C 9 ATOM 3727 O O . TRP A 1 49 ? 8.556 -10.945 12.701 1.00 0.00 ? 49 TRP A O 9 ATOM 3728 C CB . TRP A 1 49 ? 6.017 -8.879 12.152 1.00 0.00 ? 49 TRP A CB 9 ATOM 3729 C CG . TRP A 1 49 ? 5.593 -7.590 12.860 1.00 0.00 ? 49 TRP A CG 9 ATOM 3730 C CD1 . TRP A 1 49 ? 5.050 -6.492 12.317 1.00 0.00 ? 49 TRP A CD1 9 ATOM 3731 C CD2 . TRP A 1 49 ? 5.699 -7.309 14.271 1.00 0.00 ? 49 TRP A CD2 9 ATOM 3732 N NE1 . TRP A 1 49 ? 4.799 -5.527 13.272 1.00 0.00 ? 49 TRP A NE1 9 ATOM 3733 C CE2 . TRP A 1 49 ? 5.207 -6.040 14.498 1.00 0.00 ? 49 TRP A CE2 9 ATOM 3734 C CE3 . TRP A 1 49 ? 6.195 -8.101 15.321 1.00 0.00 ? 49 TRP A CE3 9 ATOM 3735 C CZ2 . TRP A 1 49 ? 5.163 -5.450 15.767 1.00 0.00 ? 49 TRP A CZ2 9 ATOM 3736 C CZ3 . TRP A 1 49 ? 6.144 -7.497 16.584 1.00 0.00 ? 49 TRP A CZ3 9 ATOM 3737 C CH2 . TRP A 1 49 ? 5.651 -6.221 16.829 1.00 0.00 ? 49 TRP A CH2 9 ATOM 3738 N N . TRP A 1 50 ? 7.853 -10.962 10.551 1.00 0.00 ? 50 TRP A N 9 ATOM 3739 C CA . TRP A 1 50 ? 8.291 -12.323 10.302 1.00 0.00 ? 50 TRP A CA 9 ATOM 3740 C C . TRP A 1 50 ? 9.798 -12.295 10.038 1.00 0.00 ? 50 TRP A C 9 ATOM 3741 O O . TRP A 1 50 ? 10.241 -11.801 9.002 1.00 0.00 ? 50 TRP A O 9 ATOM 3742 C CB . TRP A 1 50 ? 7.496 -12.955 9.158 1.00 0.00 ? 50 TRP A CB 9 ATOM 3743 C CG . TRP A 1 50 ? 7.006 -11.951 8.112 1.00 0.00 ? 50 TRP A CG 9 ATOM 3744 C CD1 . TRP A 1 50 ? 7.703 -10.973 7.517 1.00 0.00 ? 50 TRP A CD1 9 ATOM 3745 C CD2 . TRP A 1 50 ? 5.675 -11.866 7.560 1.00 0.00 ? 50 TRP A CD2 9 ATOM 3746 N NE1 . TRP A 1 50 ? 6.922 -10.267 6.625 1.00 0.00 ? 50 TRP A NE1 9 ATOM 3747 C CE2 . TRP A 1 50 ? 5.650 -10.827 6.652 1.00 0.00 ? 50 TRP A CE2 9 ATOM 3748 C CE3 . TRP A 1 50 ? 4.532 -12.641 7.819 1.00 0.00 ? 50 TRP A CE3 9 ATOM 3749 C CZ2 . TRP A 1 50 ? 4.505 -10.468 5.929 1.00 0.00 ? 50 TRP A CZ2 9 ATOM 3750 C CZ3 . TRP A 1 50 ? 3.396 -12.270 7.089 1.00 0.00 ? 50 TRP A CZ3 9 ATOM 3751 C CH2 . TRP A 1 50 ? 3.354 -11.227 6.171 1.00 0.00 ? 50 TRP A CH2 9 ATOM 3752 N N . GLU A 1 51 ? 10.545 -12.829 10.993 1.00 0.00 ? 51 GLU A N 9 ATOM 3753 C CA . GLU A 1 51 ? 11.993 -12.871 10.876 1.00 0.00 ? 51 GLU A CA 9 ATOM 3754 C C . GLU A 1 51 ? 12.524 -14.227 11.344 1.00 0.00 ? 51 GLU A C 9 ATOM 3755 O O . GLU A 1 51 ? 13.732 -14.404 11.500 1.00 0.00 ? 51 GLU A O 9 ATOM 3756 C CB . GLU A 1 51 ? 12.638 -11.728 11.660 1.00 0.00 ? 51 GLU A CB 9 ATOM 3757 C CG . GLU A 1 51 ? 12.940 -10.537 10.748 1.00 0.00 ? 51 GLU A CG 9 ATOM 3758 C CD . GLU A 1 51 ? 14.350 -10.636 10.164 1.00 0.00 ? 51 GLU A CD 9 ATOM 3759 O OE1 . GLU A 1 51 ? 15.287 -10.179 10.923 1.00 0.00 ? 51 GLU A OE1 9 ATOM 3760 O OE2 . GLU A 1 51 ? 14.522 -11.128 9.038 1.00 0.00 ? 51 GLU A OE2 9 ATOM 3761 N N . LEU A 1 52 ? 11.598 -15.149 11.557 1.00 0.00 ? 52 LEU A N 9 ATOM 3762 C CA . LEU A 1 52 ? 11.957 -16.483 12.004 1.00 0.00 ? 52 LEU A CA 9 ATOM 3763 C C . LEU A 1 52 ? 11.287 -17.519 11.099 1.00 0.00 ? 52 LEU A C 9 ATOM 3764 O O . LEU A 1 52 ? 10.418 -17.178 10.297 1.00 0.00 ? 52 LEU A O 9 ATOM 3765 C CB . LEU A 1 52 ? 11.627 -16.659 13.488 1.00 0.00 ? 52 LEU A CB 9 ATOM 3766 C CG . LEU A 1 52 ? 10.166 -16.436 13.881 1.00 0.00 ? 52 LEU A CG 9 ATOM 3767 C CD1 . LEU A 1 52 ? 9.822 -14.945 13.891 1.00 0.00 ? 52 LEU A CD1 9 ATOM 3768 C CD2 . LEU A 1 52 ? 9.227 -17.233 12.974 1.00 0.00 ? 52 LEU A CD2 9 ATOM 3769 N N . ARG A 1 53 ? 11.715 -18.762 11.257 1.00 0.00 ? 53 ARG A N 9 ATOM 3770 C CA . ARG A 1 53 ? 11.167 -19.850 10.465 1.00 0.00 ? 53 ARG A CA 9 ATOM 3771 C C . ARG A 1 53 ? 9.684 -20.046 10.786 1.00 0.00 ? 53 ARG A C 9 ATOM 3772 O O . ARG A 1 53 ? 8.819 -19.557 10.061 1.00 0.00 ? 53 ARG A O 9 ATOM 3773 C CB . ARG A 1 53 ? 11.916 -21.157 10.730 1.00 0.00 ? 53 ARG A CB 9 ATOM 3774 C CG . ARG A 1 53 ? 11.663 -21.655 12.154 1.00 0.00 ? 53 ARG A CG 9 ATOM 3775 C CD . ARG A 1 53 ? 10.877 -22.967 12.145 1.00 0.00 ? 53 ARG A CD 9 ATOM 3776 N NE . ARG A 1 53 ? 11.772 -24.092 11.794 1.00 0.00 ? 53 ARG A NE 9 ATOM 3777 C CZ . ARG A 1 53 ? 11.743 -24.744 10.612 1.00 0.00 ? 53 ARG A CZ 9 ATOM 3778 N NH1 . ARG A 1 53 ? 10.791 -25.669 10.364 1.00 0.00 ? 53 ARG A NH1 9 ATOM 3779 N NH2 . ARG A 1 53 ? 12.657 -24.462 9.703 1.00 0.00 ? 53 ARG A NH2 9 ATOM 3780 O OXT . ARG A 1 53 ? 9.442 -20.741 11.845 1.00 0.00 ? 53 ARG A OXT 9 ATOM 3781 N N . ASN A 1 1 ? -2.104 16.022 1.492 1.00 0.00 ? 1 ASN A N 10 ATOM 3782 C CA . ASN A 1 1 ? -3.370 15.620 2.081 1.00 0.00 ? 1 ASN A CA 10 ATOM 3783 C C . ASN A 1 1 ? -3.693 14.186 1.652 1.00 0.00 ? 1 ASN A C 10 ATOM 3784 O O . ASN A 1 1 ? -3.137 13.687 0.676 1.00 0.00 ? 1 ASN A O 10 ATOM 3785 C CB . ASN A 1 1 ? -4.510 16.522 1.609 1.00 0.00 ? 1 ASN A CB 10 ATOM 3786 C CG . ASN A 1 1 ? -4.272 17.975 2.032 1.00 0.00 ? 1 ASN A CG 10 ATOM 3787 O OD1 . ASN A 1 1 ? -3.552 18.724 1.392 1.00 0.00 ? 1 ASN A OD1 10 ATOM 3788 N ND2 . ASN A 1 1 ? -4.913 18.325 3.140 1.00 0.00 ? 1 ASN A ND2 10 ATOM 3789 N N . SER A 1 2 ? -4.591 13.566 2.404 1.00 0.00 ? 2 SER A N 10 ATOM 3790 C CA . SER A 1 2 ? -4.995 12.201 2.114 1.00 0.00 ? 2 SER A CA 10 ATOM 3791 C C . SER A 1 2 ? -6.500 12.146 1.844 1.00 0.00 ? 2 SER A C 10 ATOM 3792 O O . SER A 1 2 ? -7.300 12.543 2.691 1.00 0.00 ? 2 SER A O 10 ATOM 3793 C CB . SER A 1 2 ? -4.627 11.261 3.265 1.00 0.00 ? 2 SER A CB 10 ATOM 3794 O OG . SER A 1 2 ? -5.271 11.628 4.481 1.00 0.00 ? 2 SER A OG 10 ATOM 3795 N N . TYR A 1 3 ? -6.839 11.653 0.664 1.00 0.00 ? 3 TYR A N 10 ATOM 3796 C CA . TYR A 1 3 ? -8.234 11.541 0.272 1.00 0.00 ? 3 TYR A CA 10 ATOM 3797 C C . TYR A 1 3 ? -8.552 10.131 -0.229 1.00 0.00 ? 3 TYR A C 10 ATOM 3798 O O . TYR A 1 3 ? -7.766 9.539 -0.967 1.00 0.00 ? 3 TYR A O 10 ATOM 3799 C CB . TYR A 1 3 ? -8.430 12.534 -0.876 1.00 0.00 ? 3 TYR A CB 10 ATOM 3800 C CG . TYR A 1 3 ? -9.764 12.381 -1.609 1.00 0.00 ? 3 TYR A CG 10 ATOM 3801 C CD1 . TYR A 1 3 ? -10.880 13.058 -1.158 1.00 0.00 ? 3 TYR A CD1 10 ATOM 3802 C CD2 . TYR A 1 3 ? -9.854 11.567 -2.721 1.00 0.00 ? 3 TYR A CD2 10 ATOM 3803 C CE1 . TYR A 1 3 ? -12.136 12.914 -1.847 1.00 0.00 ? 3 TYR A CE1 10 ATOM 3804 C CE2 . TYR A 1 3 ? -11.109 11.424 -3.409 1.00 0.00 ? 3 TYR A CE2 10 ATOM 3805 C CZ . TYR A 1 3 ? -12.189 12.105 -2.940 1.00 0.00 ? 3 TYR A CZ 10 ATOM 3806 O OH . TYR A 1 3 ? -13.376 11.970 -3.591 1.00 0.00 ? 3 TYR A OH 10 ATOM 3807 N N . PRO A 1 4 ? -9.736 9.620 0.204 1.00 0.00 ? 4 PRO A N 10 ATOM 3808 C CA . PRO A 1 4 ? -10.167 8.291 -0.193 1.00 0.00 ? 4 PRO A CA 10 ATOM 3809 C C . PRO A 1 4 ? -10.654 8.282 -1.642 1.00 0.00 ? 4 PRO A C 10 ATOM 3810 O O . PRO A 1 4 ? -11.732 8.794 -1.942 1.00 0.00 ? 4 PRO A O 10 ATOM 3811 C CB . PRO A 1 4 ? -11.255 7.917 0.802 1.00 0.00 ? 4 PRO A CB 10 ATOM 3812 C CG . PRO A 1 4 ? -11.715 9.224 1.427 1.00 0.00 ? 4 PRO A CG 10 ATOM 3813 C CD . PRO A 1 4 ? -10.691 10.292 1.080 1.00 0.00 ? 4 PRO A CD 10 ATOM 3814 N N . GLY A 1 5 ? -9.838 7.695 -2.505 1.00 0.00 ? 5 GLY A N 10 ATOM 3815 C CA . GLY A 1 5 ? -10.172 7.612 -3.916 1.00 0.00 ? 5 GLY A CA 10 ATOM 3816 C C . GLY A 1 5 ? -9.250 6.633 -4.642 1.00 0.00 ? 5 GLY A C 10 ATOM 3817 O O . GLY A 1 5 ? -8.123 6.397 -4.208 1.00 0.00 ? 5 GLY A O 10 ATOM 3818 N N . CYS A 1 6 ? -9.763 6.085 -5.735 1.00 0.00 ? 6 CYS A N 10 ATOM 3819 C CA . CYS A 1 6 ? -8.998 5.136 -6.525 1.00 0.00 ? 6 CYS A CA 10 ATOM 3820 C C . CYS A 1 6 ? -9.846 4.722 -7.730 1.00 0.00 ? 6 CYS A C 10 ATOM 3821 O O . CYS A 1 6 ? -10.741 3.887 -7.607 1.00 0.00 ? 6 CYS A O 10 ATOM 3822 C CB . CYS A 1 6 ? -8.563 3.929 -5.693 1.00 0.00 ? 6 CYS A CB 10 ATOM 3823 S SG . CYS A 1 6 ? -6.871 4.042 -5.003 1.00 0.00 ? 6 CYS A SG 10 ATOM 3824 N N . PRO A 1 7 ? -9.525 5.341 -8.897 1.00 0.00 ? 7 PRO A N 10 ATOM 3825 C CA . PRO A 1 7 ? -10.248 5.046 -10.124 1.00 0.00 ? 7 PRO A CA 10 ATOM 3826 C C . PRO A 1 7 ? -9.832 3.688 -10.691 1.00 0.00 ? 7 PRO A C 10 ATOM 3827 O O . PRO A 1 7 ? -9.037 2.972 -10.081 1.00 0.00 ? 7 PRO A O 10 ATOM 3828 C CB . PRO A 1 7 ? -9.927 6.202 -11.057 1.00 0.00 ? 7 PRO A CB 10 ATOM 3829 C CG . PRO A 1 7 ? -8.678 6.860 -10.494 1.00 0.00 ? 7 PRO A CG 10 ATOM 3830 C CD . PRO A 1 7 ? -8.472 6.337 -9.081 1.00 0.00 ? 7 PRO A CD 10 ATOM 3831 N N . SER A 1 8 ? -10.387 3.371 -11.853 1.00 0.00 ? 8 SER A N 10 ATOM 3832 C CA . SER A 1 8 ? -10.085 2.110 -12.509 1.00 0.00 ? 8 SER A CA 10 ATOM 3833 C C . SER A 1 8 ? -8.841 2.263 -13.386 1.00 0.00 ? 8 SER A C 10 ATOM 3834 O O . SER A 1 8 ? -8.560 1.410 -14.226 1.00 0.00 ? 8 SER A O 10 ATOM 3835 C CB . SER A 1 8 ? -11.270 1.628 -13.347 1.00 0.00 ? 8 SER A CB 10 ATOM 3836 O OG . SER A 1 8 ? -11.026 0.349 -13.927 1.00 0.00 ? 8 SER A OG 10 ATOM 3837 N N . SER A 1 9 ? -8.128 3.358 -13.161 1.00 0.00 ? 9 SER A N 10 ATOM 3838 C CA . SER A 1 9 ? -6.920 3.634 -13.920 1.00 0.00 ? 9 SER A CA 10 ATOM 3839 C C . SER A 1 9 ? -5.780 2.733 -13.437 1.00 0.00 ? 9 SER A C 10 ATOM 3840 O O . SER A 1 9 ? -5.019 2.203 -14.245 1.00 0.00 ? 9 SER A O 10 ATOM 3841 C CB . SER A 1 9 ? -6.519 5.104 -13.802 1.00 0.00 ? 9 SER A CB 10 ATOM 3842 O OG . SER A 1 9 ? -7.548 5.977 -14.261 1.00 0.00 ? 9 SER A OG 10 ATOM 3843 N N . TYR A 1 10 ? -5.701 2.586 -12.124 1.00 0.00 ? 10 TYR A N 10 ATOM 3844 C CA . TYR A 1 10 ? -4.668 1.759 -11.522 1.00 0.00 ? 10 TYR A CA 10 ATOM 3845 C C . TYR A 1 10 ? -5.089 0.289 -11.497 1.00 0.00 ? 10 TYR A C 10 ATOM 3846 O O . TYR A 1 10 ? -4.506 -0.540 -12.191 1.00 0.00 ? 10 TYR A O 10 ATOM 3847 C CB . TYR A 1 10 ? -4.510 2.258 -10.084 1.00 0.00 ? 10 TYR A CB 10 ATOM 3848 C CG . TYR A 1 10 ? -4.041 3.711 -9.977 1.00 0.00 ? 10 TYR A CG 10 ATOM 3849 C CD1 . TYR A 1 10 ? -2.718 4.027 -10.215 1.00 0.00 ? 10 TYR A CD1 10 ATOM 3850 C CD2 . TYR A 1 10 ? -4.939 4.704 -9.645 1.00 0.00 ? 10 TYR A CD2 10 ATOM 3851 C CE1 . TYR A 1 10 ? -2.276 5.394 -10.115 1.00 0.00 ? 10 TYR A CE1 10 ATOM 3852 C CE2 . TYR A 1 10 ? -4.497 6.070 -9.545 1.00 0.00 ? 10 TYR A CE2 10 ATOM 3853 C CZ . TYR A 1 10 ? -3.187 6.348 -9.785 1.00 0.00 ? 10 TYR A CZ 10 ATOM 3854 O OH . TYR A 1 10 ? -2.770 7.639 -9.689 1.00 0.00 ? 10 TYR A OH 10 ATOM 3855 N N . ASP A 1 11 ? -6.100 0.011 -10.685 1.00 0.00 ? 11 ASP A N 10 ATOM 3856 C CA . ASP A 1 11 ? -6.607 -1.345 -10.558 1.00 0.00 ? 11 ASP A CA 10 ATOM 3857 C C . ASP A 1 11 ? -5.438 -2.300 -10.312 1.00 0.00 ? 11 ASP A C 10 ATOM 3858 O O . ASP A 1 11 ? -5.026 -3.029 -11.213 1.00 0.00 ? 11 ASP A O 10 ATOM 3859 C CB . ASP A 1 11 ? -7.317 -1.789 -11.839 1.00 0.00 ? 11 ASP A CB 10 ATOM 3860 C CG . ASP A 1 11 ? -8.837 -1.602 -11.834 1.00 0.00 ? 11 ASP A CG 10 ATOM 3861 O OD1 . ASP A 1 11 ? -9.488 -2.464 -11.129 1.00 0.00 ? 11 ASP A OD1 10 ATOM 3862 O OD2 . ASP A 1 11 ? -9.368 -0.681 -12.470 1.00 0.00 ? 11 ASP A OD2 10 ATOM 3863 N N . GLY A 1 12 ? -4.938 -2.267 -9.084 1.00 0.00 ? 12 GLY A N 10 ATOM 3864 C CA . GLY A 1 12 ? -3.824 -3.122 -8.708 1.00 0.00 ? 12 GLY A CA 10 ATOM 3865 C C . GLY A 1 12 ? -2.678 -2.299 -8.115 1.00 0.00 ? 12 GLY A C 10 ATOM 3866 O O . GLY A 1 12 ? -1.508 -2.595 -8.353 1.00 0.00 ? 12 GLY A O 10 ATOM 3867 N N . TYR A 1 13 ? -3.055 -1.281 -7.354 1.00 0.00 ? 13 TYR A N 10 ATOM 3868 C CA . TYR A 1 13 ? -2.074 -0.413 -6.725 1.00 0.00 ? 13 TYR A CA 10 ATOM 3869 C C . TYR A 1 13 ? -1.927 -0.740 -5.238 1.00 0.00 ? 13 TYR A C 10 ATOM 3870 O O . TYR A 1 13 ? -1.063 -0.187 -4.559 1.00 0.00 ? 13 TYR A O 10 ATOM 3871 C CB . TYR A 1 13 ? -2.614 1.010 -6.872 1.00 0.00 ? 13 TYR A CB 10 ATOM 3872 C CG . TYR A 1 13 ? -1.526 2.074 -7.042 1.00 0.00 ? 13 TYR A CG 10 ATOM 3873 C CD1 . TYR A 1 13 ? -0.885 2.217 -8.255 1.00 0.00 ? 13 TYR A CD1 10 ATOM 3874 C CD2 . TYR A 1 13 ? -1.188 2.890 -5.981 1.00 0.00 ? 13 TYR A CD2 10 ATOM 3875 C CE1 . TYR A 1 13 ? 0.138 3.218 -8.413 1.00 0.00 ? 13 TYR A CE1 10 ATOM 3876 C CE2 . TYR A 1 13 ? -0.165 3.890 -6.139 1.00 0.00 ? 13 TYR A CE2 10 ATOM 3877 C CZ . TYR A 1 13 ? 0.448 4.005 -7.348 1.00 0.00 ? 13 TYR A CZ 10 ATOM 3878 O OH . TYR A 1 13 ? 1.414 4.951 -7.499 1.00 0.00 ? 13 TYR A OH 10 ATOM 3879 N N . CYS A 1 14 ? -2.786 -1.635 -4.772 1.00 0.00 ? 14 CYS A N 10 ATOM 3880 C CA . CYS A 1 14 ? -2.763 -2.042 -3.378 1.00 0.00 ? 14 CYS A CA 10 ATOM 3881 C C . CYS A 1 14 ? -2.808 -3.570 -3.322 1.00 0.00 ? 14 CYS A C 10 ATOM 3882 O O . CYS A 1 14 ? -3.825 -4.177 -3.654 1.00 0.00 ? 14 CYS A O 10 ATOM 3883 C CB . CYS A 1 14 ? -3.908 -1.407 -2.586 1.00 0.00 ? 14 CYS A CB 10 ATOM 3884 S SG . CYS A 1 14 ? -4.580 0.134 -3.309 1.00 0.00 ? 14 CYS A SG 10 ATOM 3885 N N . LEU A 1 15 ? -1.696 -4.148 -2.899 1.00 0.00 ? 15 LEU A N 10 ATOM 3886 C CA . LEU A 1 15 ? -1.595 -5.594 -2.794 1.00 0.00 ? 15 LEU A CA 10 ATOM 3887 C C . LEU A 1 15 ? -1.188 -5.972 -1.368 1.00 0.00 ? 15 LEU A C 10 ATOM 3888 O O . LEU A 1 15 ? -0.887 -5.100 -0.554 1.00 0.00 ? 15 LEU A O 10 ATOM 3889 C CB . LEU A 1 15 ? -0.654 -6.145 -3.867 1.00 0.00 ? 15 LEU A CB 10 ATOM 3890 C CG . LEU A 1 15 ? -0.767 -5.503 -5.251 1.00 0.00 ? 15 LEU A CG 10 ATOM 3891 C CD1 . LEU A 1 15 ? -2.173 -5.688 -5.828 1.00 0.00 ? 15 LEU A CD1 10 ATOM 3892 C CD2 . LEU A 1 15 ? -0.354 -4.030 -5.211 1.00 0.00 ? 15 LEU A CD2 10 ATOM 3893 N N . ASN A 1 16 ? -1.193 -7.270 -1.110 1.00 0.00 ? 16 ASN A N 10 ATOM 3894 C CA . ASN A 1 16 ? -0.828 -7.774 0.204 1.00 0.00 ? 16 ASN A CA 10 ATOM 3895 C C . ASN A 1 16 ? -1.663 -7.061 1.268 1.00 0.00 ? 16 ASN A C 10 ATOM 3896 O O . ASN A 1 16 ? -1.133 -6.290 2.066 1.00 0.00 ? 16 ASN A O 10 ATOM 3897 C CB . ASN A 1 16 ? 0.648 -7.509 0.505 1.00 0.00 ? 16 ASN A CB 10 ATOM 3898 C CG . ASN A 1 16 ? 1.544 -8.085 -0.592 1.00 0.00 ? 16 ASN A CG 10 ATOM 3899 O OD1 . ASN A 1 16 ? 1.451 -9.245 -0.959 1.00 0.00 ? 16 ASN A OD1 10 ATOM 3900 N ND2 . ASN A 1 16 ? 2.415 -7.215 -1.094 1.00 0.00 ? 16 ASN A ND2 10 ATOM 3901 N N . GLY A 1 17 ? -2.958 -7.343 1.246 1.00 0.00 ? 17 GLY A N 10 ATOM 3902 C CA . GLY A 1 17 ? -3.873 -6.738 2.199 1.00 0.00 ? 17 GLY A CA 10 ATOM 3903 C C . GLY A 1 17 ? -3.679 -5.221 2.259 1.00 0.00 ? 17 GLY A C 10 ATOM 3904 O O . GLY A 1 17 ? -3.859 -4.609 3.311 1.00 0.00 ? 17 GLY A O 10 ATOM 3905 N N . GLY A 1 18 ? -3.315 -4.657 1.116 1.00 0.00 ? 18 GLY A N 10 ATOM 3906 C CA . GLY A 1 18 ? -3.094 -3.225 1.024 1.00 0.00 ? 18 GLY A CA 10 ATOM 3907 C C . GLY A 1 18 ? -4.409 -2.483 0.775 1.00 0.00 ? 18 GLY A C 10 ATOM 3908 O O . GLY A 1 18 ? -5.384 -3.079 0.324 1.00 0.00 ? 18 GLY A O 10 ATOM 3909 N N . VAL A 1 19 ? -4.388 -1.193 1.077 1.00 0.00 ? 19 VAL A N 10 ATOM 3910 C CA . VAL A 1 19 ? -5.568 -0.363 0.892 1.00 0.00 ? 19 VAL A CA 10 ATOM 3911 C C . VAL A 1 19 ? -5.286 0.678 -0.194 1.00 0.00 ? 19 VAL A C 10 ATOM 3912 O O . VAL A 1 19 ? -4.147 0.828 -0.634 1.00 0.00 ? 19 VAL A O 10 ATOM 3913 C CB . VAL A 1 19 ? -5.984 0.259 2.225 1.00 0.00 ? 19 VAL A CB 10 ATOM 3914 C CG1 . VAL A 1 19 ? -7.277 1.064 2.073 1.00 0.00 ? 19 VAL A CG1 10 ATOM 3915 C CG2 . VAL A 1 19 ? -6.128 -0.811 3.308 1.00 0.00 ? 19 VAL A CG2 10 ATOM 3916 N N . CYS A 1 20 ? -6.342 1.372 -0.592 1.00 0.00 ? 20 CYS A N 10 ATOM 3917 C CA . CYS A 1 20 ? -6.224 2.395 -1.616 1.00 0.00 ? 20 CYS A CA 10 ATOM 3918 C C . CYS A 1 20 ? -6.486 3.756 -0.968 1.00 0.00 ? 20 CYS A C 10 ATOM 3919 O O . CYS A 1 20 ? -7.388 3.892 -0.143 1.00 0.00 ? 20 CYS A O 10 ATOM 3920 C CB . CYS A 1 20 ? -7.166 2.133 -2.792 1.00 0.00 ? 20 CYS A CB 10 ATOM 3921 S SG . CYS A 1 20 ? -6.446 2.461 -4.442 1.00 0.00 ? 20 CYS A SG 10 ATOM 3922 N N . MET A 1 21 ? -5.680 4.731 -1.366 1.00 0.00 ? 21 MET A N 10 ATOM 3923 C CA . MET A 1 21 ? -5.815 6.076 -0.834 1.00 0.00 ? 21 MET A CA 10 ATOM 3924 C C . MET A 1 21 ? -5.283 7.113 -1.827 1.00 0.00 ? 21 MET A C 10 ATOM 3925 O O . MET A 1 21 ? -4.465 6.793 -2.686 1.00 0.00 ? 21 MET A O 10 ATOM 3926 C CB . MET A 1 21 ? -5.040 6.184 0.481 1.00 0.00 ? 21 MET A CB 10 ATOM 3927 C CG . MET A 1 21 ? -5.965 5.976 1.681 1.00 0.00 ? 21 MET A CG 10 ATOM 3928 S SD . MET A 1 21 ? -6.947 7.441 1.958 1.00 0.00 ? 21 MET A SD 10 ATOM 3929 C CE . MET A 1 21 ? -8.032 6.849 3.246 1.00 0.00 ? 21 MET A CE 10 ATOM 3930 N N . HIS A 1 22 ? -5.773 8.335 -1.675 1.00 0.00 ? 22 HIS A N 10 ATOM 3931 C CA . HIS A 1 22 ? -5.357 9.421 -2.545 1.00 0.00 ? 22 HIS A CA 10 ATOM 3932 C C . HIS A 1 22 ? -4.521 10.425 -1.752 1.00 0.00 ? 22 HIS A C 10 ATOM 3933 O O . HIS A 1 22 ? -4.618 10.490 -0.526 1.00 0.00 ? 22 HIS A O 10 ATOM 3934 C CB . HIS A 1 22 ? -6.569 10.065 -3.226 1.00 0.00 ? 22 HIS A CB 10 ATOM 3935 C CG . HIS A 1 22 ? -6.241 10.786 -4.510 1.00 0.00 ? 22 HIS A CG 10 ATOM 3936 N ND1 . HIS A 1 22 ? -6.871 11.955 -4.897 1.00 0.00 ? 22 HIS A ND1 10 ATOM 3937 C CD2 . HIS A 1 22 ? -5.341 10.491 -5.494 1.00 0.00 ? 22 HIS A CD2 10 ATOM 3938 C CE1 . HIS A 1 22 ? -6.367 12.339 -6.060 1.00 0.00 ? 22 HIS A CE1 10 ATOM 3939 N NE2 . HIS A 1 22 ? -5.420 11.428 -6.428 1.00 0.00 ? 22 HIS A NE2 10 ATOM 3940 N N . ILE A 1 23 ? -3.716 11.185 -2.481 1.00 0.00 ? 23 ILE A N 10 ATOM 3941 C CA . ILE A 1 23 ? -2.863 12.183 -1.860 1.00 0.00 ? 23 ILE A CA 10 ATOM 3942 C C . ILE A 1 23 ? -3.375 13.579 -2.219 1.00 0.00 ? 23 ILE A C 10 ATOM 3943 O O . ILE A 1 23 ? -3.045 14.557 -1.547 1.00 0.00 ? 23 ILE A O 10 ATOM 3944 C CB . ILE A 1 23 ? -1.400 11.948 -2.241 1.00 0.00 ? 23 ILE A CB 10 ATOM 3945 C CG1 . ILE A 1 23 ? -1.106 10.455 -2.395 1.00 0.00 ? 23 ILE A CG1 10 ATOM 3946 C CG2 . ILE A 1 23 ? -0.458 12.618 -1.239 1.00 0.00 ? 23 ILE A CG2 10 ATOM 3947 C CD1 . ILE A 1 23 ? -0.398 9.905 -1.154 1.00 0.00 ? 23 ILE A CD1 10 ATOM 3948 N N . GLU A 1 24 ? -4.172 13.630 -3.275 1.00 0.00 ? 24 GLU A N 10 ATOM 3949 C CA . GLU A 1 24 ? -4.733 14.891 -3.731 1.00 0.00 ? 24 GLU A CA 10 ATOM 3950 C C . GLU A 1 24 ? -3.623 15.924 -3.930 1.00 0.00 ? 24 GLU A C 10 ATOM 3951 O O . GLU A 1 24 ? -2.479 15.695 -3.541 1.00 0.00 ? 24 GLU A O 10 ATOM 3952 C CB . GLU A 1 24 ? -5.791 15.405 -2.753 1.00 0.00 ? 24 GLU A CB 10 ATOM 3953 C CG . GLU A 1 24 ? -6.987 15.999 -3.501 1.00 0.00 ? 24 GLU A CG 10 ATOM 3954 C CD . GLU A 1 24 ? -8.118 16.352 -2.535 1.00 0.00 ? 24 GLU A CD 10 ATOM 3955 O OE1 . GLU A 1 24 ? -8.987 15.510 -2.262 1.00 0.00 ? 24 GLU A OE1 10 ATOM 3956 O OE2 . GLU A 1 24 ? -8.075 17.550 -2.059 1.00 0.00 ? 24 GLU A OE2 10 ATOM 3957 N N . SER A 1 25 ? -4.000 17.041 -4.535 1.00 0.00 ? 25 SER A N 10 ATOM 3958 C CA . SER A 1 25 ? -3.050 18.110 -4.792 1.00 0.00 ? 25 SER A CA 10 ATOM 3959 C C . SER A 1 25 ? -2.170 17.754 -5.992 1.00 0.00 ? 25 SER A C 10 ATOM 3960 O O . SER A 1 25 ? -1.641 18.640 -6.663 1.00 0.00 ? 25 SER A O 10 ATOM 3961 C CB . SER A 1 25 ? -2.182 18.383 -3.561 1.00 0.00 ? 25 SER A CB 10 ATOM 3962 O OG . SER A 1 25 ? -0.889 17.796 -3.679 1.00 0.00 ? 25 SER A OG 10 ATOM 3963 N N . LEU A 1 26 ? -2.043 16.457 -6.226 1.00 0.00 ? 26 LEU A N 10 ATOM 3964 C CA . LEU A 1 26 ? -1.237 15.972 -7.335 1.00 0.00 ? 26 LEU A CA 10 ATOM 3965 C C . LEU A 1 26 ? -1.906 14.739 -7.945 1.00 0.00 ? 26 LEU A C 10 ATOM 3966 O O . LEU A 1 26 ? -1.278 13.997 -8.699 1.00 0.00 ? 26 LEU A O 10 ATOM 3967 C CB . LEU A 1 26 ? 0.204 15.730 -6.883 1.00 0.00 ? 26 LEU A CB 10 ATOM 3968 C CG . LEU A 1 26 ? 1.188 16.875 -7.136 1.00 0.00 ? 26 LEU A CG 10 ATOM 3969 C CD1 . LEU A 1 26 ? 2.335 16.846 -6.122 1.00 0.00 ? 26 LEU A CD1 10 ATOM 3970 C CD2 . LEU A 1 26 ? 1.697 16.851 -8.578 1.00 0.00 ? 26 LEU A CD2 10 ATOM 3971 N N . ASP A 1 27 ? -3.171 14.558 -7.597 1.00 0.00 ? 27 ASP A N 10 ATOM 3972 C CA . ASP A 1 27 ? -3.932 13.428 -8.102 1.00 0.00 ? 27 ASP A CA 10 ATOM 3973 C C . ASP A 1 27 ? -3.119 12.147 -7.911 1.00 0.00 ? 27 ASP A C 10 ATOM 3974 O O . ASP A 1 27 ? -3.350 11.152 -8.598 1.00 0.00 ? 27 ASP A O 10 ATOM 3975 C CB . ASP A 1 27 ? -4.226 13.583 -9.595 1.00 0.00 ? 27 ASP A CB 10 ATOM 3976 C CG . ASP A 1 27 ? -5.693 13.395 -9.987 1.00 0.00 ? 27 ASP A CG 10 ATOM 3977 O OD1 . ASP A 1 27 ? -6.541 14.258 -9.723 1.00 0.00 ? 27 ASP A OD1 10 ATOM 3978 O OD2 . ASP A 1 27 ? -5.953 12.291 -10.602 1.00 0.00 ? 27 ASP A OD2 10 ATOM 3979 N N . SER A 1 28 ? -2.186 12.209 -6.973 1.00 0.00 ? 28 SER A N 10 ATOM 3980 C CA . SER A 1 28 ? -1.338 11.065 -6.683 1.00 0.00 ? 28 SER A CA 10 ATOM 3981 C C . SER A 1 28 ? -2.076 10.086 -5.770 1.00 0.00 ? 28 SER A C 10 ATOM 3982 O O . SER A 1 28 ? -2.394 10.415 -4.629 1.00 0.00 ? 28 SER A O 10 ATOM 3983 C CB . SER A 1 28 ? -0.022 11.505 -6.036 1.00 0.00 ? 28 SER A CB 10 ATOM 3984 O OG . SER A 1 28 ? 0.057 12.921 -5.895 1.00 0.00 ? 28 SER A OG 10 ATOM 3985 N N . TYR A 1 29 ? -2.325 8.899 -6.306 1.00 0.00 ? 29 TYR A N 10 ATOM 3986 C CA . TYR A 1 29 ? -3.020 7.869 -5.554 1.00 0.00 ? 29 TYR A CA 10 ATOM 3987 C C . TYR A 1 29 ? -2.030 6.874 -4.945 1.00 0.00 ? 29 TYR A C 10 ATOM 3988 O O . TYR A 1 29 ? -1.183 6.326 -5.647 1.00 0.00 ? 29 TYR A O 10 ATOM 3989 C CB . TYR A 1 29 ? -3.905 7.135 -6.563 1.00 0.00 ? 29 TYR A CB 10 ATOM 3990 C CG . TYR A 1 29 ? -5.156 7.915 -6.976 1.00 0.00 ? 29 TYR A CG 10 ATOM 3991 C CD1 . TYR A 1 29 ? -5.090 8.822 -8.015 1.00 0.00 ? 29 TYR A CD1 10 ATOM 3992 C CD2 . TYR A 1 29 ? -6.347 7.712 -6.311 1.00 0.00 ? 29 TYR A CD2 10 ATOM 3993 C CE1 . TYR A 1 29 ? -6.267 9.557 -8.403 1.00 0.00 ? 29 TYR A CE1 10 ATOM 3994 C CE2 . TYR A 1 29 ? -7.523 8.445 -6.700 1.00 0.00 ? 29 TYR A CE2 10 ATOM 3995 C CZ . TYR A 1 29 ? -7.424 9.331 -7.728 1.00 0.00 ? 29 TYR A CZ 10 ATOM 3996 O OH . TYR A 1 29 ? -8.536 10.024 -8.095 1.00 0.00 ? 29 TYR A OH 10 ATOM 3997 N N . THR A 1 30 ? -2.169 6.673 -3.642 1.00 0.00 ? 30 THR A N 10 ATOM 3998 C CA . THR A 1 30 ? -1.299 5.753 -2.930 1.00 0.00 ? 30 THR A CA 10 ATOM 3999 C C . THR A 1 30 ? -2.043 4.457 -2.600 1.00 0.00 ? 30 THR A C 10 ATOM 4000 O O . THR A 1 30 ? -3.155 4.240 -3.078 1.00 0.00 ? 30 THR A O 10 ATOM 4001 C CB . THR A 1 30 ? -0.759 6.475 -1.692 1.00 0.00 ? 30 THR A CB 10 ATOM 4002 O OG1 . THR A 1 30 ? 0.009 5.482 -1.019 1.00 0.00 ? 30 THR A OG1 10 ATOM 4003 C CG2 . THR A 1 30 ? -1.863 6.833 -0.696 1.00 0.00 ? 30 THR A CG2 10 ATOM 4004 N N . CYS A 1 31 ? -1.400 3.634 -1.786 1.00 0.00 ? 31 CYS A N 10 ATOM 4005 C CA . CYS A 1 31 ? -1.990 2.368 -1.387 1.00 0.00 ? 31 CYS A CA 10 ATOM 4006 C C . CYS A 1 31 ? -1.279 1.884 -0.121 1.00 0.00 ? 31 CYS A C 10 ATOM 4007 O O . CYS A 1 31 ? -0.051 1.868 -0.062 1.00 0.00 ? 31 CYS A O 10 ATOM 4008 C CB . CYS A 1 31 ? -1.916 1.331 -2.511 1.00 0.00 ? 31 CYS A CB 10 ATOM 4009 S SG . CYS A 1 31 ? -3.471 1.109 -3.452 1.00 0.00 ? 31 CYS A SG 10 ATOM 4010 N N . ASN A 1 32 ? -2.083 1.504 0.861 1.00 0.00 ? 32 ASN A N 10 ATOM 4011 C CA . ASN A 1 32 ? -1.547 1.023 2.123 1.00 0.00 ? 32 ASN A CA 10 ATOM 4012 C C . ASN A 1 32 ? -1.096 -0.428 1.960 1.00 0.00 ? 32 ASN A C 10 ATOM 4013 O O . ASN A 1 32 ? -1.572 -1.134 1.074 1.00 0.00 ? 32 ASN A O 10 ATOM 4014 C CB . ASN A 1 32 ? -2.608 1.069 3.226 1.00 0.00 ? 32 ASN A CB 10 ATOM 4015 C CG . ASN A 1 32 ? -1.961 1.042 4.611 1.00 0.00 ? 32 ASN A CG 10 ATOM 4016 O OD1 . ASN A 1 32 ? -0.760 0.887 4.760 1.00 0.00 ? 32 ASN A OD1 10 ATOM 4017 N ND2 . ASN A 1 32 ? -2.820 1.202 5.612 1.00 0.00 ? 32 ASN A ND2 10 ATOM 4018 N N . CYS A 1 33 ? -0.183 -0.832 2.832 1.00 0.00 ? 33 CYS A N 10 ATOM 4019 C CA . CYS A 1 33 ? 0.337 -2.189 2.795 1.00 0.00 ? 33 CYS A CA 10 ATOM 4020 C C . CYS A 1 33 ? 0.023 -2.861 4.134 1.00 0.00 ? 33 CYS A C 10 ATOM 4021 O O . CYS A 1 33 ? -0.972 -2.533 4.777 1.00 0.00 ? 33 CYS A O 10 ATOM 4022 C CB . CYS A 1 33 ? 1.836 -2.211 2.483 1.00 0.00 ? 33 CYS A CB 10 ATOM 4023 S SG . CYS A 1 33 ? 2.385 -3.629 1.465 1.00 0.00 ? 33 CYS A SG 10 ATOM 4024 N N . VAL A 1 34 ? 0.892 -3.785 4.513 1.00 0.00 ? 34 VAL A N 10 ATOM 4025 C CA . VAL A 1 34 ? 0.721 -4.505 5.764 1.00 0.00 ? 34 VAL A CA 10 ATOM 4026 C C . VAL A 1 34 ? 2.071 -5.064 6.216 1.00 0.00 ? 34 VAL A C 10 ATOM 4027 O O . VAL A 1 34 ? 3.118 -4.627 5.741 1.00 0.00 ? 34 VAL A O 10 ATOM 4028 C CB . VAL A 1 34 ? -0.350 -5.587 5.603 1.00 0.00 ? 34 VAL A CB 10 ATOM 4029 C CG1 . VAL A 1 34 ? 0.253 -6.879 5.051 1.00 0.00 ? 34 VAL A CG1 10 ATOM 4030 C CG2 . VAL A 1 34 ? -1.078 -5.842 6.926 1.00 0.00 ? 34 VAL A CG2 10 ATOM 4031 N N . ILE A 1 35 ? 2.003 -6.023 7.129 1.00 0.00 ? 35 ILE A N 10 ATOM 4032 C CA . ILE A 1 35 ? 3.207 -6.646 7.649 1.00 0.00 ? 35 ILE A CA 10 ATOM 4033 C C . ILE A 1 35 ? 3.806 -7.561 6.580 1.00 0.00 ? 35 ILE A C 10 ATOM 4034 O O . ILE A 1 35 ? 3.109 -8.405 6.017 1.00 0.00 ? 35 ILE A O 10 ATOM 4035 C CB . ILE A 1 35 ? 2.913 -7.357 8.973 1.00 0.00 ? 35 ILE A CB 10 ATOM 4036 C CG1 . ILE A 1 35 ? 2.132 -6.446 9.921 1.00 0.00 ? 35 ILE A CG1 10 ATOM 4037 C CG2 . ILE A 1 35 ? 4.202 -7.882 9.611 1.00 0.00 ? 35 ILE A CG2 10 ATOM 4038 C CD1 . ILE A 1 35 ? 1.618 -7.228 11.131 1.00 0.00 ? 35 ILE A CD1 10 ATOM 4039 N N . GLY A 1 36 ? 5.092 -7.366 6.331 1.00 0.00 ? 36 GLY A N 10 ATOM 4040 C CA . GLY A 1 36 ? 5.793 -8.163 5.338 1.00 0.00 ? 36 GLY A CA 10 ATOM 4041 C C . GLY A 1 36 ? 5.717 -7.510 3.956 1.00 0.00 ? 36 GLY A C 10 ATOM 4042 O O . GLY A 1 36 ? 6.127 -8.104 2.962 1.00 0.00 ? 36 GLY A O 10 ATOM 4043 N N . TYR A 1 37 ? 5.188 -6.295 3.941 1.00 0.00 ? 37 TYR A N 10 ATOM 4044 C CA . TYR A 1 37 ? 5.053 -5.555 2.697 1.00 0.00 ? 37 TYR A CA 10 ATOM 4045 C C . TYR A 1 37 ? 4.781 -4.073 2.969 1.00 0.00 ? 37 TYR A C 10 ATOM 4046 O O . TYR A 1 37 ? 4.054 -3.732 3.899 1.00 0.00 ? 37 TYR A O 10 ATOM 4047 C CB . TYR A 1 37 ? 3.847 -6.158 1.976 1.00 0.00 ? 37 TYR A CB 10 ATOM 4048 C CG . TYR A 1 37 ? 3.914 -7.678 1.817 1.00 0.00 ? 37 TYR A CG 10 ATOM 4049 C CD1 . TYR A 1 37 ? 3.468 -8.499 2.833 1.00 0.00 ? 37 TYR A CD1 10 ATOM 4050 C CD2 . TYR A 1 37 ? 4.421 -8.230 0.658 1.00 0.00 ? 37 TYR A CD2 10 ATOM 4051 C CE1 . TYR A 1 37 ? 3.532 -9.929 2.684 1.00 0.00 ? 37 TYR A CE1 10 ATOM 4052 C CE2 . TYR A 1 37 ? 4.485 -9.660 0.508 1.00 0.00 ? 37 TYR A CE2 10 ATOM 4053 C CZ . TYR A 1 37 ? 4.037 -10.440 1.528 1.00 0.00 ? 37 TYR A CZ 10 ATOM 4054 O OH . TYR A 1 37 ? 4.097 -11.791 1.388 1.00 0.00 ? 37 TYR A OH 10 ATOM 4055 N N . SER A 1 38 ? 5.379 -3.232 2.136 1.00 0.00 ? 38 SER A N 10 ATOM 4056 C CA . SER A 1 38 ? 5.210 -1.796 2.274 1.00 0.00 ? 38 SER A CA 10 ATOM 4057 C C . SER A 1 38 ? 5.613 -1.094 0.977 1.00 0.00 ? 38 SER A C 10 ATOM 4058 O O . SER A 1 38 ? 6.273 -1.689 0.126 1.00 0.00 ? 38 SER A O 10 ATOM 4059 C CB . SER A 1 38 ? 6.030 -1.254 3.447 1.00 0.00 ? 38 SER A CB 10 ATOM 4060 O OG . SER A 1 38 ? 5.737 0.113 3.719 1.00 0.00 ? 38 SER A OG 10 ATOM 4061 N N . GLY A 1 39 ? 5.201 0.160 0.866 1.00 0.00 ? 39 GLY A N 10 ATOM 4062 C CA . GLY A 1 39 ? 5.510 0.948 -0.314 1.00 0.00 ? 39 GLY A CA 10 ATOM 4063 C C . GLY A 1 39 ? 4.270 1.684 -0.825 1.00 0.00 ? 39 GLY A C 10 ATOM 4064 O O . GLY A 1 39 ? 3.194 1.576 -0.236 1.00 0.00 ? 39 GLY A O 10 ATOM 4065 N N . ASP A 1 40 ? 4.459 2.414 -1.912 1.00 0.00 ? 40 ASP A N 10 ATOM 4066 C CA . ASP A 1 40 ? 3.369 3.168 -2.508 1.00 0.00 ? 40 ASP A CA 10 ATOM 4067 C C . ASP A 1 40 ? 2.381 2.199 -3.161 1.00 0.00 ? 40 ASP A C 10 ATOM 4068 O O . ASP A 1 40 ? 1.264 2.582 -3.504 1.00 0.00 ? 40 ASP A O 10 ATOM 4069 C CB . ASP A 1 40 ? 3.884 4.118 -3.592 1.00 0.00 ? 40 ASP A CB 10 ATOM 4070 C CG . ASP A 1 40 ? 2.828 5.053 -4.186 1.00 0.00 ? 40 ASP A CG 10 ATOM 4071 O OD1 . ASP A 1 40 ? 2.565 6.099 -3.477 1.00 0.00 ? 40 ASP A OD1 10 ATOM 4072 O OD2 . ASP A 1 40 ? 2.283 4.796 -5.269 1.00 0.00 ? 40 ASP A OD2 10 ATOM 4073 N N . ARG A 1 41 ? 2.828 0.959 -3.311 1.00 0.00 ? 41 ARG A N 10 ATOM 4074 C CA . ARG A 1 41 ? 1.998 -0.068 -3.915 1.00 0.00 ? 41 ARG A CA 10 ATOM 4075 C C . ARG A 1 41 ? 2.139 -1.384 -3.148 1.00 0.00 ? 41 ARG A C 10 ATOM 4076 O O . ARG A 1 41 ? 1.736 -2.438 -3.636 1.00 0.00 ? 41 ARG A O 10 ATOM 4077 C CB . ARG A 1 41 ? 2.382 -0.295 -5.379 1.00 0.00 ? 41 ARG A CB 10 ATOM 4078 C CG . ARG A 1 41 ? 1.151 -0.627 -6.224 1.00 0.00 ? 41 ARG A CG 10 ATOM 4079 C CD . ARG A 1 41 ? 1.557 -1.180 -7.591 1.00 0.00 ? 41 ARG A CD 10 ATOM 4080 N NE . ARG A 1 41 ? 1.904 -2.613 -7.474 1.00 0.00 ? 41 ARG A NE 10 ATOM 4081 C CZ . ARG A 1 41 ? 1.710 -3.522 -8.454 1.00 0.00 ? 41 ARG A CZ 10 ATOM 4082 N NH1 . ARG A 1 41 ? 2.647 -3.716 -9.406 1.00 0.00 ? 41 ARG A NH1 10 ATOM 4083 N NH2 . ARG A 1 41 ? 0.589 -4.219 -8.466 1.00 0.00 ? 41 ARG A NH2 10 ATOM 4084 N N . CYS A 1 42 ? 2.709 -1.278 -1.957 1.00 0.00 ? 42 CYS A N 10 ATOM 4085 C CA . CYS A 1 42 ? 2.907 -2.447 -1.116 1.00 0.00 ? 42 CYS A CA 10 ATOM 4086 C C . CYS A 1 42 ? 3.534 -3.551 -1.969 1.00 0.00 ? 42 CYS A C 10 ATOM 4087 O O . CYS A 1 42 ? 2.865 -4.522 -2.321 1.00 0.00 ? 42 CYS A O 10 ATOM 4088 C CB . CYS A 1 42 ? 1.602 -2.900 -0.461 1.00 0.00 ? 42 CYS A CB 10 ATOM 4089 S SG . CYS A 1 42 ? 1.807 -4.075 0.928 1.00 0.00 ? 42 CYS A SG 10 ATOM 4090 N N . GLN A 1 43 ? 4.808 -3.367 -2.278 1.00 0.00 ? 43 GLN A N 10 ATOM 4091 C CA . GLN A 1 43 ? 5.532 -4.337 -3.084 1.00 0.00 ? 43 GLN A CA 10 ATOM 4092 C C . GLN A 1 43 ? 6.799 -4.790 -2.358 1.00 0.00 ? 43 GLN A C 10 ATOM 4093 O O . GLN A 1 43 ? 7.219 -5.938 -2.493 1.00 0.00 ? 43 GLN A O 10 ATOM 4094 C CB . GLN A 1 43 ? 5.864 -3.764 -4.463 1.00 0.00 ? 43 GLN A CB 10 ATOM 4095 C CG . GLN A 1 43 ? 7.060 -4.490 -5.083 1.00 0.00 ? 43 GLN A CG 10 ATOM 4096 C CD . GLN A 1 43 ? 8.378 -3.964 -4.508 1.00 0.00 ? 43 GLN A CD 10 ATOM 4097 O OE1 . GLN A 1 43 ? 9.026 -4.600 -3.693 1.00 0.00 ? 43 GLN A OE1 10 ATOM 4098 N NE2 . GLN A 1 43 ? 8.736 -2.773 -4.976 1.00 0.00 ? 43 GLN A NE2 10 ATOM 4099 N N . THR A 1 44 ? 7.373 -3.865 -1.602 1.00 0.00 ? 44 THR A N 10 ATOM 4100 C CA . THR A 1 44 ? 8.585 -4.155 -0.855 1.00 0.00 ? 44 THR A CA 10 ATOM 4101 C C . THR A 1 44 ? 8.285 -5.126 0.289 1.00 0.00 ? 44 THR A C 10 ATOM 4102 O O . THR A 1 44 ? 7.705 -4.738 1.302 1.00 0.00 ? 44 THR A O 10 ATOM 4103 C CB . THR A 1 44 ? 9.179 -2.827 -0.383 1.00 0.00 ? 44 THR A CB 10 ATOM 4104 O OG1 . THR A 1 44 ? 9.891 -2.342 -1.519 1.00 0.00 ? 44 THR A OG1 10 ATOM 4105 C CG2 . THR A 1 44 ? 10.260 -3.015 0.682 1.00 0.00 ? 44 THR A CG2 10 ATOM 4106 N N . ARG A 1 45 ? 8.696 -6.370 0.090 1.00 0.00 ? 45 ARG A N 10 ATOM 4107 C CA . ARG A 1 45 ? 8.479 -7.401 1.091 1.00 0.00 ? 45 ARG A CA 10 ATOM 4108 C C . ARG A 1 45 ? 9.444 -7.212 2.263 1.00 0.00 ? 45 ARG A C 10 ATOM 4109 O O . ARG A 1 45 ? 10.651 -7.080 2.063 1.00 0.00 ? 45 ARG A O 10 ATOM 4110 C CB . ARG A 1 45 ? 8.675 -8.797 0.496 1.00 0.00 ? 45 ARG A CB 10 ATOM 4111 C CG . ARG A 1 45 ? 7.391 -9.621 0.601 1.00 0.00 ? 45 ARG A CG 10 ATOM 4112 C CD . ARG A 1 45 ? 7.652 -11.087 0.253 1.00 0.00 ? 45 ARG A CD 10 ATOM 4113 N NE . ARG A 1 45 ? 6.368 -11.800 0.064 1.00 0.00 ? 45 ARG A NE 10 ATOM 4114 C CZ . ARG A 1 45 ? 6.000 -12.403 -1.086 1.00 0.00 ? 45 ARG A CZ 10 ATOM 4115 N NH1 . ARG A 1 45 ? 6.352 -13.682 -1.333 1.00 0.00 ? 45 ARG A NH1 10 ATOM 4116 N NH2 . ARG A 1 45 ? 5.289 -11.724 -1.966 1.00 0.00 ? 45 ARG A NH2 10 ATOM 4117 N N . ASP A 1 46 ? 8.877 -7.205 3.460 1.00 0.00 ? 46 ASP A N 10 ATOM 4118 C CA . ASP A 1 46 ? 9.672 -7.036 4.665 1.00 0.00 ? 46 ASP A CA 10 ATOM 4119 C C . ASP A 1 46 ? 10.588 -8.248 4.841 1.00 0.00 ? 46 ASP A C 10 ATOM 4120 O O . ASP A 1 46 ? 11.083 -8.805 3.862 1.00 0.00 ? 46 ASP A O 10 ATOM 4121 C CB . ASP A 1 46 ? 8.782 -6.934 5.903 1.00 0.00 ? 46 ASP A CB 10 ATOM 4122 C CG . ASP A 1 46 ? 9.334 -6.055 7.027 1.00 0.00 ? 46 ASP A CG 10 ATOM 4123 O OD1 . ASP A 1 46 ? 9.458 -4.831 6.877 1.00 0.00 ? 46 ASP A OD1 10 ATOM 4124 O OD2 . ASP A 1 46 ? 9.647 -6.686 8.107 1.00 0.00 ? 46 ASP A OD2 10 ATOM 4125 N N . LEU A 1 47 ? 10.787 -8.623 6.094 1.00 0.00 ? 47 LEU A N 10 ATOM 4126 C CA . LEU A 1 47 ? 11.636 -9.759 6.412 1.00 0.00 ? 47 LEU A CA 10 ATOM 4127 C C . LEU A 1 47 ? 11.147 -10.409 7.708 1.00 0.00 ? 47 LEU A C 10 ATOM 4128 O O . LEU A 1 47 ? 11.049 -11.633 7.793 1.00 0.00 ? 47 LEU A O 10 ATOM 4129 C CB . LEU A 1 47 ? 13.106 -9.334 6.453 1.00 0.00 ? 47 LEU A CB 10 ATOM 4130 C CG . LEU A 1 47 ? 13.601 -8.515 5.261 1.00 0.00 ? 47 LEU A CG 10 ATOM 4131 C CD1 . LEU A 1 47 ? 14.986 -7.927 5.538 1.00 0.00 ? 47 LEU A CD1 10 ATOM 4132 C CD2 . LEU A 1 47 ? 13.576 -9.344 3.977 1.00 0.00 ? 47 LEU A CD2 10 ATOM 4133 N N . ARG A 1 48 ? 10.854 -9.563 8.683 1.00 0.00 ? 48 ARG A N 10 ATOM 4134 C CA . ARG A 1 48 ? 10.378 -10.041 9.970 1.00 0.00 ? 48 ARG A CA 10 ATOM 4135 C C . ARG A 1 48 ? 9.929 -8.864 10.841 1.00 0.00 ? 48 ARG A C 10 ATOM 4136 O O . ARG A 1 48 ? 10.569 -8.551 11.843 1.00 0.00 ? 48 ARG A O 10 ATOM 4137 C CB . ARG A 1 48 ? 11.466 -10.824 10.705 1.00 0.00 ? 48 ARG A CB 10 ATOM 4138 C CG . ARG A 1 48 ? 11.158 -12.322 10.705 1.00 0.00 ? 48 ARG A CG 10 ATOM 4139 C CD . ARG A 1 48 ? 12.413 -13.139 11.021 1.00 0.00 ? 48 ARG A CD 10 ATOM 4140 N NE . ARG A 1 48 ? 12.188 -14.563 10.681 1.00 0.00 ? 48 ARG A NE 10 ATOM 4141 C CZ . ARG A 1 48 ? 12.575 -15.134 9.519 1.00 0.00 ? 48 ARG A CZ 10 ATOM 4142 N NH1 . ARG A 1 48 ? 11.764 -15.102 8.440 1.00 0.00 ? 48 ARG A NH1 10 ATOM 4143 N NH2 . ARG A 1 48 ? 13.754 -15.723 9.456 1.00 0.00 ? 48 ARG A NH2 10 ATOM 4144 N N . TRP A 1 49 ? 8.835 -8.245 10.425 1.00 0.00 ? 49 TRP A N 10 ATOM 4145 C CA . TRP A 1 49 ? 8.293 -7.110 11.153 1.00 0.00 ? 49 TRP A CA 10 ATOM 4146 C C . TRP A 1 49 ? 7.552 -7.646 12.380 1.00 0.00 ? 49 TRP A C 10 ATOM 4147 O O . TRP A 1 49 ? 7.147 -6.876 13.250 1.00 0.00 ? 49 TRP A O 10 ATOM 4148 C CB . TRP A 1 49 ? 7.410 -6.249 10.251 1.00 0.00 ? 49 TRP A CB 10 ATOM 4149 C CG . TRP A 1 49 ? 6.494 -5.285 11.009 1.00 0.00 ? 49 TRP A CG 10 ATOM 4150 C CD1 . TRP A 1 49 ? 6.548 -3.948 11.038 1.00 0.00 ? 49 TRP A CD1 10 ATOM 4151 C CD2 . TRP A 1 49 ? 5.379 -5.644 11.853 1.00 0.00 ? 49 TRP A CD2 10 ATOM 4152 N NE1 . TRP A 1 49 ? 5.552 -3.420 11.837 1.00 0.00 ? 49 TRP A NE1 10 ATOM 4153 C CE2 . TRP A 1 49 ? 4.821 -4.485 12.347 1.00 0.00 ? 49 TRP A CE2 10 ATOM 4154 C CE3 . TRP A 1 49 ? 4.862 -6.909 12.187 1.00 0.00 ? 49 TRP A CE3 10 ATOM 4155 C CZ2 . TRP A 1 49 ? 3.713 -4.472 13.203 1.00 0.00 ? 49 TRP A CZ2 10 ATOM 4156 C CZ3 . TRP A 1 49 ? 3.755 -6.879 13.043 1.00 0.00 ? 49 TRP A CZ3 10 ATOM 4157 C CH2 . TRP A 1 49 ? 3.180 -5.719 13.551 1.00 0.00 ? 49 TRP A CH2 10 ATOM 4158 N N . TRP A 1 50 ? 7.399 -8.962 12.412 1.00 0.00 ? 50 TRP A N 10 ATOM 4159 C CA . TRP A 1 50 ? 6.713 -9.608 13.517 1.00 0.00 ? 50 TRP A CA 10 ATOM 4160 C C . TRP A 1 50 ? 7.754 -9.946 14.587 1.00 0.00 ? 50 TRP A C 10 ATOM 4161 O O . TRP A 1 50 ? 7.458 -10.660 15.542 1.00 0.00 ? 50 TRP A O 10 ATOM 4162 C CB . TRP A 1 50 ? 5.932 -10.833 13.037 1.00 0.00 ? 50 TRP A CB 10 ATOM 4163 C CG . TRP A 1 50 ? 5.732 -10.888 11.520 1.00 0.00 ? 50 TRP A CG 10 ATOM 4164 C CD1 . TRP A 1 50 ? 6.659 -11.084 10.573 1.00 0.00 ? 50 TRP A CD1 10 ATOM 4165 C CD2 . TRP A 1 50 ? 4.484 -10.736 10.812 1.00 0.00 ? 50 TRP A CD2 10 ATOM 4166 N NE1 . TRP A 1 50 ? 6.102 -11.069 9.310 1.00 0.00 ? 50 TRP A NE1 10 ATOM 4167 C CE2 . TRP A 1 50 ? 4.736 -10.851 9.461 1.00 0.00 ? 50 TRP A CE2 10 ATOM 4168 C CE3 . TRP A 1 50 ? 3.184 -10.509 11.298 1.00 0.00 ? 50 TRP A CE3 10 ATOM 4169 C CZ2 . TRP A 1 50 ? 3.739 -10.754 8.483 1.00 0.00 ? 50 TRP A CZ2 10 ATOM 4170 C CZ3 . TRP A 1 50 ? 2.198 -10.414 10.308 1.00 0.00 ? 50 TRP A CZ3 10 ATOM 4171 C CH2 . TRP A 1 50 ? 2.436 -10.527 8.943 1.00 0.00 ? 50 TRP A CH2 10 ATOM 4172 N N . GLU A 1 51 ? 8.951 -9.414 14.390 1.00 0.00 ? 51 GLU A N 10 ATOM 4173 C CA . GLU A 1 51 ? 10.037 -9.650 15.326 1.00 0.00 ? 51 GLU A CA 10 ATOM 4174 C C . GLU A 1 51 ? 10.731 -8.332 15.677 1.00 0.00 ? 51 GLU A C 10 ATOM 4175 O O . GLU A 1 51 ? 10.914 -8.015 16.851 1.00 0.00 ? 51 GLU A O 10 ATOM 4176 C CB . GLU A 1 51 ? 11.038 -10.661 14.762 1.00 0.00 ? 51 GLU A CB 10 ATOM 4177 C CG . GLU A 1 51 ? 10.388 -12.035 14.589 1.00 0.00 ? 51 GLU A CG 10 ATOM 4178 C CD . GLU A 1 51 ? 11.379 -13.155 14.915 1.00 0.00 ? 51 GLU A CD 10 ATOM 4179 O OE1 . GLU A 1 51 ? 12.476 -13.199 14.340 1.00 0.00 ? 51 GLU A OE1 10 ATOM 4180 O OE2 . GLU A 1 51 ? 10.974 -13.998 15.805 1.00 0.00 ? 51 GLU A OE2 10 ATOM 4181 N N . LEU A 1 52 ? 11.099 -7.597 14.636 1.00 0.00 ? 52 LEU A N 10 ATOM 4182 C CA . LEU A 1 52 ? 11.769 -6.320 14.819 1.00 0.00 ? 52 LEU A CA 10 ATOM 4183 C C . LEU A 1 52 ? 11.032 -5.244 14.019 1.00 0.00 ? 52 LEU A C 10 ATOM 4184 O O . LEU A 1 52 ? 10.485 -5.524 12.954 1.00 0.00 ? 52 LEU A O 10 ATOM 4185 C CB . LEU A 1 52 ? 13.253 -6.439 14.471 1.00 0.00 ? 52 LEU A CB 10 ATOM 4186 C CG . LEU A 1 52 ? 13.580 -6.665 12.994 1.00 0.00 ? 52 LEU A CG 10 ATOM 4187 C CD1 . LEU A 1 52 ? 14.465 -5.541 12.449 1.00 0.00 ? 52 LEU A CD1 10 ATOM 4188 C CD2 . LEU A 1 52 ? 14.207 -8.045 12.775 1.00 0.00 ? 52 LEU A CD2 10 ATOM 4189 N N . ARG A 1 53 ? 11.045 -4.036 14.562 1.00 0.00 ? 53 ARG A N 10 ATOM 4190 C CA . ARG A 1 53 ? 10.386 -2.916 13.911 1.00 0.00 ? 53 ARG A CA 10 ATOM 4191 C C . ARG A 1 53 ? 11.264 -2.365 12.787 1.00 0.00 ? 53 ARG A C 10 ATOM 4192 O O . ARG A 1 53 ? 10.756 -1.916 11.760 1.00 0.00 ? 53 ARG A O 10 ATOM 4193 C CB . ARG A 1 53 ? 10.085 -1.798 14.911 1.00 0.00 ? 53 ARG A CB 10 ATOM 4194 C CG . ARG A 1 53 ? 8.992 -2.220 15.893 1.00 0.00 ? 53 ARG A CG 10 ATOM 4195 C CD . ARG A 1 53 ? 8.776 -1.150 16.967 1.00 0.00 ? 53 ARG A CD 10 ATOM 4196 N NE . ARG A 1 53 ? 8.149 0.048 16.367 1.00 0.00 ? 53 ARG A NE 10 ATOM 4197 C CZ . ARG A 1 53 ? 8.689 1.284 16.403 1.00 0.00 ? 53 ARG A CZ 10 ATOM 4198 N NH1 . ARG A 1 53 ? 9.843 1.494 15.797 1.00 0.00 ? 53 ARG A NH1 10 ATOM 4199 N NH2 . ARG A 1 53 ? 8.060 2.288 17.047 1.00 0.00 ? 53 ARG A NH2 10 ATOM 4200 O OXT . ARG A 1 53 ? 12.534 -2.413 13.012 1.00 0.00 ? 53 ARG A OXT 10 ATOM 4201 N N . ASN A 1 1 ? -2.944 15.680 2.090 1.00 0.00 ? 1 ASN A N 11 ATOM 4202 C CA . ASN A 1 1 ? -4.190 15.127 2.590 1.00 0.00 ? 1 ASN A CA 11 ATOM 4203 C C . ASN A 1 1 ? -4.432 13.759 1.946 1.00 0.00 ? 1 ASN A C 11 ATOM 4204 O O . ASN A 1 1 ? -3.978 13.506 0.831 1.00 0.00 ? 1 ASN A O 11 ATOM 4205 C CB . ASN A 1 1 ? -5.374 16.030 2.238 1.00 0.00 ? 1 ASN A CB 11 ATOM 4206 C CG . ASN A 1 1 ? -5.292 17.359 2.991 1.00 0.00 ? 1 ASN A CG 11 ATOM 4207 O OD1 . ASN A 1 1 ? -5.605 17.458 4.167 1.00 0.00 ? 1 ASN A OD1 11 ATOM 4208 N ND2 . ASN A 1 1 ? -4.852 18.373 2.251 1.00 0.00 ? 1 ASN A ND2 11 ATOM 4209 N N . SER A 1 2 ? -5.144 12.913 2.676 1.00 0.00 ? 2 SER A N 11 ATOM 4210 C CA . SER A 1 2 ? -5.450 11.580 2.189 1.00 0.00 ? 2 SER A CA 11 ATOM 4211 C C . SER A 1 2 ? -6.949 11.458 1.902 1.00 0.00 ? 2 SER A C 11 ATOM 4212 O O . SER A 1 2 ? -7.773 11.636 2.798 1.00 0.00 ? 2 SER A O 11 ATOM 4213 C CB . SER A 1 2 ? -5.017 10.513 3.197 1.00 0.00 ? 2 SER A CB 11 ATOM 4214 O OG . SER A 1 2 ? -5.637 10.695 4.468 1.00 0.00 ? 2 SER A OG 11 ATOM 4215 N N . TYR A 1 3 ? -7.255 11.158 0.648 1.00 0.00 ? 3 TYR A N 11 ATOM 4216 C CA . TYR A 1 3 ? -8.638 11.012 0.230 1.00 0.00 ? 3 TYR A CA 11 ATOM 4217 C C . TYR A 1 3 ? -8.894 9.614 -0.336 1.00 0.00 ? 3 TYR A C 11 ATOM 4218 O O . TYR A 1 3 ? -8.054 9.064 -1.046 1.00 0.00 ? 3 TYR A O 11 ATOM 4219 C CB . TYR A 1 3 ? -8.857 12.046 -0.876 1.00 0.00 ? 3 TYR A CB 11 ATOM 4220 C CG . TYR A 1 3 ? -10.180 11.885 -1.627 1.00 0.00 ? 3 TYR A CG 11 ATOM 4221 C CD1 . TYR A 1 3 ? -11.344 12.399 -1.094 1.00 0.00 ? 3 TYR A CD1 11 ATOM 4222 C CD2 . TYR A 1 3 ? -10.210 11.222 -2.838 1.00 0.00 ? 3 TYR A CD2 11 ATOM 4223 C CE1 . TYR A 1 3 ? -12.589 12.247 -1.800 1.00 0.00 ? 3 TYR A CE1 11 ATOM 4224 C CE2 . TYR A 1 3 ? -11.454 11.069 -3.545 1.00 0.00 ? 3 TYR A CE2 11 ATOM 4225 C CZ . TYR A 1 3 ? -12.582 11.588 -2.991 1.00 0.00 ? 3 TYR A CZ 11 ATOM 4226 O OH . TYR A 1 3 ? -13.758 11.444 -3.659 1.00 0.00 ? 3 TYR A OH 11 ATOM 4227 N N . PRO A 1 4 ? -10.091 9.066 0.006 1.00 0.00 ? 4 PRO A N 11 ATOM 4228 C CA . PRO A 1 4 ? -10.469 7.742 -0.460 1.00 0.00 ? 4 PRO A CA 11 ATOM 4229 C C . PRO A 1 4 ? -10.868 7.774 -1.937 1.00 0.00 ? 4 PRO A C 11 ATOM 4230 O O . PRO A 1 4 ? -11.919 8.311 -2.288 1.00 0.00 ? 4 PRO A O 11 ATOM 4231 C CB . PRO A 1 4 ? -11.606 7.312 0.453 1.00 0.00 ? 4 PRO A CB 11 ATOM 4232 C CG . PRO A 1 4 ? -12.131 8.588 1.093 1.00 0.00 ? 4 PRO A CG 11 ATOM 4233 C CD . PRO A 1 4 ? -11.111 9.687 0.844 1.00 0.00 ? 4 PRO A CD 11 ATOM 4234 N N . GLY A 1 5 ? -10.009 7.197 -2.762 1.00 0.00 ? 5 GLY A N 11 ATOM 4235 C CA . GLY A 1 5 ? -10.260 7.152 -4.194 1.00 0.00 ? 5 GLY A CA 11 ATOM 4236 C C . GLY A 1 5 ? -9.104 6.475 -4.932 1.00 0.00 ? 5 GLY A C 11 ATOM 4237 O O . GLY A 1 5 ? -7.986 6.416 -4.422 1.00 0.00 ? 5 GLY A O 11 ATOM 4238 N N . CYS A 1 6 ? -9.413 5.978 -6.121 1.00 0.00 ? 6 CYS A N 11 ATOM 4239 C CA . CYS A 1 6 ? -8.415 5.305 -6.934 1.00 0.00 ? 6 CYS A CA 11 ATOM 4240 C C . CYS A 1 6 ? -9.130 4.608 -8.094 1.00 0.00 ? 6 CYS A C 11 ATOM 4241 O O . CYS A 1 6 ? -9.968 3.735 -7.875 1.00 0.00 ? 6 CYS A O 11 ATOM 4242 C CB . CYS A 1 6 ? -7.577 4.326 -6.107 1.00 0.00 ? 6 CYS A CB 11 ATOM 4243 S SG . CYS A 1 6 ? -8.548 3.178 -5.065 1.00 0.00 ? 6 CYS A SG 11 ATOM 4244 N N . PRO A 1 7 ? -8.763 5.031 -9.334 1.00 0.00 ? 7 PRO A N 11 ATOM 4245 C CA . PRO A 1 7 ? -9.360 4.457 -10.526 1.00 0.00 ? 7 PRO A CA 11 ATOM 4246 C C . PRO A 1 7 ? -8.801 3.060 -10.802 1.00 0.00 ? 7 PRO A C 11 ATOM 4247 O O . PRO A 1 7 ? -8.014 2.537 -10.014 1.00 0.00 ? 7 PRO A O 11 ATOM 4248 C CB . PRO A 1 7 ? -9.050 5.449 -11.637 1.00 0.00 ? 7 PRO A CB 11 ATOM 4249 C CG . PRO A 1 7 ? -7.903 6.304 -11.125 1.00 0.00 ? 7 PRO A CG 11 ATOM 4250 C CD . PRO A 1 7 ? -7.775 6.065 -9.629 1.00 0.00 ? 7 PRO A CD 11 ATOM 4251 N N . SER A 1 8 ? -9.229 2.496 -11.921 1.00 0.00 ? 8 SER A N 11 ATOM 4252 C CA . SER A 1 8 ? -8.782 1.168 -12.309 1.00 0.00 ? 8 SER A CA 11 ATOM 4253 C C . SER A 1 8 ? -7.468 1.267 -13.086 1.00 0.00 ? 8 SER A C 11 ATOM 4254 O O . SER A 1 8 ? -7.046 0.301 -13.722 1.00 0.00 ? 8 SER A O 11 ATOM 4255 C CB . SER A 1 8 ? -9.843 0.453 -13.146 1.00 0.00 ? 8 SER A CB 11 ATOM 4256 O OG . SER A 1 8 ? -9.506 -0.912 -13.383 1.00 0.00 ? 8 SER A OG 11 ATOM 4257 N N . SER A 1 9 ? -6.860 2.442 -13.013 1.00 0.00 ? 9 SER A N 11 ATOM 4258 C CA . SER A 1 9 ? -5.603 2.676 -13.703 1.00 0.00 ? 9 SER A CA 11 ATOM 4259 C C . SER A 1 9 ? -4.472 1.918 -13.006 1.00 0.00 ? 9 SER A C 11 ATOM 4260 O O . SER A 1 9 ? -3.563 1.413 -13.662 1.00 0.00 ? 9 SER A O 11 ATOM 4261 C CB . SER A 1 9 ? -5.279 4.172 -13.764 1.00 0.00 ? 9 SER A CB 11 ATOM 4262 O OG . SER A 1 9 ? -4.113 4.434 -14.537 1.00 0.00 ? 9 SER A OG 11 ATOM 4263 N N . TYR A 1 10 ? -4.566 1.861 -11.686 1.00 0.00 ? 10 TYR A N 11 ATOM 4264 C CA . TYR A 1 10 ? -3.563 1.172 -10.892 1.00 0.00 ? 10 TYR A CA 11 ATOM 4265 C C . TYR A 1 10 ? -4.037 -0.230 -10.508 1.00 0.00 ? 10 TYR A C 11 ATOM 4266 O O . TYR A 1 10 ? -3.263 -1.027 -9.976 1.00 0.00 ? 10 TYR A O 11 ATOM 4267 C CB . TYR A 1 10 ? -3.385 2.003 -9.621 1.00 0.00 ? 10 TYR A CB 11 ATOM 4268 C CG . TYR A 1 10 ? -3.043 3.473 -9.880 1.00 0.00 ? 10 TYR A CG 11 ATOM 4269 C CD1 . TYR A 1 10 ? -1.782 3.821 -10.315 1.00 0.00 ? 10 TYR A CD1 11 ATOM 4270 C CD2 . TYR A 1 10 ? -3.998 4.449 -9.681 1.00 0.00 ? 10 TYR A CD2 11 ATOM 4271 C CE1 . TYR A 1 10 ? -1.459 5.203 -10.560 1.00 0.00 ? 10 TYR A CE1 11 ATOM 4272 C CE2 . TYR A 1 10 ? -3.678 5.830 -9.925 1.00 0.00 ? 10 TYR A CE2 11 ATOM 4273 C CZ . TYR A 1 10 ? -2.423 6.140 -10.353 1.00 0.00 ? 10 TYR A CZ 11 ATOM 4274 O OH . TYR A 1 10 ? -2.119 7.445 -10.584 1.00 0.00 ? 10 TYR A OH 11 ATOM 4275 N N . ASP A 1 11 ? -5.304 -0.491 -10.791 1.00 0.00 ? 11 ASP A N 11 ATOM 4276 C CA . ASP A 1 11 ? -5.891 -1.785 -10.481 1.00 0.00 ? 11 ASP A CA 11 ATOM 4277 C C . ASP A 1 11 ? -5.861 -2.003 -8.966 1.00 0.00 ? 11 ASP A C 11 ATOM 4278 O O . ASP A 1 11 ? -5.320 -2.998 -8.489 1.00 0.00 ? 11 ASP A O 11 ATOM 4279 C CB . ASP A 1 11 ? -5.101 -2.919 -11.137 1.00 0.00 ? 11 ASP A CB 11 ATOM 4280 C CG . ASP A 1 11 ? -5.788 -4.285 -11.110 1.00 0.00 ? 11 ASP A CG 11 ATOM 4281 O OD1 . ASP A 1 11 ? -6.634 -4.489 -12.064 1.00 0.00 ? 11 ASP A OD1 11 ATOM 4282 O OD2 . ASP A 1 11 ? -5.530 -5.112 -10.224 1.00 0.00 ? 11 ASP A OD2 11 ATOM 4283 N N . GLY A 1 12 ? -6.451 -1.055 -8.253 1.00 0.00 ? 12 GLY A N 11 ATOM 4284 C CA . GLY A 1 12 ? -6.500 -1.131 -6.803 1.00 0.00 ? 12 GLY A CA 11 ATOM 4285 C C . GLY A 1 12 ? -5.262 -0.483 -6.178 1.00 0.00 ? 12 GLY A C 11 ATOM 4286 O O . GLY A 1 12 ? -5.336 0.075 -5.085 1.00 0.00 ? 12 GLY A O 11 ATOM 4287 N N . TYR A 1 13 ? -4.154 -0.582 -6.899 1.00 0.00 ? 13 TYR A N 11 ATOM 4288 C CA . TYR A 1 13 ? -2.903 -0.014 -6.427 1.00 0.00 ? 13 TYR A CA 11 ATOM 4289 C C . TYR A 1 13 ? -2.501 -0.613 -5.080 1.00 0.00 ? 13 TYR A C 11 ATOM 4290 O O . TYR A 1 13 ? -1.616 -0.092 -4.404 1.00 0.00 ? 13 TYR A O 11 ATOM 4291 C CB . TYR A 1 13 ? -3.160 1.484 -6.250 1.00 0.00 ? 13 TYR A CB 11 ATOM 4292 C CG . TYR A 1 13 ? -1.995 2.373 -6.689 1.00 0.00 ? 13 TYR A CG 11 ATOM 4293 C CD1 . TYR A 1 13 ? -0.695 1.966 -6.464 1.00 0.00 ? 13 TYR A CD1 11 ATOM 4294 C CD2 . TYR A 1 13 ? -2.243 3.580 -7.310 1.00 0.00 ? 13 TYR A CD2 11 ATOM 4295 C CE1 . TYR A 1 13 ? 0.402 2.801 -6.877 1.00 0.00 ? 13 TYR A CE1 11 ATOM 4296 C CE2 . TYR A 1 13 ? -1.146 4.415 -7.723 1.00 0.00 ? 13 TYR A CE2 11 ATOM 4297 C CZ . TYR A 1 13 ? 0.122 3.985 -7.486 1.00 0.00 ? 13 TYR A CZ 11 ATOM 4298 O OH . TYR A 1 13 ? 1.159 4.776 -7.875 1.00 0.00 ? 13 TYR A OH 11 ATOM 4299 N N . CYS A 1 14 ? -3.172 -1.700 -4.728 1.00 0.00 ? 14 CYS A N 11 ATOM 4300 C CA . CYS A 1 14 ? -2.895 -2.376 -3.472 1.00 0.00 ? 14 CYS A CA 11 ATOM 4301 C C . CYS A 1 14 ? -2.866 -3.884 -3.733 1.00 0.00 ? 14 CYS A C 11 ATOM 4302 O O . CYS A 1 14 ? -3.856 -4.458 -4.188 1.00 0.00 ? 14 CYS A O 11 ATOM 4303 C CB . CYS A 1 14 ? -3.914 -2.003 -2.393 1.00 0.00 ? 14 CYS A CB 11 ATOM 4304 S SG . CYS A 1 14 ? -4.503 -0.272 -2.458 1.00 0.00 ? 14 CYS A SG 11 ATOM 4305 N N . LEU A 1 15 ? -1.722 -4.482 -3.434 1.00 0.00 ? 15 LEU A N 11 ATOM 4306 C CA . LEU A 1 15 ? -1.550 -5.911 -3.633 1.00 0.00 ? 15 LEU A CA 11 ATOM 4307 C C . LEU A 1 15 ? -1.240 -6.572 -2.288 1.00 0.00 ? 15 LEU A C 11 ATOM 4308 O O . LEU A 1 15 ? -1.103 -5.892 -1.275 1.00 0.00 ? 15 LEU A O 11 ATOM 4309 C CB . LEU A 1 15 ? -0.500 -6.182 -4.710 1.00 0.00 ? 15 LEU A CB 11 ATOM 4310 C CG . LEU A 1 15 ? -1.003 -6.171 -6.155 1.00 0.00 ? 15 LEU A CG 11 ATOM 4311 C CD1 . LEU A 1 15 ? -1.294 -7.592 -6.643 1.00 0.00 ? 15 LEU A CD1 11 ATOM 4312 C CD2 . LEU A 1 15 ? -2.216 -5.251 -6.307 1.00 0.00 ? 15 LEU A CD2 11 ATOM 4313 N N . ASN A 1 16 ? -1.134 -7.893 -2.327 1.00 0.00 ? 16 ASN A N 11 ATOM 4314 C CA . ASN A 1 16 ? -0.841 -8.655 -1.125 1.00 0.00 ? 16 ASN A CA 11 ATOM 4315 C C . ASN A 1 16 ? -2.006 -8.521 -0.142 1.00 0.00 ? 16 ASN A C 11 ATOM 4316 O O . ASN A 1 16 ? -2.626 -9.516 0.231 1.00 0.00 ? 16 ASN A O 11 ATOM 4317 C CB . ASN A 1 16 ? 0.421 -8.132 -0.436 1.00 0.00 ? 16 ASN A CB 11 ATOM 4318 C CG . ASN A 1 16 ? 1.671 -8.475 -1.245 1.00 0.00 ? 16 ASN A CG 11 ATOM 4319 O OD1 . ASN A 1 16 ? 2.077 -9.621 -1.354 1.00 0.00 ? 16 ASN A OD1 11 ATOM 4320 N ND2 . ASN A 1 16 ? 2.258 -7.422 -1.809 1.00 0.00 ? 16 ASN A ND2 11 ATOM 4321 N N . GLY A 1 17 ? -2.271 -7.283 0.246 1.00 0.00 ? 17 GLY A N 11 ATOM 4322 C CA . GLY A 1 17 ? -3.351 -7.005 1.177 1.00 0.00 ? 17 GLY A CA 11 ATOM 4323 C C . GLY A 1 17 ? -3.250 -5.581 1.726 1.00 0.00 ? 17 GLY A C 11 ATOM 4324 O O . GLY A 1 17 ? -2.822 -5.377 2.861 1.00 0.00 ? 17 GLY A O 11 ATOM 4325 N N . GLY A 1 18 ? -3.651 -4.629 0.895 1.00 0.00 ? 18 GLY A N 11 ATOM 4326 C CA . GLY A 1 18 ? -3.610 -3.229 1.283 1.00 0.00 ? 18 GLY A CA 11 ATOM 4327 C C . GLY A 1 18 ? -4.871 -2.495 0.820 1.00 0.00 ? 18 GLY A C 11 ATOM 4328 O O . GLY A 1 18 ? -5.529 -2.922 -0.127 1.00 0.00 ? 18 GLY A O 11 ATOM 4329 N N . VAL A 1 19 ? -5.168 -1.405 1.511 1.00 0.00 ? 19 VAL A N 11 ATOM 4330 C CA . VAL A 1 19 ? -6.337 -0.606 1.183 1.00 0.00 ? 19 VAL A CA 11 ATOM 4331 C C . VAL A 1 19 ? -5.940 0.487 0.189 1.00 0.00 ? 19 VAL A C 11 ATOM 4332 O O . VAL A 1 19 ? -4.767 0.842 0.087 1.00 0.00 ? 19 VAL A O 11 ATOM 4333 C CB . VAL A 1 19 ? -6.968 -0.053 2.462 1.00 0.00 ? 19 VAL A CB 11 ATOM 4334 C CG1 . VAL A 1 19 ? -8.445 0.280 2.245 1.00 0.00 ? 19 VAL A CG1 11 ATOM 4335 C CG2 . VAL A 1 19 ? -6.791 -1.029 3.628 1.00 0.00 ? 19 VAL A CG2 11 ATOM 4336 N N . CYS A 1 20 ? -6.941 0.992 -0.518 1.00 0.00 ? 20 CYS A N 11 ATOM 4337 C CA . CYS A 1 20 ? -6.713 2.038 -1.499 1.00 0.00 ? 20 CYS A CA 11 ATOM 4338 C C . CYS A 1 20 ? -6.867 3.392 -0.803 1.00 0.00 ? 20 CYS A C 11 ATOM 4339 O O . CYS A 1 20 ? -7.735 3.557 0.054 1.00 0.00 ? 20 CYS A O 11 ATOM 4340 C CB . CYS A 1 20 ? -7.650 1.903 -2.699 1.00 0.00 ? 20 CYS A CB 11 ATOM 4341 S SG . CYS A 1 20 ? -6.893 2.308 -4.315 1.00 0.00 ? 20 CYS A SG 11 ATOM 4342 N N . MET A 1 21 ? -6.013 4.325 -1.195 1.00 0.00 ? 21 MET A N 11 ATOM 4343 C CA . MET A 1 21 ? -6.044 5.660 -0.621 1.00 0.00 ? 21 MET A CA 11 ATOM 4344 C C . MET A 1 21 ? -5.429 6.683 -1.575 1.00 0.00 ? 21 MET A C 11 ATOM 4345 O O . MET A 1 21 ? -4.313 6.492 -2.062 1.00 0.00 ? 21 MET A O 11 ATOM 4346 C CB . MET A 1 21 ? -5.273 5.663 0.701 1.00 0.00 ? 21 MET A CB 11 ATOM 4347 C CG . MET A 1 21 ? -5.962 6.553 1.736 1.00 0.00 ? 21 MET A CG 11 ATOM 4348 S SD . MET A 1 21 ? -7.339 5.685 2.468 1.00 0.00 ? 21 MET A SD 11 ATOM 4349 C CE . MET A 1 21 ? -7.977 6.960 3.541 1.00 0.00 ? 21 MET A CE 11 ATOM 4350 N N . HIS A 1 22 ? -6.180 7.747 -1.816 1.00 0.00 ? 22 HIS A N 11 ATOM 4351 C CA . HIS A 1 22 ? -5.721 8.801 -2.705 1.00 0.00 ? 22 HIS A CA 11 ATOM 4352 C C . HIS A 1 22 ? -5.055 9.909 -1.888 1.00 0.00 ? 22 HIS A C 11 ATOM 4353 O O . HIS A 1 22 ? -5.429 10.149 -0.740 1.00 0.00 ? 22 HIS A O 11 ATOM 4354 C CB . HIS A 1 22 ? -6.869 9.317 -3.576 1.00 0.00 ? 22 HIS A CB 11 ATOM 4355 C CG . HIS A 1 22 ? -6.432 10.247 -4.681 1.00 0.00 ? 22 HIS A CG 11 ATOM 4356 N ND1 . HIS A 1 22 ? -7.125 11.401 -5.008 1.00 0.00 ? 22 HIS A ND1 11 ATOM 4357 C CD2 . HIS A 1 22 ? -5.367 10.184 -5.530 1.00 0.00 ? 22 HIS A CD2 11 ATOM 4358 C CE1 . HIS A 1 22 ? -6.495 11.996 -6.011 1.00 0.00 ? 22 HIS A CE1 11 ATOM 4359 N NE2 . HIS A 1 22 ? -5.407 11.240 -6.335 1.00 0.00 ? 22 HIS A NE2 11 ATOM 4360 N N . ILE A 1 23 ? -4.077 10.554 -2.508 1.00 0.00 ? 23 ILE A N 11 ATOM 4361 C CA . ILE A 1 23 ? -3.355 11.630 -1.851 1.00 0.00 ? 23 ILE A CA 11 ATOM 4362 C C . ILE A 1 23 ? -3.687 12.956 -2.541 1.00 0.00 ? 23 ILE A C 11 ATOM 4363 O O . ILE A 1 23 ? -4.247 12.967 -3.635 1.00 0.00 ? 23 ILE A O 11 ATOM 4364 C CB . ILE A 1 23 ? -1.859 11.320 -1.803 1.00 0.00 ? 23 ILE A CB 11 ATOM 4365 C CG1 . ILE A 1 23 ? -1.597 9.836 -2.078 1.00 0.00 ? 23 ILE A CG1 11 ATOM 4366 C CG2 . ILE A 1 23 ? -1.246 11.773 -0.477 1.00 0.00 ? 23 ILE A CG2 11 ATOM 4367 C CD1 . ILE A 1 23 ? -0.097 9.558 -2.199 1.00 0.00 ? 23 ILE A CD1 11 ATOM 4368 N N . GLU A 1 24 ? -3.327 14.040 -1.870 1.00 0.00 ? 24 GLU A N 11 ATOM 4369 C CA . GLU A 1 24 ? -3.580 15.369 -2.405 1.00 0.00 ? 24 GLU A CA 11 ATOM 4370 C C . GLU A 1 24 ? -2.260 16.100 -2.650 1.00 0.00 ? 24 GLU A C 11 ATOM 4371 O O . GLU A 1 24 ? -1.185 15.542 -2.431 1.00 0.00 ? 24 GLU A O 11 ATOM 4372 C CB . GLU A 1 24 ? -4.485 16.171 -1.469 1.00 0.00 ? 24 GLU A CB 11 ATOM 4373 C CG . GLU A 1 24 ? -5.957 15.824 -1.700 1.00 0.00 ? 24 GLU A CG 11 ATOM 4374 C CD . GLU A 1 24 ? -6.875 16.820 -0.986 1.00 0.00 ? 24 GLU A CD 11 ATOM 4375 O OE1 . GLU A 1 24 ? -7.136 17.893 -1.652 1.00 0.00 ? 24 GLU A OE1 11 ATOM 4376 O OE2 . GLU A 1 24 ? -7.304 16.563 0.148 1.00 0.00 ? 24 GLU A OE2 11 ATOM 4377 N N . SER A 1 25 ? -2.383 17.338 -3.105 1.00 0.00 ? 25 SER A N 11 ATOM 4378 C CA . SER A 1 25 ? -1.212 18.154 -3.384 1.00 0.00 ? 25 SER A CA 11 ATOM 4379 C C . SER A 1 25 ? -0.746 17.923 -4.824 1.00 0.00 ? 25 SER A C 11 ATOM 4380 O O . SER A 1 25 ? -0.183 18.820 -5.448 1.00 0.00 ? 25 SER A O 11 ATOM 4381 C CB . SER A 1 25 ? -0.078 17.845 -2.404 1.00 0.00 ? 25 SER A CB 11 ATOM 4382 O OG . SER A 1 25 ? 0.831 18.933 -2.280 1.00 0.00 ? 25 SER A OG 11 ATOM 4383 N N . LEU A 1 26 ? -0.999 16.717 -5.307 1.00 0.00 ? 26 LEU A N 11 ATOM 4384 C CA . LEU A 1 26 ? -0.612 16.356 -6.661 1.00 0.00 ? 26 LEU A CA 11 ATOM 4385 C C . LEU A 1 26 ? -1.567 15.287 -7.194 1.00 0.00 ? 26 LEU A C 11 ATOM 4386 O O . LEU A 1 26 ? -1.255 14.597 -8.162 1.00 0.00 ? 26 LEU A O 11 ATOM 4387 C CB . LEU A 1 26 ? 0.861 15.943 -6.706 1.00 0.00 ? 26 LEU A CB 11 ATOM 4388 C CG . LEU A 1 26 ? 1.779 16.828 -7.551 1.00 0.00 ? 26 LEU A CG 11 ATOM 4389 C CD1 . LEU A 1 26 ? 3.236 16.690 -7.102 1.00 0.00 ? 26 LEU A CD1 11 ATOM 4390 C CD2 . LEU A 1 26 ? 1.609 16.529 -9.042 1.00 0.00 ? 26 LEU A CD2 11 ATOM 4391 N N . ASP A 1 27 ? -2.713 15.182 -6.536 1.00 0.00 ? 27 ASP A N 11 ATOM 4392 C CA . ASP A 1 27 ? -3.716 14.209 -6.930 1.00 0.00 ? 27 ASP A CA 11 ATOM 4393 C C . ASP A 1 27 ? -3.052 12.841 -7.107 1.00 0.00 ? 27 ASP A C 11 ATOM 4394 O O . ASP A 1 27 ? -3.400 12.090 -8.016 1.00 0.00 ? 27 ASP A O 11 ATOM 4395 C CB . ASP A 1 27 ? -4.365 14.594 -8.261 1.00 0.00 ? 27 ASP A CB 11 ATOM 4396 C CG . ASP A 1 27 ? -5.413 15.704 -8.172 1.00 0.00 ? 27 ASP A CG 11 ATOM 4397 O OD1 . ASP A 1 27 ? -6.599 15.311 -7.852 1.00 0.00 ? 27 ASP A OD1 11 ATOM 4398 O OD2 . ASP A 1 27 ? -5.111 16.888 -8.397 1.00 0.00 ? 27 ASP A OD2 11 ATOM 4399 N N . SER A 1 28 ? -2.106 12.559 -6.222 1.00 0.00 ? 28 SER A N 11 ATOM 4400 C CA . SER A 1 28 ? -1.390 11.296 -6.267 1.00 0.00 ? 28 SER A CA 11 ATOM 4401 C C . SER A 1 28 ? -2.192 10.214 -5.542 1.00 0.00 ? 28 SER A C 11 ATOM 4402 O O . SER A 1 28 ? -2.999 10.517 -4.665 1.00 0.00 ? 28 SER A O 11 ATOM 4403 C CB . SER A 1 28 ? 0.003 11.430 -5.650 1.00 0.00 ? 28 SER A CB 11 ATOM 4404 O OG . SER A 1 28 ? 0.494 10.182 -5.166 1.00 0.00 ? 28 SER A OG 11 ATOM 4405 N N . TYR A 1 29 ? -1.942 8.974 -5.936 1.00 0.00 ? 29 TYR A N 11 ATOM 4406 C CA . TYR A 1 29 ? -2.630 7.845 -5.334 1.00 0.00 ? 29 TYR A CA 11 ATOM 4407 C C . TYR A 1 29 ? -1.651 6.947 -4.574 1.00 0.00 ? 29 TYR A C 11 ATOM 4408 O O . TYR A 1 29 ? -0.510 6.769 -4.998 1.00 0.00 ? 29 TYR A O 11 ATOM 4409 C CB . TYR A 1 29 ? -3.235 7.052 -6.495 1.00 0.00 ? 29 TYR A CB 11 ATOM 4410 C CG . TYR A 1 29 ? -4.444 7.726 -7.147 1.00 0.00 ? 29 TYR A CG 11 ATOM 4411 C CD1 . TYR A 1 29 ? -5.696 7.594 -6.582 1.00 0.00 ? 29 TYR A CD1 11 ATOM 4412 C CD2 . TYR A 1 29 ? -4.281 8.468 -8.299 1.00 0.00 ? 29 TYR A CD2 11 ATOM 4413 C CE1 . TYR A 1 29 ? -6.833 8.229 -7.197 1.00 0.00 ? 29 TYR A CE1 11 ATOM 4414 C CE2 . TYR A 1 29 ? -5.419 9.103 -8.914 1.00 0.00 ? 29 TYR A CE2 11 ATOM 4415 C CZ . TYR A 1 29 ? -6.639 8.952 -8.331 1.00 0.00 ? 29 TYR A CZ 11 ATOM 4416 O OH . TYR A 1 29 ? -7.712 9.553 -8.910 1.00 0.00 ? 29 TYR A OH 11 ATOM 4417 N N . THR A 1 30 ? -2.133 6.406 -3.465 1.00 0.00 ? 30 THR A N 11 ATOM 4418 C CA . THR A 1 30 ? -1.314 5.532 -2.642 1.00 0.00 ? 30 THR A CA 11 ATOM 4419 C C . THR A 1 30 ? -2.119 4.307 -2.202 1.00 0.00 ? 30 THR A C 11 ATOM 4420 O O . THR A 1 30 ? -3.271 4.140 -2.600 1.00 0.00 ? 30 THR A O 11 ATOM 4421 C CB . THR A 1 30 ? -0.771 6.356 -1.473 1.00 0.00 ? 30 THR A CB 11 ATOM 4422 O OG1 . THR A 1 30 ? 0.000 5.423 -0.721 1.00 0.00 ? 30 THR A OG1 11 ATOM 4423 C CG2 . THR A 1 30 ? -1.872 6.795 -0.506 1.00 0.00 ? 30 THR A CG2 11 ATOM 4424 N N . CYS A 1 31 ? -1.481 3.483 -1.385 1.00 0.00 ? 31 CYS A N 11 ATOM 4425 C CA . CYS A 1 31 ? -2.121 2.278 -0.885 1.00 0.00 ? 31 CYS A CA 11 ATOM 4426 C C . CYS A 1 31 ? -1.446 1.883 0.428 1.00 0.00 ? 31 CYS A C 11 ATOM 4427 O O . CYS A 1 31 ? -0.232 1.690 0.473 1.00 0.00 ? 31 CYS A O 11 ATOM 4428 C CB . CYS A 1 31 ? -2.078 1.146 -1.914 1.00 0.00 ? 31 CYS A CB 11 ATOM 4429 S SG . CYS A 1 31 ? -3.664 0.818 -2.764 1.00 0.00 ? 31 CYS A SG 11 ATOM 4430 N N . ASN A 1 32 ? -2.262 1.774 1.467 1.00 0.00 ? 32 ASN A N 11 ATOM 4431 C CA . ASN A 1 32 ? -1.757 1.407 2.780 1.00 0.00 ? 32 ASN A CA 11 ATOM 4432 C C . ASN A 1 32 ? -1.505 -0.103 2.819 1.00 0.00 ? 32 ASN A C 11 ATOM 4433 O O . ASN A 1 32 ? -2.449 -0.893 2.825 1.00 0.00 ? 32 ASN A O 11 ATOM 4434 C CB . ASN A 1 32 ? -2.770 1.746 3.875 1.00 0.00 ? 32 ASN A CB 11 ATOM 4435 C CG . ASN A 1 32 ? -4.167 1.239 3.506 1.00 0.00 ? 32 ASN A CG 11 ATOM 4436 O OD1 . ASN A 1 32 ? -4.409 0.750 2.415 1.00 0.00 ? 32 ASN A OD1 11 ATOM 4437 N ND2 . ASN A 1 32 ? -5.067 1.384 4.474 1.00 0.00 ? 32 ASN A ND2 11 ATOM 4438 N N . CYS A 1 33 ? -0.231 -0.457 2.844 1.00 0.00 ? 33 CYS A N 11 ATOM 4439 C CA . CYS A 1 33 ? 0.157 -1.858 2.883 1.00 0.00 ? 33 CYS A CA 11 ATOM 4440 C C . CYS A 1 33 ? -0.015 -2.363 4.318 1.00 0.00 ? 33 CYS A C 11 ATOM 4441 O O . CYS A 1 33 ? -0.929 -1.942 5.023 1.00 0.00 ? 33 CYS A O 11 ATOM 4442 C CB . CYS A 1 33 ? 1.584 -2.064 2.373 1.00 0.00 ? 33 CYS A CB 11 ATOM 4443 S SG . CYS A 1 33 ? 1.990 -1.148 0.842 1.00 0.00 ? 33 CYS A SG 11 ATOM 4444 N N . VAL A 1 34 ? 0.880 -3.261 4.705 1.00 0.00 ? 34 VAL A N 11 ATOM 4445 C CA . VAL A 1 34 ? 0.840 -3.829 6.042 1.00 0.00 ? 34 VAL A CA 11 ATOM 4446 C C . VAL A 1 34 ? 2.268 -4.068 6.534 1.00 0.00 ? 34 VAL A C 11 ATOM 4447 O O . VAL A 1 34 ? 3.230 -3.764 5.828 1.00 0.00 ? 34 VAL A O 11 ATOM 4448 C CB . VAL A 1 34 ? -0.014 -5.098 6.045 1.00 0.00 ? 34 VAL A CB 11 ATOM 4449 C CG1 . VAL A 1 34 ? -0.792 -5.238 4.736 1.00 0.00 ? 34 VAL A CG1 11 ATOM 4450 C CG2 . VAL A 1 34 ? 0.845 -6.336 6.307 1.00 0.00 ? 34 VAL A CG2 11 ATOM 4451 N N . ILE A 1 35 ? 2.362 -4.609 7.740 1.00 0.00 ? 35 ILE A N 11 ATOM 4452 C CA . ILE A 1 35 ? 3.658 -4.892 8.333 1.00 0.00 ? 35 ILE A CA 11 ATOM 4453 C C . ILE A 1 35 ? 4.319 -6.045 7.577 1.00 0.00 ? 35 ILE A C 11 ATOM 4454 O O . ILE A 1 35 ? 3.969 -7.208 7.777 1.00 0.00 ? 35 ILE A O 11 ATOM 4455 C CB . ILE A 1 35 ? 3.515 -5.146 9.835 1.00 0.00 ? 35 ILE A CB 11 ATOM 4456 C CG1 . ILE A 1 35 ? 2.677 -4.050 10.498 1.00 0.00 ? 35 ILE A CG1 11 ATOM 4457 C CG2 . ILE A 1 35 ? 4.884 -5.298 10.499 1.00 0.00 ? 35 ILE A CG2 11 ATOM 4458 C CD1 . ILE A 1 35 ? 3.568 -2.947 11.069 1.00 0.00 ? 35 ILE A CD1 11 ATOM 4459 N N . GLY A 1 36 ? 5.266 -5.684 6.721 1.00 0.00 ? 36 GLY A N 11 ATOM 4460 C CA . GLY A 1 36 ? 5.980 -6.674 5.934 1.00 0.00 ? 36 GLY A CA 11 ATOM 4461 C C . GLY A 1 36 ? 5.722 -6.475 4.440 1.00 0.00 ? 36 GLY A C 11 ATOM 4462 O O . GLY A 1 36 ? 6.113 -7.308 3.621 1.00 0.00 ? 36 GLY A O 11 ATOM 4463 N N . TYR A 1 37 ? 5.063 -5.368 4.127 1.00 0.00 ? 37 TYR A N 11 ATOM 4464 C CA . TYR A 1 37 ? 4.749 -5.050 2.745 1.00 0.00 ? 37 TYR A CA 11 ATOM 4465 C C . TYR A 1 37 ? 4.719 -3.537 2.524 1.00 0.00 ? 37 TYR A C 11 ATOM 4466 O O . TYR A 1 37 ? 4.074 -2.808 3.276 1.00 0.00 ? 37 TYR A O 11 ATOM 4467 C CB . TYR A 1 37 ? 3.351 -5.618 2.490 1.00 0.00 ? 37 TYR A CB 11 ATOM 4468 C CG . TYR A 1 37 ? 3.274 -7.144 2.571 1.00 0.00 ? 37 TYR A CG 11 ATOM 4469 C CD1 . TYR A 1 37 ? 3.363 -7.775 3.795 1.00 0.00 ? 37 TYR A CD1 11 ATOM 4470 C CD2 . TYR A 1 37 ? 3.116 -7.889 1.421 1.00 0.00 ? 37 TYR A CD2 11 ATOM 4471 C CE1 . TYR A 1 37 ? 3.291 -9.211 3.872 1.00 0.00 ? 37 TYR A CE1 11 ATOM 4472 C CE2 . TYR A 1 37 ? 3.045 -9.326 1.498 1.00 0.00 ? 37 TYR A CE2 11 ATOM 4473 C CZ . TYR A 1 37 ? 3.136 -9.915 2.719 1.00 0.00 ? 37 TYR A CZ 11 ATOM 4474 O OH . TYR A 1 37 ? 3.069 -11.272 2.793 1.00 0.00 ? 37 TYR A OH 11 ATOM 4475 N N . SER A 1 38 ? 5.425 -3.108 1.487 1.00 0.00 ? 38 SER A N 11 ATOM 4476 C CA . SER A 1 38 ? 5.488 -1.694 1.158 1.00 0.00 ? 38 SER A CA 11 ATOM 4477 C C . SER A 1 38 ? 5.958 -1.514 -0.288 1.00 0.00 ? 38 SER A C 11 ATOM 4478 O O . SER A 1 38 ? 6.489 -2.445 -0.892 1.00 0.00 ? 38 SER A O 11 ATOM 4479 C CB . SER A 1 38 ? 6.418 -0.946 2.116 1.00 0.00 ? 38 SER A CB 11 ATOM 4480 O OG . SER A 1 38 ? 7.779 -1.010 1.698 1.00 0.00 ? 38 SER A OG 11 ATOM 4481 N N . GLY A 1 39 ? 5.745 -0.311 -0.800 1.00 0.00 ? 39 GLY A N 11 ATOM 4482 C CA . GLY A 1 39 ? 6.139 0.002 -2.162 1.00 0.00 ? 39 GLY A CA 11 ATOM 4483 C C . GLY A 1 39 ? 5.039 0.779 -2.887 1.00 0.00 ? 39 GLY A C 11 ATOM 4484 O O . GLY A 1 39 ? 4.669 0.438 -4.010 1.00 0.00 ? 39 GLY A O 11 ATOM 4485 N N . ASP A 1 40 ? 4.545 1.808 -2.216 1.00 0.00 ? 40 ASP A N 11 ATOM 4486 C CA . ASP A 1 40 ? 3.493 2.637 -2.782 1.00 0.00 ? 40 ASP A CA 11 ATOM 4487 C C . ASP A 1 40 ? 2.514 1.751 -3.557 1.00 0.00 ? 40 ASP A C 11 ATOM 4488 O O . ASP A 1 40 ? 2.032 2.139 -4.621 1.00 0.00 ? 40 ASP A O 11 ATOM 4489 C CB . ASP A 1 40 ? 4.068 3.670 -3.753 1.00 0.00 ? 40 ASP A CB 11 ATOM 4490 C CG . ASP A 1 40 ? 4.745 3.085 -4.995 1.00 0.00 ? 40 ASP A CG 11 ATOM 4491 O OD1 . ASP A 1 40 ? 5.948 2.782 -4.984 1.00 0.00 ? 40 ASP A OD1 11 ATOM 4492 O OD2 . ASP A 1 40 ? 3.973 2.938 -6.018 1.00 0.00 ? 40 ASP A OD2 11 ATOM 4493 N N . ARG A 1 41 ? 2.252 0.581 -2.994 1.00 0.00 ? 41 ARG A N 11 ATOM 4494 C CA . ARG A 1 41 ? 1.340 -0.361 -3.619 1.00 0.00 ? 41 ARG A CA 11 ATOM 4495 C C . ARG A 1 41 ? 1.272 -1.653 -2.804 1.00 0.00 ? 41 ARG A C 11 ATOM 4496 O O . ARG A 1 41 ? 0.257 -2.349 -2.822 1.00 0.00 ? 41 ARG A O 11 ATOM 4497 C CB . ARG A 1 41 ? 1.782 -0.691 -5.047 1.00 0.00 ? 41 ARG A CB 11 ATOM 4498 C CG . ARG A 1 41 ? 0.761 -1.594 -5.741 1.00 0.00 ? 41 ARG A CG 11 ATOM 4499 C CD . ARG A 1 41 ? 0.551 -1.168 -7.196 1.00 0.00 ? 41 ARG A CD 11 ATOM 4500 N NE . ARG A 1 41 ? 1.630 -1.720 -8.046 1.00 0.00 ? 41 ARG A NE 11 ATOM 4501 C CZ . ARG A 1 41 ? 2.409 -0.976 -8.858 1.00 0.00 ? 41 ARG A CZ 11 ATOM 4502 N NH1 . ARG A 1 41 ? 3.492 -0.335 -8.370 1.00 0.00 ? 41 ARG A NH1 11 ATOM 4503 N NH2 . ARG A 1 41 ? 2.097 -0.884 -10.137 1.00 0.00 ? 41 ARG A NH2 11 ATOM 4504 N N . CYS A 1 42 ? 2.363 -1.935 -2.106 1.00 0.00 ? 42 CYS A N 11 ATOM 4505 C CA . CYS A 1 42 ? 2.438 -3.130 -1.285 1.00 0.00 ? 42 CYS A CA 11 ATOM 4506 C C . CYS A 1 42 ? 2.795 -4.313 -2.189 1.00 0.00 ? 42 CYS A C 11 ATOM 4507 O O . CYS A 1 42 ? 1.923 -5.091 -2.573 1.00 0.00 ? 42 CYS A O 11 ATOM 4508 C CB . CYS A 1 42 ? 1.138 -3.373 -0.516 1.00 0.00 ? 42 CYS A CB 11 ATOM 4509 S SG . CYS A 1 42 ? 0.205 -1.856 -0.090 1.00 0.00 ? 42 CYS A SG 11 ATOM 4510 N N . GLN A 1 43 ? 4.079 -4.410 -2.504 1.00 0.00 ? 43 GLN A N 11 ATOM 4511 C CA . GLN A 1 43 ? 4.561 -5.483 -3.355 1.00 0.00 ? 43 GLN A CA 11 ATOM 4512 C C . GLN A 1 43 ? 5.831 -6.099 -2.766 1.00 0.00 ? 43 GLN A C 11 ATOM 4513 O O . GLN A 1 43 ? 6.027 -7.312 -2.833 1.00 0.00 ? 43 GLN A O 11 ATOM 4514 C CB . GLN A 1 43 ? 4.805 -4.984 -4.782 1.00 0.00 ? 43 GLN A CB 11 ATOM 4515 C CG . GLN A 1 43 ? 3.524 -4.418 -5.391 1.00 0.00 ? 43 GLN A CG 11 ATOM 4516 C CD . GLN A 1 43 ? 3.836 -3.293 -6.380 1.00 0.00 ? 43 GLN A CD 11 ATOM 4517 O OE1 . GLN A 1 43 ? 3.456 -3.325 -7.539 1.00 0.00 ? 43 GLN A OE1 11 ATOM 4518 N NE2 . GLN A 1 43 ? 4.550 -2.296 -5.859 1.00 0.00 ? 43 GLN A NE2 11 ATOM 4519 N N . THR A 1 44 ? 6.659 -5.236 -2.197 1.00 0.00 ? 44 THR A N 11 ATOM 4520 C CA . THR A 1 44 ? 7.906 -5.680 -1.594 1.00 0.00 ? 44 THR A CA 11 ATOM 4521 C C . THR A 1 44 ? 7.646 -6.271 -0.208 1.00 0.00 ? 44 THR A C 11 ATOM 4522 O O . THR A 1 44 ? 7.168 -5.577 0.688 1.00 0.00 ? 44 THR A O 11 ATOM 4523 C CB . THR A 1 44 ? 8.873 -4.495 -1.579 1.00 0.00 ? 44 THR A CB 11 ATOM 4524 O OG1 . THR A 1 44 ? 8.799 -3.968 -2.900 1.00 0.00 ? 44 THR A OG1 11 ATOM 4525 C CG2 . THR A 1 44 ? 10.331 -4.931 -1.434 1.00 0.00 ? 44 THR A CG2 11 ATOM 4526 N N . ARG A 1 45 ? 7.973 -7.548 -0.073 1.00 0.00 ? 45 ARG A N 11 ATOM 4527 C CA . ARG A 1 45 ? 7.782 -8.241 1.190 1.00 0.00 ? 45 ARG A CA 11 ATOM 4528 C C . ARG A 1 45 ? 9.088 -8.267 1.985 1.00 0.00 ? 45 ARG A C 11 ATOM 4529 O O . ARG A 1 45 ? 9.682 -9.325 2.177 1.00 0.00 ? 45 ARG A O 11 ATOM 4530 C CB . ARG A 1 45 ? 7.303 -9.676 0.965 1.00 0.00 ? 45 ARG A CB 11 ATOM 4531 C CG . ARG A 1 45 ? 6.043 -9.967 1.781 1.00 0.00 ? 45 ARG A CG 11 ATOM 4532 C CD . ARG A 1 45 ? 6.124 -11.344 2.443 1.00 0.00 ? 45 ARG A CD 11 ATOM 4533 N NE . ARG A 1 45 ? 6.247 -12.397 1.409 1.00 0.00 ? 45 ARG A NE 11 ATOM 4534 C CZ . ARG A 1 45 ? 7.122 -13.424 1.474 1.00 0.00 ? 45 ARG A CZ 11 ATOM 4535 N NH1 . ARG A 1 45 ? 6.784 -14.510 2.142 1.00 0.00 ? 45 ARG A NH1 11 ATOM 4536 N NH2 . ARG A 1 45 ? 8.323 -13.340 0.864 1.00 0.00 ? 45 ARG A NH2 11 ATOM 4537 N N . ASP A 1 46 ? 9.499 -7.085 2.426 1.00 0.00 ? 46 ASP A N 11 ATOM 4538 C CA . ASP A 1 46 ? 10.724 -6.959 3.198 1.00 0.00 ? 46 ASP A CA 11 ATOM 4539 C C . ASP A 1 46 ? 10.445 -6.140 4.460 1.00 0.00 ? 46 ASP A C 11 ATOM 4540 O O . ASP A 1 46 ? 10.481 -6.671 5.568 1.00 0.00 ? 46 ASP A O 11 ATOM 4541 C CB . ASP A 1 46 ? 11.807 -6.236 2.394 1.00 0.00 ? 46 ASP A CB 11 ATOM 4542 C CG . ASP A 1 46 ? 13.211 -6.826 2.527 1.00 0.00 ? 46 ASP A CG 11 ATOM 4543 O OD1 . ASP A 1 46 ? 13.549 -7.825 1.876 1.00 0.00 ? 46 ASP A OD1 11 ATOM 4544 O OD2 . ASP A 1 46 ? 13.987 -6.205 3.351 1.00 0.00 ? 46 ASP A OD2 11 ATOM 4545 N N . LEU A 1 47 ? 10.174 -4.861 4.248 1.00 0.00 ? 47 LEU A N 11 ATOM 4546 C CA . LEU A 1 47 ? 9.888 -3.964 5.355 1.00 0.00 ? 47 LEU A CA 11 ATOM 4547 C C . LEU A 1 47 ? 9.695 -4.783 6.633 1.00 0.00 ? 47 LEU A C 11 ATOM 4548 O O . LEU A 1 47 ? 8.763 -5.580 6.728 1.00 0.00 ? 47 LEU A O 11 ATOM 4549 C CB . LEU A 1 47 ? 8.703 -3.057 5.020 1.00 0.00 ? 47 LEU A CB 11 ATOM 4550 C CG . LEU A 1 47 ? 9.023 -1.808 4.198 1.00 0.00 ? 47 LEU A CG 11 ATOM 4551 C CD1 . LEU A 1 47 ? 9.817 -0.796 5.027 1.00 0.00 ? 47 LEU A CD1 11 ATOM 4552 C CD2 . LEU A 1 47 ? 9.744 -2.176 2.899 1.00 0.00 ? 47 LEU A CD2 11 ATOM 4553 N N . ARG A 1 48 ? 10.590 -4.557 7.584 1.00 0.00 ? 48 ARG A N 11 ATOM 4554 C CA . ARG A 1 48 ? 10.528 -5.266 8.851 1.00 0.00 ? 48 ARG A CA 11 ATOM 4555 C C . ARG A 1 48 ? 11.329 -4.513 9.917 1.00 0.00 ? 48 ARG A C 11 ATOM 4556 O O . ARG A 1 48 ? 12.304 -5.038 10.451 1.00 0.00 ? 48 ARG A O 11 ATOM 4557 C CB . ARG A 1 48 ? 11.082 -6.685 8.718 1.00 0.00 ? 48 ARG A CB 11 ATOM 4558 C CG . ARG A 1 48 ? 10.489 -7.607 9.785 1.00 0.00 ? 48 ARG A CG 11 ATOM 4559 C CD . ARG A 1 48 ? 10.700 -9.077 9.418 1.00 0.00 ? 48 ARG A CD 11 ATOM 4560 N NE . ARG A 1 48 ? 12.145 -9.353 9.248 1.00 0.00 ? 48 ARG A NE 11 ATOM 4561 C CZ . ARG A 1 48 ? 12.639 -10.315 8.438 1.00 0.00 ? 48 ARG A CZ 11 ATOM 4562 N NH1 . ARG A 1 48 ? 12.504 -11.618 8.758 1.00 0.00 ? 48 ARG A NH1 11 ATOM 4563 N NH2 . ARG A 1 48 ? 13.258 -9.958 7.328 1.00 0.00 ? 48 ARG A NH2 11 ATOM 4564 N N . TRP A 1 49 ? 10.882 -3.296 10.197 1.00 0.00 ? 49 TRP A N 11 ATOM 4565 C CA . TRP A 1 49 ? 11.544 -2.467 11.189 1.00 0.00 ? 49 TRP A CA 11 ATOM 4566 C C . TRP A 1 49 ? 11.188 -3.013 12.573 1.00 0.00 ? 49 TRP A C 11 ATOM 4567 O O . TRP A 1 49 ? 11.668 -2.505 13.587 1.00 0.00 ? 49 TRP A O 11 ATOM 4568 C CB . TRP A 1 49 ? 11.168 -0.994 11.012 1.00 0.00 ? 49 TRP A CB 11 ATOM 4569 C CG . TRP A 1 49 ? 9.660 -0.732 11.011 1.00 0.00 ? 49 TRP A CG 11 ATOM 4570 C CD1 . TRP A 1 49 ? 8.797 -0.882 12.025 1.00 0.00 ? 49 TRP A CD1 11 ATOM 4571 C CD2 . TRP A 1 49 ? 8.869 -0.266 9.900 1.00 0.00 ? 49 TRP A CD2 11 ATOM 4572 N NE1 . TRP A 1 49 ? 7.513 -0.548 11.649 1.00 0.00 ? 49 TRP A NE1 11 ATOM 4573 C CE2 . TRP A 1 49 ? 7.558 -0.161 10.315 1.00 0.00 ? 49 TRP A CE2 11 ATOM 4574 C CE3 . TRP A 1 49 ? 9.250 0.056 8.584 1.00 0.00 ? 49 TRP A CE3 11 ATOM 4575 C CZ2 . TRP A 1 49 ? 6.519 0.266 9.477 1.00 0.00 ? 49 TRP A CZ2 11 ATOM 4576 C CZ3 . TRP A 1 49 ? 8.201 0.481 7.760 1.00 0.00 ? 49 TRP A CZ3 11 ATOM 4577 C CH2 . TRP A 1 49 ? 6.875 0.592 8.163 1.00 0.00 ? 49 TRP A CH2 11 ATOM 4578 N N . TRP A 1 50 ? 10.350 -4.039 12.574 1.00 0.00 ? 50 TRP A N 11 ATOM 4579 C CA . TRP A 1 50 ? 9.924 -4.658 13.817 1.00 0.00 ? 50 TRP A CA 11 ATOM 4580 C C . TRP A 1 50 ? 10.838 -5.856 14.085 1.00 0.00 ? 50 TRP A C 11 ATOM 4581 O O . TRP A 1 50 ? 10.590 -6.954 13.592 1.00 0.00 ? 50 TRP A O 11 ATOM 4582 C CB . TRP A 1 50 ? 8.443 -5.037 13.762 1.00 0.00 ? 50 TRP A CB 11 ATOM 4583 C CG . TRP A 1 50 ? 8.034 -5.758 12.475 1.00 0.00 ? 50 TRP A CG 11 ATOM 4584 C CD1 . TRP A 1 50 ? 7.783 -7.063 12.306 1.00 0.00 ? 50 TRP A CD1 11 ATOM 4585 C CD2 . TRP A 1 50 ? 7.836 -5.156 11.179 1.00 0.00 ? 50 TRP A CD2 11 ATOM 4586 N NE1 . TRP A 1 50 ? 7.438 -7.346 11.000 1.00 0.00 ? 50 TRP A NE1 11 ATOM 4587 C CE2 . TRP A 1 50 ? 7.472 -6.150 10.293 1.00 0.00 ? 50 TRP A CE2 11 ATOM 4588 C CE3 . TRP A 1 50 ? 7.960 -3.818 10.768 1.00 0.00 ? 50 TRP A CE3 11 ATOM 4589 C CZ2 . TRP A 1 50 ? 7.203 -5.909 8.939 1.00 0.00 ? 50 TRP A CZ2 11 ATOM 4590 C CZ3 . TRP A 1 50 ? 7.688 -3.594 9.413 1.00 0.00 ? 50 TRP A CZ3 11 ATOM 4591 C CH2 . TRP A 1 50 ? 7.321 -4.582 8.508 1.00 0.00 ? 50 TRP A CH2 11 ATOM 4592 N N . GLU A 1 51 ? 11.879 -5.603 14.867 1.00 0.00 ? 51 GLU A N 11 ATOM 4593 C CA . GLU A 1 51 ? 12.831 -6.645 15.208 1.00 0.00 ? 51 GLU A CA 11 ATOM 4594 C C . GLU A 1 51 ? 13.745 -6.179 16.341 1.00 0.00 ? 51 GLU A C 11 ATOM 4595 O O . GLU A 1 51 ? 13.910 -6.880 17.339 1.00 0.00 ? 51 GLU A O 11 ATOM 4596 C CB . GLU A 1 51 ? 13.646 -7.064 13.982 1.00 0.00 ? 51 GLU A CB 11 ATOM 4597 C CG . GLU A 1 51 ? 13.286 -8.486 13.546 1.00 0.00 ? 51 GLU A CG 11 ATOM 4598 C CD . GLU A 1 51 ? 12.492 -8.472 12.237 1.00 0.00 ? 51 GLU A CD 11 ATOM 4599 O OE1 . GLU A 1 51 ? 13.030 -8.084 11.189 1.00 0.00 ? 51 GLU A OE1 11 ATOM 4600 O OE2 . GLU A 1 51 ? 11.274 -8.885 12.335 1.00 0.00 ? 51 GLU A OE2 11 ATOM 4601 N N . LEU A 1 52 ? 14.317 -4.999 16.151 1.00 0.00 ? 52 LEU A N 11 ATOM 4602 C CA . LEU A 1 52 ? 15.211 -4.432 17.146 1.00 0.00 ? 52 LEU A CA 11 ATOM 4603 C C . LEU A 1 52 ? 14.587 -3.157 17.718 1.00 0.00 ? 52 LEU A C 11 ATOM 4604 O O . LEU A 1 52 ? 14.421 -3.034 18.931 1.00 0.00 ? 52 LEU A O 11 ATOM 4605 C CB . LEU A 1 52 ? 16.605 -4.220 16.554 1.00 0.00 ? 52 LEU A CB 11 ATOM 4606 C CG . LEU A 1 52 ? 17.405 -5.490 16.249 1.00 0.00 ? 52 LEU A CG 11 ATOM 4607 C CD1 . LEU A 1 52 ? 18.215 -5.331 14.960 1.00 0.00 ? 52 LEU A CD1 11 ATOM 4608 C CD2 . LEU A 1 52 ? 18.288 -5.880 17.436 1.00 0.00 ? 52 LEU A CD2 11 ATOM 4609 N N . ARG A 1 53 ? 14.259 -2.242 16.818 1.00 0.00 ? 53 ARG A N 11 ATOM 4610 C CA . ARG A 1 53 ? 13.656 -0.981 17.219 1.00 0.00 ? 53 ARG A CA 11 ATOM 4611 C C . ARG A 1 53 ? 14.458 -0.348 18.357 1.00 0.00 ? 53 ARG A C 11 ATOM 4612 O O . ARG A 1 53 ? 15.615 0.028 18.173 1.00 0.00 ? 53 ARG A O 11 ATOM 4613 C CB . ARG A 1 53 ? 12.209 -1.183 17.674 1.00 0.00 ? 53 ARG A CB 11 ATOM 4614 C CG . ARG A 1 53 ? 11.379 -1.855 16.580 1.00 0.00 ? 53 ARG A CG 11 ATOM 4615 C CD . ARG A 1 53 ? 9.891 -1.546 16.753 1.00 0.00 ? 53 ARG A CD 11 ATOM 4616 N NE . ARG A 1 53 ? 9.420 -2.045 18.065 1.00 0.00 ? 53 ARG A NE 11 ATOM 4617 C CZ . ARG A 1 53 ? 8.870 -3.262 18.261 1.00 0.00 ? 53 ARG A CZ 11 ATOM 4618 N NH1 . ARG A 1 53 ? 7.552 -3.458 18.058 1.00 0.00 ? 53 ARG A NH1 11 ATOM 4619 N NH2 . ARG A 1 53 ? 9.646 -4.256 18.652 1.00 0.00 ? 53 ARG A NH2 11 ATOM 4620 O OXT . ARG A 1 53 ? 13.830 -0.253 19.480 1.00 0.00 ? 53 ARG A OXT 11 ATOM 4621 N N . ASN A 1 1 ? -2.949 15.362 1.899 1.00 0.00 ? 1 ASN A N 12 ATOM 4622 C CA . ASN A 1 1 ? -4.041 14.741 2.626 1.00 0.00 ? 1 ASN A CA 12 ATOM 4623 C C . ASN A 1 1 ? -4.434 13.435 1.932 1.00 0.00 ? 1 ASN A C 12 ATOM 4624 O O . ASN A 1 1 ? -4.685 13.420 0.728 1.00 0.00 ? 1 ASN A O 12 ATOM 4625 C CB . ASN A 1 1 ? -5.271 15.650 2.656 1.00 0.00 ? 1 ASN A CB 12 ATOM 4626 C CG . ASN A 1 1 ? -5.544 16.246 1.273 1.00 0.00 ? 1 ASN A CG 12 ATOM 4627 O OD1 . ASN A 1 1 ? -4.778 17.037 0.748 1.00 0.00 ? 1 ASN A OD1 12 ATOM 4628 N ND2 . ASN A 1 1 ? -6.676 15.826 0.717 1.00 0.00 ? 1 ASN A ND2 12 ATOM 4629 N N . SER A 1 2 ? -4.476 12.371 2.720 1.00 0.00 ? 2 SER A N 12 ATOM 4630 C CA . SER A 1 2 ? -4.834 11.064 2.196 1.00 0.00 ? 2 SER A CA 12 ATOM 4631 C C . SER A 1 2 ? -6.327 11.025 1.865 1.00 0.00 ? 2 SER A C 12 ATOM 4632 O O . SER A 1 2 ? -7.166 11.264 2.731 1.00 0.00 ? 2 SER A O 12 ATOM 4633 C CB . SER A 1 2 ? -4.482 9.956 3.190 1.00 0.00 ? 2 SER A CB 12 ATOM 4634 O OG . SER A 1 2 ? -3.097 9.964 3.530 1.00 0.00 ? 2 SER A OG 12 ATOM 4635 N N . TYR A 1 3 ? -6.615 10.721 0.609 1.00 0.00 ? 3 TYR A N 12 ATOM 4636 C CA . TYR A 1 3 ? -7.993 10.646 0.152 1.00 0.00 ? 3 TYR A CA 12 ATOM 4637 C C . TYR A 1 3 ? -8.279 9.295 -0.506 1.00 0.00 ? 3 TYR A C 12 ATOM 4638 O O . TYR A 1 3 ? -7.484 8.810 -1.309 1.00 0.00 ? 3 TYR A O 12 ATOM 4639 C CB . TYR A 1 3 ? -8.151 11.753 -0.894 1.00 0.00 ? 3 TYR A CB 12 ATOM 4640 C CG . TYR A 1 3 ? -9.539 11.810 -1.535 1.00 0.00 ? 3 TYR A CG 12 ATOM 4641 C CD1 . TYR A 1 3 ? -10.533 12.576 -0.962 1.00 0.00 ? 3 TYR A CD1 12 ATOM 4642 C CD2 . TYR A 1 3 ? -9.796 11.093 -2.685 1.00 0.00 ? 3 TYR A CD2 12 ATOM 4643 C CE1 . TYR A 1 3 ? -11.839 12.629 -1.567 1.00 0.00 ? 3 TYR A CE1 12 ATOM 4644 C CE2 . TYR A 1 3 ? -11.101 11.146 -3.289 1.00 0.00 ? 3 TYR A CE2 12 ATOM 4645 C CZ . TYR A 1 3 ? -12.059 11.911 -2.700 1.00 0.00 ? 3 TYR A CZ 12 ATOM 4646 O OH . TYR A 1 3 ? -13.292 11.961 -3.271 1.00 0.00 ? 3 TYR A OH 12 ATOM 4647 N N . PRO A 1 4 ? -9.449 8.712 -0.132 1.00 0.00 ? 4 PRO A N 12 ATOM 4648 C CA . PRO A 1 4 ? -9.852 7.427 -0.678 1.00 0.00 ? 4 PRO A CA 12 ATOM 4649 C C . PRO A 1 4 ? -10.345 7.571 -2.118 1.00 0.00 ? 4 PRO A C 12 ATOM 4650 O O . PRO A 1 4 ? -11.343 8.248 -2.371 1.00 0.00 ? 4 PRO A O 12 ATOM 4651 C CB . PRO A 1 4 ? -10.927 6.917 0.270 1.00 0.00 ? 4 PRO A CB 12 ATOM 4652 C CG . PRO A 1 4 ? -11.414 8.132 1.041 1.00 0.00 ? 4 PRO A CG 12 ATOM 4653 C CD . PRO A 1 4 ? -10.416 9.257 0.816 1.00 0.00 ? 4 PRO A CD 12 ATOM 4654 N N . GLY A 1 5 ? -9.625 6.928 -3.024 1.00 0.00 ? 5 GLY A N 12 ATOM 4655 C CA . GLY A 1 5 ? -9.978 6.978 -4.434 1.00 0.00 ? 5 GLY A CA 12 ATOM 4656 C C . GLY A 1 5 ? -9.155 5.970 -5.240 1.00 0.00 ? 5 GLY A C 12 ATOM 4657 O O . GLY A 1 5 ? -8.039 5.626 -4.856 1.00 0.00 ? 5 GLY A O 12 ATOM 4658 N N . CYS A 1 6 ? -9.740 5.525 -6.343 1.00 0.00 ? 6 CYS A N 12 ATOM 4659 C CA . CYS A 1 6 ? -9.076 4.563 -7.206 1.00 0.00 ? 6 CYS A CA 12 ATOM 4660 C C . CYS A 1 6 ? -9.944 4.352 -8.448 1.00 0.00 ? 6 CYS A C 12 ATOM 4661 O O . CYS A 1 6 ? -10.864 3.536 -8.435 1.00 0.00 ? 6 CYS A O 12 ATOM 4662 C CB . CYS A 1 6 ? -8.793 3.249 -6.477 1.00 0.00 ? 6 CYS A CB 12 ATOM 4663 S SG . CYS A 1 6 ? -7.129 3.132 -5.721 1.00 0.00 ? 6 CYS A SG 12 ATOM 4664 N N . PRO A 1 7 ? -9.613 5.122 -9.519 1.00 0.00 ? 7 PRO A N 12 ATOM 4665 C CA . PRO A 1 7 ? -10.353 5.027 -10.766 1.00 0.00 ? 7 PRO A CA 12 ATOM 4666 C C . PRO A 1 7 ? -9.985 3.750 -11.524 1.00 0.00 ? 7 PRO A C 12 ATOM 4667 O O . PRO A 1 7 ? -9.183 2.949 -11.047 1.00 0.00 ? 7 PRO A O 12 ATOM 4668 C CB . PRO A 1 7 ? -10.001 6.293 -11.529 1.00 0.00 ? 7 PRO A CB 12 ATOM 4669 C CG . PRO A 1 7 ? -8.728 6.824 -10.892 1.00 0.00 ? 7 PRO A CG 12 ATOM 4670 C CD . PRO A 1 7 ? -8.529 6.099 -9.571 1.00 0.00 ? 7 PRO A CD 12 ATOM 4671 N N . SER A 1 8 ? -10.590 3.600 -12.695 1.00 0.00 ? 8 SER A N 12 ATOM 4672 C CA . SER A 1 8 ? -10.337 2.435 -13.525 1.00 0.00 ? 8 SER A CA 12 ATOM 4673 C C . SER A 1 8 ? -8.834 2.278 -13.763 1.00 0.00 ? 8 SER A C 12 ATOM 4674 O O . SER A 1 8 ? -8.354 1.177 -14.029 1.00 0.00 ? 8 SER A O 12 ATOM 4675 C CB . SER A 1 8 ? -11.076 2.538 -14.859 1.00 0.00 ? 8 SER A CB 12 ATOM 4676 O OG . SER A 1 8 ? -12.487 2.657 -14.680 1.00 0.00 ? 8 SER A OG 12 ATOM 4677 N N . SER A 1 9 ? -8.130 3.395 -13.654 1.00 0.00 ? 9 SER A N 12 ATOM 4678 C CA . SER A 1 9 ? -6.691 3.396 -13.853 1.00 0.00 ? 9 SER A CA 12 ATOM 4679 C C . SER A 1 9 ? -5.987 2.902 -12.588 1.00 0.00 ? 9 SER A C 12 ATOM 4680 O O . SER A 1 9 ? -4.759 2.895 -12.518 1.00 0.00 ? 9 SER A O 12 ATOM 4681 C CB . SER A 1 9 ? -6.187 4.792 -14.228 1.00 0.00 ? 9 SER A CB 12 ATOM 4682 O OG . SER A 1 9 ? -7.175 5.793 -14.003 1.00 0.00 ? 9 SER A OG 12 ATOM 4683 N N . TYR A 1 10 ? -6.797 2.497 -11.619 1.00 0.00 ? 10 TYR A N 12 ATOM 4684 C CA . TYR A 1 10 ? -6.265 2.002 -10.359 1.00 0.00 ? 10 TYR A CA 12 ATOM 4685 C C . TYR A 1 10 ? -7.117 0.849 -9.822 1.00 0.00 ? 10 TYR A C 12 ATOM 4686 O O . TYR A 1 10 ? -7.918 1.038 -8.910 1.00 0.00 ? 10 TYR A O 12 ATOM 4687 C CB . TYR A 1 10 ? -6.339 3.174 -9.380 1.00 0.00 ? 10 TYR A CB 12 ATOM 4688 C CG . TYR A 1 10 ? -5.262 4.238 -9.600 1.00 0.00 ? 10 TYR A CG 12 ATOM 4689 C CD1 . TYR A 1 10 ? -5.456 5.234 -10.535 1.00 0.00 ? 10 TYR A CD1 12 ATOM 4690 C CD2 . TYR A 1 10 ? -4.097 4.202 -8.862 1.00 0.00 ? 10 TYR A CD2 12 ATOM 4691 C CE1 . TYR A 1 10 ? -4.443 6.235 -10.742 1.00 0.00 ? 10 TYR A CE1 12 ATOM 4692 C CE2 . TYR A 1 10 ? -3.083 5.203 -9.067 1.00 0.00 ? 10 TYR A CE2 12 ATOM 4693 C CZ . TYR A 1 10 ? -3.306 6.171 -9.998 1.00 0.00 ? 10 TYR A CZ 12 ATOM 4694 O OH . TYR A 1 10 ? -2.348 7.116 -10.193 1.00 0.00 ? 10 TYR A OH 12 ATOM 4695 N N . ASP A 1 11 ? -6.913 -0.320 -10.414 1.00 0.00 ? 11 ASP A N 12 ATOM 4696 C CA . ASP A 1 11 ? -7.650 -1.502 -10.005 1.00 0.00 ? 11 ASP A CA 12 ATOM 4697 C C . ASP A 1 11 ? -7.174 -1.943 -8.619 1.00 0.00 ? 11 ASP A C 12 ATOM 4698 O O . ASP A 1 11 ? -6.750 -3.083 -8.438 1.00 0.00 ? 11 ASP A O 12 ATOM 4699 C CB . ASP A 1 11 ? -7.413 -2.663 -10.976 1.00 0.00 ? 11 ASP A CB 12 ATOM 4700 C CG . ASP A 1 11 ? -8.229 -3.924 -10.688 1.00 0.00 ? 11 ASP A CG 12 ATOM 4701 O OD1 . ASP A 1 11 ? -9.416 -3.932 -11.192 1.00 0.00 ? 11 ASP A OD1 12 ATOM 4702 O OD2 . ASP A 1 11 ? -7.754 -4.852 -10.017 1.00 0.00 ? 11 ASP A OD2 12 ATOM 4703 N N . GLY A 1 12 ? -7.261 -1.016 -7.677 1.00 0.00 ? 12 GLY A N 12 ATOM 4704 C CA . GLY A 1 12 ? -6.844 -1.293 -6.313 1.00 0.00 ? 12 GLY A CA 12 ATOM 4705 C C . GLY A 1 12 ? -5.447 -0.735 -6.041 1.00 0.00 ? 12 GLY A C 12 ATOM 4706 O O . GLY A 1 12 ? -5.142 -0.334 -4.919 1.00 0.00 ? 12 GLY A O 12 ATOM 4707 N N . TYR A 1 13 ? -4.634 -0.725 -7.089 1.00 0.00 ? 13 TYR A N 12 ATOM 4708 C CA . TYR A 1 13 ? -3.275 -0.223 -6.977 1.00 0.00 ? 13 TYR A CA 12 ATOM 4709 C C . TYR A 1 13 ? -2.575 -0.799 -5.746 1.00 0.00 ? 13 TYR A C 12 ATOM 4710 O O . TYR A 1 13 ? -1.594 -0.235 -5.263 1.00 0.00 ? 13 TYR A O 12 ATOM 4711 C CB . TYR A 1 13 ? -3.400 1.295 -6.813 1.00 0.00 ? 13 TYR A CB 12 ATOM 4712 C CG . TYR A 1 13 ? -2.195 2.078 -7.339 1.00 0.00 ? 13 TYR A CG 12 ATOM 4713 C CD1 . TYR A 1 13 ? -1.968 2.166 -8.697 1.00 0.00 ? 13 TYR A CD1 12 ATOM 4714 C CD2 . TYR A 1 13 ? -1.336 2.698 -6.455 1.00 0.00 ? 13 TYR A CD2 12 ATOM 4715 C CE1 . TYR A 1 13 ? -0.833 2.902 -9.192 1.00 0.00 ? 13 TYR A CE1 12 ATOM 4716 C CE2 . TYR A 1 13 ? -0.202 3.436 -6.950 1.00 0.00 ? 13 TYR A CE2 12 ATOM 4717 C CZ . TYR A 1 13 ? -0.008 3.500 -8.294 1.00 0.00 ? 13 TYR A CZ 12 ATOM 4718 O OH . TYR A 1 13 ? 1.063 4.197 -8.761 1.00 0.00 ? 13 TYR A OH 12 ATOM 4719 N N . CYS A 1 14 ? -3.108 -1.916 -5.272 1.00 0.00 ? 14 CYS A N 12 ATOM 4720 C CA . CYS A 1 14 ? -2.547 -2.577 -4.105 1.00 0.00 ? 14 CYS A CA 12 ATOM 4721 C C . CYS A 1 14 ? -2.396 -4.067 -4.423 1.00 0.00 ? 14 CYS A C 12 ATOM 4722 O O . CYS A 1 14 ? -3.212 -4.636 -5.147 1.00 0.00 ? 14 CYS A O 12 ATOM 4723 C CB . CYS A 1 14 ? -3.400 -2.343 -2.857 1.00 0.00 ? 14 CYS A CB 12 ATOM 4724 S SG . CYS A 1 14 ? -3.794 -0.590 -2.514 1.00 0.00 ? 14 CYS A SG 12 ATOM 4725 N N . LEU A 1 15 ? -1.349 -4.654 -3.865 1.00 0.00 ? 15 LEU A N 12 ATOM 4726 C CA . LEU A 1 15 ? -1.081 -6.066 -4.079 1.00 0.00 ? 15 LEU A CA 12 ATOM 4727 C C . LEU A 1 15 ? -0.473 -6.665 -2.808 1.00 0.00 ? 15 LEU A C 12 ATOM 4728 O O . LEU A 1 15 ? 0.004 -5.935 -1.941 1.00 0.00 ? 15 LEU A O 12 ATOM 4729 C CB . LEU A 1 15 ? -0.216 -6.265 -5.327 1.00 0.00 ? 15 LEU A CB 12 ATOM 4730 C CG . LEU A 1 15 ? 0.621 -5.060 -5.760 1.00 0.00 ? 15 LEU A CG 12 ATOM 4731 C CD1 . LEU A 1 15 ? -0.273 -3.901 -6.202 1.00 0.00 ? 15 LEU A CD1 12 ATOM 4732 C CD2 . LEU A 1 15 ? 1.595 -4.645 -4.657 1.00 0.00 ? 15 LEU A CD2 12 ATOM 4733 N N . ASN A 1 16 ? -0.509 -7.988 -2.740 1.00 0.00 ? 16 ASN A N 12 ATOM 4734 C CA . ASN A 1 16 ? 0.032 -8.692 -1.590 1.00 0.00 ? 16 ASN A CA 12 ATOM 4735 C C . ASN A 1 16 ? -0.949 -8.583 -0.421 1.00 0.00 ? 16 ASN A C 12 ATOM 4736 O O . ASN A 1 16 ? -1.345 -9.593 0.160 1.00 0.00 ? 16 ASN A O 12 ATOM 4737 C CB . ASN A 1 16 ? 1.363 -8.082 -1.149 1.00 0.00 ? 16 ASN A CB 12 ATOM 4738 C CG . ASN A 1 16 ? 2.214 -7.684 -2.355 1.00 0.00 ? 16 ASN A CG 12 ATOM 4739 O OD1 . ASN A 1 16 ? 2.181 -6.558 -2.825 1.00 0.00 ? 16 ASN A OD1 12 ATOM 4740 N ND2 . ASN A 1 16 ? 2.971 -8.666 -2.832 1.00 0.00 ? 16 ASN A ND2 12 ATOM 4741 N N . GLY A 1 17 ? -1.317 -7.348 -0.112 1.00 0.00 ? 17 GLY A N 12 ATOM 4742 C CA . GLY A 1 17 ? -2.245 -7.093 0.977 1.00 0.00 ? 17 GLY A CA 12 ATOM 4743 C C . GLY A 1 17 ? -2.199 -5.624 1.404 1.00 0.00 ? 17 GLY A C 12 ATOM 4744 O O . GLY A 1 17 ? -1.548 -5.281 2.390 1.00 0.00 ? 17 GLY A O 12 ATOM 4745 N N . GLY A 1 18 ? -2.899 -4.797 0.642 1.00 0.00 ? 18 GLY A N 12 ATOM 4746 C CA . GLY A 1 18 ? -2.948 -3.374 0.929 1.00 0.00 ? 18 GLY A CA 12 ATOM 4747 C C . GLY A 1 18 ? -4.247 -2.753 0.413 1.00 0.00 ? 18 GLY A C 12 ATOM 4748 O O . GLY A 1 18 ? -4.807 -3.213 -0.581 1.00 0.00 ? 18 GLY A O 12 ATOM 4749 N N . VAL A 1 19 ? -4.690 -1.717 1.112 1.00 0.00 ? 19 VAL A N 12 ATOM 4750 C CA . VAL A 1 19 ? -5.913 -1.030 0.737 1.00 0.00 ? 19 VAL A CA 12 ATOM 4751 C C . VAL A 1 19 ? -5.576 0.118 -0.218 1.00 0.00 ? 19 VAL A C 12 ATOM 4752 O O . VAL A 1 19 ? -4.479 0.673 -0.162 1.00 0.00 ? 19 VAL A O 12 ATOM 4753 C CB . VAL A 1 19 ? -6.659 -0.567 1.989 1.00 0.00 ? 19 VAL A CB 12 ATOM 4754 C CG1 . VAL A 1 19 ? -8.069 -0.086 1.642 1.00 0.00 ? 19 VAL A CG1 12 ATOM 4755 C CG2 . VAL A 1 19 ? -6.700 -1.676 3.043 1.00 0.00 ? 19 VAL A CG2 12 ATOM 4756 N N . CYS A 1 20 ? -6.538 0.439 -1.070 1.00 0.00 ? 20 CYS A N 12 ATOM 4757 C CA . CYS A 1 20 ? -6.357 1.511 -2.032 1.00 0.00 ? 20 CYS A CA 12 ATOM 4758 C C . CYS A 1 20 ? -6.593 2.844 -1.320 1.00 0.00 ? 20 CYS A C 12 ATOM 4759 O O . CYS A 1 20 ? -7.546 2.981 -0.554 1.00 0.00 ? 20 CYS A O 12 ATOM 4760 C CB . CYS A 1 20 ? -7.274 1.341 -3.247 1.00 0.00 ? 20 CYS A CB 12 ATOM 4761 S SG . CYS A 1 20 ? -6.610 2.020 -4.810 1.00 0.00 ? 20 CYS A SG 12 ATOM 4762 N N . MET A 1 21 ? -5.710 3.793 -1.598 1.00 0.00 ? 21 MET A N 12 ATOM 4763 C CA . MET A 1 21 ? -5.812 5.109 -0.992 1.00 0.00 ? 21 MET A CA 12 ATOM 4764 C C . MET A 1 21 ? -5.125 6.166 -1.860 1.00 0.00 ? 21 MET A C 12 ATOM 4765 O O . MET A 1 21 ? -3.941 6.044 -2.171 1.00 0.00 ? 21 MET A O 12 ATOM 4766 C CB . MET A 1 21 ? -5.163 5.086 0.392 1.00 0.00 ? 21 MET A CB 12 ATOM 4767 C CG . MET A 1 21 ? -6.025 5.829 1.415 1.00 0.00 ? 21 MET A CG 12 ATOM 4768 S SD . MET A 1 21 ? -7.313 4.754 2.025 1.00 0.00 ? 21 MET A SD 12 ATOM 4769 C CE . MET A 1 21 ? -8.131 5.863 3.158 1.00 0.00 ? 21 MET A CE 12 ATOM 4770 N N . HIS A 1 22 ? -5.898 7.179 -2.227 1.00 0.00 ? 22 HIS A N 12 ATOM 4771 C CA . HIS A 1 22 ? -5.378 8.254 -3.052 1.00 0.00 ? 22 HIS A CA 12 ATOM 4772 C C . HIS A 1 22 ? -4.801 9.354 -2.159 1.00 0.00 ? 22 HIS A C 12 ATOM 4773 O O . HIS A 1 22 ? -5.214 9.505 -1.010 1.00 0.00 ? 22 HIS A O 12 ATOM 4774 C CB . HIS A 1 22 ? -6.455 8.772 -4.009 1.00 0.00 ? 22 HIS A CB 12 ATOM 4775 C CG . HIS A 1 22 ? -5.956 9.798 -4.997 1.00 0.00 ? 22 HIS A CG 12 ATOM 4776 N ND1 . HIS A 1 22 ? -6.639 10.968 -5.275 1.00 0.00 ? 22 HIS A ND1 12 ATOM 4777 C CD2 . HIS A 1 22 ? -4.833 9.818 -5.772 1.00 0.00 ? 22 HIS A CD2 12 ATOM 4778 C CE1 . HIS A 1 22 ? -5.952 11.653 -6.174 1.00 0.00 ? 22 HIS A CE1 12 ATOM 4779 N NE2 . HIS A 1 22 ? -4.832 10.938 -6.482 1.00 0.00 ? 22 HIS A NE2 12 ATOM 4780 N N . ILE A 1 23 ? -3.856 10.093 -2.720 1.00 0.00 ? 23 ILE A N 12 ATOM 4781 C CA . ILE A 1 23 ? -3.218 11.174 -1.989 1.00 0.00 ? 23 ILE A CA 12 ATOM 4782 C C . ILE A 1 23 ? -3.521 12.503 -2.684 1.00 0.00 ? 23 ILE A C 12 ATOM 4783 O O . ILE A 1 23 ? -4.037 12.521 -3.800 1.00 0.00 ? 23 ILE A O 12 ATOM 4784 C CB . ILE A 1 23 ? -1.723 10.896 -1.820 1.00 0.00 ? 23 ILE A CB 12 ATOM 4785 C CG1 . ILE A 1 23 ? -1.399 9.432 -2.124 1.00 0.00 ? 23 ILE A CG1 12 ATOM 4786 C CG2 . ILE A 1 23 ? -1.242 11.313 -0.429 1.00 0.00 ? 23 ILE A CG2 12 ATOM 4787 C CD1 . ILE A 1 23 ? 0.113 9.203 -2.168 1.00 0.00 ? 23 ILE A CD1 12 ATOM 4788 N N . GLU A 1 24 ? -3.192 13.584 -1.992 1.00 0.00 ? 24 GLU A N 12 ATOM 4789 C CA . GLU A 1 24 ? -3.423 14.915 -2.527 1.00 0.00 ? 24 GLU A CA 12 ATOM 4790 C C . GLU A 1 24 ? -2.109 15.695 -2.596 1.00 0.00 ? 24 GLU A C 12 ATOM 4791 O O . GLU A 1 24 ? -1.052 15.169 -2.252 1.00 0.00 ? 24 GLU A O 12 ATOM 4792 C CB . GLU A 1 24 ? -4.465 15.666 -1.697 1.00 0.00 ? 24 GLU A CB 12 ATOM 4793 C CG . GLU A 1 24 ? -5.883 15.348 -2.178 1.00 0.00 ? 24 GLU A CG 12 ATOM 4794 C CD . GLU A 1 24 ? -6.803 16.560 -2.008 1.00 0.00 ? 24 GLU A CD 12 ATOM 4795 O OE1 . GLU A 1 24 ? -6.529 17.435 -1.175 1.00 0.00 ? 24 GLU A OE1 12 ATOM 4796 O OE2 . GLU A 1 24 ? -7.835 16.572 -2.782 1.00 0.00 ? 24 GLU A OE2 12 ATOM 4797 N N . SER A 1 25 ? -2.220 16.938 -3.040 1.00 0.00 ? 25 SER A N 12 ATOM 4798 C CA . SER A 1 25 ? -1.053 17.797 -3.158 1.00 0.00 ? 25 SER A CA 12 ATOM 4799 C C . SER A 1 25 ? -0.410 17.620 -4.534 1.00 0.00 ? 25 SER A C 12 ATOM 4800 O O . SER A 1 25 ? 0.189 18.553 -5.069 1.00 0.00 ? 25 SER A O 12 ATOM 4801 C CB . SER A 1 25 ? -0.037 17.499 -2.054 1.00 0.00 ? 25 SER A CB 12 ATOM 4802 O OG . SER A 1 25 ? 0.814 18.614 -1.798 1.00 0.00 ? 25 SER A OG 12 ATOM 4803 N N . LEU A 1 26 ? -0.554 16.416 -5.070 1.00 0.00 ? 26 LEU A N 12 ATOM 4804 C CA . LEU A 1 26 ? 0.008 16.105 -6.374 1.00 0.00 ? 26 LEU A CA 12 ATOM 4805 C C . LEU A 1 26 ? -0.854 15.038 -7.052 1.00 0.00 ? 26 LEU A C 12 ATOM 4806 O O . LEU A 1 26 ? -0.414 14.391 -8.001 1.00 0.00 ? 26 LEU A O 12 ATOM 4807 C CB . LEU A 1 26 ? 1.481 15.714 -6.245 1.00 0.00 ? 26 LEU A CB 12 ATOM 4808 C CG . LEU A 1 26 ? 2.484 16.652 -6.917 1.00 0.00 ? 26 LEU A CG 12 ATOM 4809 C CD1 . LEU A 1 26 ? 3.871 16.519 -6.283 1.00 0.00 ? 26 LEU A CD1 12 ATOM 4810 C CD2 . LEU A 1 26 ? 2.521 16.424 -8.429 1.00 0.00 ? 26 LEU A CD2 12 ATOM 4811 N N . ASP A 1 27 ? -2.066 14.887 -6.538 1.00 0.00 ? 27 ASP A N 12 ATOM 4812 C CA . ASP A 1 27 ? -2.993 13.910 -7.084 1.00 0.00 ? 27 ASP A CA 12 ATOM 4813 C C . ASP A 1 27 ? -2.296 12.552 -7.184 1.00 0.00 ? 27 ASP A C 12 ATOM 4814 O O . ASP A 1 27 ? -2.504 11.813 -8.145 1.00 0.00 ? 27 ASP A O 12 ATOM 4815 C CB . ASP A 1 27 ? -3.455 14.311 -8.486 1.00 0.00 ? 27 ASP A CB 12 ATOM 4816 C CG . ASP A 1 27 ? -4.611 15.312 -8.527 1.00 0.00 ? 27 ASP A CG 12 ATOM 4817 O OD1 . ASP A 1 27 ? -5.162 15.692 -7.483 1.00 0.00 ? 27 ASP A OD1 12 ATOM 4818 O OD2 . ASP A 1 27 ? -4.946 15.708 -9.706 1.00 0.00 ? 27 ASP A OD2 12 ATOM 4819 N N . SER A 1 28 ? -1.481 12.265 -6.180 1.00 0.00 ? 28 SER A N 12 ATOM 4820 C CA . SER A 1 28 ? -0.750 11.009 -6.143 1.00 0.00 ? 28 SER A CA 12 ATOM 4821 C C . SER A 1 28 ? -1.622 9.916 -5.522 1.00 0.00 ? 28 SER A C 12 ATOM 4822 O O . SER A 1 28 ? -2.548 10.208 -4.769 1.00 0.00 ? 28 SER A O 12 ATOM 4823 C CB . SER A 1 28 ? 0.557 11.155 -5.362 1.00 0.00 ? 28 SER A CB 12 ATOM 4824 O OG . SER A 1 28 ? 1.013 9.906 -4.848 1.00 0.00 ? 28 SER A OG 12 ATOM 4825 N N . TYR A 1 29 ? -1.294 8.678 -5.862 1.00 0.00 ? 29 TYR A N 12 ATOM 4826 C CA . TYR A 1 29 ? -2.034 7.539 -5.345 1.00 0.00 ? 29 TYR A CA 12 ATOM 4827 C C . TYR A 1 29 ? -1.135 6.643 -4.490 1.00 0.00 ? 29 TYR A C 12 ATOM 4828 O O . TYR A 1 29 ? 0.057 6.516 -4.758 1.00 0.00 ? 29 TYR A O 12 ATOM 4829 C CB . TYR A 1 29 ? -2.501 6.751 -6.571 1.00 0.00 ? 29 TYR A CB 12 ATOM 4830 C CG . TYR A 1 29 ? -3.677 7.391 -7.311 1.00 0.00 ? 29 TYR A CG 12 ATOM 4831 C CD1 . TYR A 1 29 ? -3.446 8.353 -8.273 1.00 0.00 ? 29 TYR A CD1 12 ATOM 4832 C CD2 . TYR A 1 29 ? -4.969 7.005 -7.019 1.00 0.00 ? 29 TYR A CD2 12 ATOM 4833 C CE1 . TYR A 1 29 ? -4.552 8.955 -8.971 1.00 0.00 ? 29 TYR A CE1 12 ATOM 4834 C CE2 . TYR A 1 29 ? -6.076 7.605 -7.717 1.00 0.00 ? 29 TYR A CE2 12 ATOM 4835 C CZ . TYR A 1 29 ? -5.813 8.551 -8.657 1.00 0.00 ? 29 TYR A CZ 12 ATOM 4836 O OH . TYR A 1 29 ? -6.859 9.120 -9.316 1.00 0.00 ? 29 TYR A OH 12 ATOM 4837 N N . THR A 1 30 ? -1.745 6.045 -3.476 1.00 0.00 ? 30 THR A N 12 ATOM 4838 C CA . THR A 1 30 ? -1.017 5.166 -2.580 1.00 0.00 ? 30 THR A CA 12 ATOM 4839 C C . THR A 1 30 ? -1.865 3.941 -2.227 1.00 0.00 ? 30 THR A C 12 ATOM 4840 O O . THR A 1 30 ? -2.904 3.705 -2.841 1.00 0.00 ? 30 THR A O 12 ATOM 4841 C CB . THR A 1 30 ? -0.593 5.982 -1.357 1.00 0.00 ? 30 THR A CB 12 ATOM 4842 O OG1 . THR A 1 30 ? 0.242 5.095 -0.617 1.00 0.00 ? 30 THR A OG1 12 ATOM 4843 C CG2 . THR A 1 30 ? -1.761 6.269 -0.411 1.00 0.00 ? 30 THR A CG2 12 ATOM 4844 N N . CYS A 1 31 ? -1.388 3.194 -1.241 1.00 0.00 ? 31 CYS A N 12 ATOM 4845 C CA . CYS A 1 31 ? -2.090 2.000 -0.803 1.00 0.00 ? 31 CYS A CA 12 ATOM 4846 C C . CYS A 1 31 ? -1.713 1.731 0.656 1.00 0.00 ? 31 CYS A C 12 ATOM 4847 O O . CYS A 1 31 ? -0.538 1.790 1.018 1.00 0.00 ? 31 CYS A O 12 ATOM 4848 C CB . CYS A 1 31 ? -1.783 0.801 -1.701 1.00 0.00 ? 31 CYS A CB 12 ATOM 4849 S SG . CYS A 1 31 ? -3.031 0.477 -3.000 1.00 0.00 ? 31 CYS A SG 12 ATOM 4850 N N . ASN A 1 32 ? -2.730 1.443 1.453 1.00 0.00 ? 32 ASN A N 12 ATOM 4851 C CA . ASN A 1 32 ? -2.521 1.165 2.865 1.00 0.00 ? 32 ASN A CA 12 ATOM 4852 C C . ASN A 1 32 ? -1.812 -0.183 3.014 1.00 0.00 ? 32 ASN A C 12 ATOM 4853 O O . ASN A 1 32 ? -2.425 -1.234 2.832 1.00 0.00 ? 32 ASN A O 12 ATOM 4854 C CB . ASN A 1 32 ? -3.852 1.086 3.614 1.00 0.00 ? 32 ASN A CB 12 ATOM 4855 C CG . ASN A 1 32 ? -4.752 2.273 3.262 1.00 0.00 ? 32 ASN A CG 12 ATOM 4856 O OD1 . ASN A 1 32 ? -4.338 3.235 2.636 1.00 0.00 ? 32 ASN A OD1 12 ATOM 4857 N ND2 . ASN A 1 32 ? -6.001 2.151 3.699 1.00 0.00 ? 32 ASN A ND2 12 ATOM 4858 N N . CYS A 1 33 ? -0.531 -0.107 3.345 1.00 0.00 ? 33 CYS A N 12 ATOM 4859 C CA . CYS A 1 33 ? 0.267 -1.311 3.521 1.00 0.00 ? 33 CYS A CA 12 ATOM 4860 C C . CYS A 1 33 ? 0.188 -1.727 4.991 1.00 0.00 ? 33 CYS A C 12 ATOM 4861 O O . CYS A 1 33 ? -0.702 -1.288 5.719 1.00 0.00 ? 33 CYS A O 12 ATOM 4862 C CB . CYS A 1 33 ? 1.711 -1.100 3.064 1.00 0.00 ? 33 CYS A CB 12 ATOM 4863 S SG . CYS A 1 33 ? 1.901 -0.059 1.572 1.00 0.00 ? 33 CYS A SG 12 ATOM 4864 N N . VAL A 1 34 ? 1.132 -2.569 5.386 1.00 0.00 ? 34 VAL A N 12 ATOM 4865 C CA . VAL A 1 34 ? 1.180 -3.050 6.755 1.00 0.00 ? 34 VAL A CA 12 ATOM 4866 C C . VAL A 1 34 ? 2.638 -3.285 7.157 1.00 0.00 ? 34 VAL A C 12 ATOM 4867 O O . VAL A 1 34 ? 3.552 -2.980 6.395 1.00 0.00 ? 34 VAL A O 12 ATOM 4868 C CB . VAL A 1 34 ? 0.312 -4.301 6.902 1.00 0.00 ? 34 VAL A CB 12 ATOM 4869 C CG1 . VAL A 1 34 ? -1.059 -4.097 6.253 1.00 0.00 ? 34 VAL A CG1 12 ATOM 4870 C CG2 . VAL A 1 34 ? 1.014 -5.529 6.322 1.00 0.00 ? 34 VAL A CG2 12 ATOM 4871 N N . ILE A 1 35 ? 2.809 -3.825 8.356 1.00 0.00 ? 35 ILE A N 12 ATOM 4872 C CA . ILE A 1 35 ? 4.139 -4.103 8.868 1.00 0.00 ? 35 ILE A CA 12 ATOM 4873 C C . ILE A 1 35 ? 4.993 -4.715 7.754 1.00 0.00 ? 35 ILE A C 12 ATOM 4874 O O . ILE A 1 35 ? 4.550 -5.626 7.059 1.00 0.00 ? 35 ILE A O 12 ATOM 4875 C CB . ILE A 1 35 ? 4.058 -4.970 10.126 1.00 0.00 ? 35 ILE A CB 12 ATOM 4876 C CG1 . ILE A 1 35 ? 4.160 -4.113 11.390 1.00 0.00 ? 35 ILE A CG1 12 ATOM 4877 C CG2 . ILE A 1 35 ? 5.113 -6.078 10.098 1.00 0.00 ? 35 ILE A CG2 12 ATOM 4878 C CD1 . ILE A 1 35 ? 4.619 -4.950 12.585 1.00 0.00 ? 35 ILE A CD1 12 ATOM 4879 N N . GLY A 1 36 ? 6.200 -4.186 7.621 1.00 0.00 ? 36 GLY A N 12 ATOM 4880 C CA . GLY A 1 36 ? 7.119 -4.668 6.605 1.00 0.00 ? 36 GLY A CA 12 ATOM 4881 C C . GLY A 1 36 ? 6.600 -4.351 5.202 1.00 0.00 ? 36 GLY A C 12 ATOM 4882 O O . GLY A 1 36 ? 7.382 -4.063 4.296 1.00 0.00 ? 36 GLY A O 12 ATOM 4883 N N . TYR A 1 37 ? 5.284 -4.413 5.065 1.00 0.00 ? 37 TYR A N 12 ATOM 4884 C CA . TYR A 1 37 ? 4.649 -4.136 3.786 1.00 0.00 ? 37 TYR A CA 12 ATOM 4885 C C . TYR A 1 37 ? 4.580 -2.630 3.525 1.00 0.00 ? 37 TYR A C 12 ATOM 4886 O O . TYR A 1 37 ? 3.938 -1.896 4.273 1.00 0.00 ? 37 TYR A O 12 ATOM 4887 C CB . TYR A 1 37 ? 3.227 -4.689 3.891 1.00 0.00 ? 37 TYR A CB 12 ATOM 4888 C CG . TYR A 1 37 ? 3.128 -6.198 3.658 1.00 0.00 ? 37 TYR A CG 12 ATOM 4889 C CD1 . TYR A 1 37 ? 3.008 -6.691 2.375 1.00 0.00 ? 37 TYR A CD1 12 ATOM 4890 C CD2 . TYR A 1 37 ? 3.159 -7.066 4.729 1.00 0.00 ? 37 TYR A CD2 12 ATOM 4891 C CE1 . TYR A 1 37 ? 2.914 -8.111 2.152 1.00 0.00 ? 37 TYR A CE1 12 ATOM 4892 C CE2 . TYR A 1 37 ? 3.064 -8.485 4.510 1.00 0.00 ? 37 TYR A CE2 12 ATOM 4893 C CZ . TYR A 1 37 ? 2.947 -8.938 3.233 1.00 0.00 ? 37 TYR A CZ 12 ATOM 4894 O OH . TYR A 1 37 ? 2.858 -10.279 3.025 1.00 0.00 ? 37 TYR A OH 12 ATOM 4895 N N . SER A 1 38 ? 5.252 -2.214 2.459 1.00 0.00 ? 38 SER A N 12 ATOM 4896 C CA . SER A 1 38 ? 5.273 -0.811 2.089 1.00 0.00 ? 38 SER A CA 12 ATOM 4897 C C . SER A 1 38 ? 5.486 -0.670 0.580 1.00 0.00 ? 38 SER A C 12 ATOM 4898 O O . SER A 1 38 ? 5.254 -1.613 -0.173 1.00 0.00 ? 38 SER A O 12 ATOM 4899 C CB . SER A 1 38 ? 6.365 -0.056 2.852 1.00 0.00 ? 38 SER A CB 12 ATOM 4900 O OG . SER A 1 38 ? 7.669 -0.403 2.397 1.00 0.00 ? 38 SER A OG 12 ATOM 4901 N N . GLY A 1 39 ? 5.928 0.515 0.185 1.00 0.00 ? 39 GLY A N 12 ATOM 4902 C CA . GLY A 1 39 ? 6.175 0.791 -1.221 1.00 0.00 ? 39 GLY A CA 12 ATOM 4903 C C . GLY A 1 39 ? 4.861 0.977 -1.983 1.00 0.00 ? 39 GLY A C 12 ATOM 4904 O O . GLY A 1 39 ? 3.938 0.179 -1.836 1.00 0.00 ? 39 GLY A O 12 ATOM 4905 N N . ASP A 1 40 ? 4.822 2.034 -2.780 1.00 0.00 ? 40 ASP A N 12 ATOM 4906 C CA . ASP A 1 40 ? 3.636 2.334 -3.565 1.00 0.00 ? 40 ASP A CA 12 ATOM 4907 C C . ASP A 1 40 ? 2.963 1.027 -3.983 1.00 0.00 ? 40 ASP A C 12 ATOM 4908 O O . ASP A 1 40 ? 3.554 0.222 -4.701 1.00 0.00 ? 40 ASP A O 12 ATOM 4909 C CB . ASP A 1 40 ? 3.998 3.107 -4.835 1.00 0.00 ? 40 ASP A CB 12 ATOM 4910 C CG . ASP A 1 40 ? 5.042 2.431 -5.727 1.00 0.00 ? 40 ASP A CG 12 ATOM 4911 O OD1 . ASP A 1 40 ? 6.231 2.364 -5.380 1.00 0.00 ? 40 ASP A OD1 12 ATOM 4912 O OD2 . ASP A 1 40 ? 4.586 1.956 -6.837 1.00 0.00 ? 40 ASP A OD2 12 ATOM 4913 N N . ARG A 1 41 ? 1.735 0.855 -3.516 1.00 0.00 ? 41 ARG A N 12 ATOM 4914 C CA . ARG A 1 41 ? 0.974 -0.342 -3.832 1.00 0.00 ? 41 ARG A CA 12 ATOM 4915 C C . ARG A 1 41 ? 1.307 -1.460 -2.843 1.00 0.00 ? 41 ARG A C 12 ATOM 4916 O O . ARG A 1 41 ? 1.008 -2.627 -3.094 1.00 0.00 ? 41 ARG A O 12 ATOM 4917 C CB . ARG A 1 41 ? 1.271 -0.823 -5.253 1.00 0.00 ? 41 ARG A CB 12 ATOM 4918 C CG . ARG A 1 41 ? 1.229 0.340 -6.246 1.00 0.00 ? 41 ARG A CG 12 ATOM 4919 C CD . ARG A 1 41 ? 2.302 0.177 -7.327 1.00 0.00 ? 41 ARG A CD 12 ATOM 4920 N NE . ARG A 1 41 ? 2.090 -1.091 -8.063 1.00 0.00 ? 41 ARG A NE 12 ATOM 4921 C CZ . ARG A 1 41 ? 1.470 -1.176 -9.258 1.00 0.00 ? 41 ARG A CZ 12 ATOM 4922 N NH1 . ARG A 1 41 ? 2.187 -1.056 -10.360 1.00 0.00 ? 41 ARG A NH1 12 ATOM 4923 N NH2 . ARG A 1 41 ? 0.138 -1.384 -9.327 1.00 0.00 ? 41 ARG A NH2 12 ATOM 4924 N N . CYS A 1 42 ? 1.922 -1.064 -1.737 1.00 0.00 ? 42 CYS A N 12 ATOM 4925 C CA . CYS A 1 42 ? 2.298 -2.019 -0.709 1.00 0.00 ? 42 CYS A CA 12 ATOM 4926 C C . CYS A 1 42 ? 2.848 -3.272 -1.393 1.00 0.00 ? 42 CYS A C 12 ATOM 4927 O O . CYS A 1 42 ? 2.307 -4.364 -1.224 1.00 0.00 ? 42 CYS A O 12 ATOM 4928 C CB . CYS A 1 42 ? 1.125 -2.343 0.218 1.00 0.00 ? 42 CYS A CB 12 ATOM 4929 S SG . CYS A 1 42 ? 0.056 -0.916 0.631 1.00 0.00 ? 42 CYS A SG 12 ATOM 4930 N N . GLN A 1 43 ? 3.915 -3.073 -2.152 1.00 0.00 ? 43 GLN A N 12 ATOM 4931 C CA . GLN A 1 43 ? 4.543 -4.174 -2.862 1.00 0.00 ? 43 GLN A CA 12 ATOM 4932 C C . GLN A 1 43 ? 5.764 -4.676 -2.090 1.00 0.00 ? 43 GLN A C 12 ATOM 4933 O O . GLN A 1 43 ? 6.072 -5.867 -2.117 1.00 0.00 ? 43 GLN A O 12 ATOM 4934 C CB . GLN A 1 43 ? 4.928 -3.759 -4.284 1.00 0.00 ? 43 GLN A CB 12 ATOM 4935 C CG . GLN A 1 43 ? 6.379 -4.131 -4.591 1.00 0.00 ? 43 GLN A CG 12 ATOM 4936 C CD . GLN A 1 43 ? 6.827 -3.543 -5.931 1.00 0.00 ? 43 GLN A CD 12 ATOM 4937 O OE1 . GLN A 1 43 ? 6.604 -4.103 -6.990 1.00 0.00 ? 43 GLN A OE1 12 ATOM 4938 N NE2 . GLN A 1 43 ? 7.467 -2.381 -5.823 1.00 0.00 ? 43 GLN A NE2 12 ATOM 4939 N N . THR A 1 44 ? 6.425 -3.744 -1.419 1.00 0.00 ? 44 THR A N 12 ATOM 4940 C CA . THR A 1 44 ? 7.605 -4.079 -0.640 1.00 0.00 ? 44 THR A CA 12 ATOM 4941 C C . THR A 1 44 ? 7.217 -4.909 0.586 1.00 0.00 ? 44 THR A C 12 ATOM 4942 O O . THR A 1 44 ? 6.945 -4.358 1.652 1.00 0.00 ? 44 THR A O 12 ATOM 4943 C CB . THR A 1 44 ? 8.324 -2.776 -0.289 1.00 0.00 ? 44 THR A CB 12 ATOM 4944 O OG1 . THR A 1 44 ? 8.658 -2.211 -1.552 1.00 0.00 ? 44 THR A OG1 12 ATOM 4945 C CG2 . THR A 1 44 ? 9.678 -3.016 0.382 1.00 0.00 ? 44 THR A CG2 12 ATOM 4946 N N . ARG A 1 45 ? 7.203 -6.219 0.394 1.00 0.00 ? 45 ARG A N 12 ATOM 4947 C CA . ARG A 1 45 ? 6.854 -7.130 1.470 1.00 0.00 ? 45 ARG A CA 12 ATOM 4948 C C . ARG A 1 45 ? 7.886 -7.043 2.596 1.00 0.00 ? 45 ARG A C 12 ATOM 4949 O O . ARG A 1 45 ? 9.069 -6.817 2.343 1.00 0.00 ? 45 ARG A O 12 ATOM 4950 C CB . ARG A 1 45 ? 6.778 -8.572 0.969 1.00 0.00 ? 45 ARG A CB 12 ATOM 4951 C CG . ARG A 1 45 ? 5.405 -9.184 1.260 1.00 0.00 ? 45 ARG A CG 12 ATOM 4952 C CD . ARG A 1 45 ? 5.428 -10.701 1.068 1.00 0.00 ? 45 ARG A CD 12 ATOM 4953 N NE . ARG A 1 45 ? 5.641 -11.027 -0.361 1.00 0.00 ? 45 ARG A NE 12 ATOM 4954 C CZ . ARG A 1 45 ? 6.698 -11.725 -0.828 1.00 0.00 ? 45 ARG A CZ 12 ATOM 4955 N NH1 . ARG A 1 45 ? 7.829 -11.090 -1.199 1.00 0.00 ? 45 ARG A NH1 12 ATOM 4956 N NH2 . ARG A 1 45 ? 6.607 -13.040 -0.917 1.00 0.00 ? 45 ARG A NH2 12 ATOM 4957 N N . ASP A 1 46 ? 7.400 -7.226 3.815 1.00 0.00 ? 46 ASP A N 12 ATOM 4958 C CA . ASP A 1 46 ? 8.267 -7.170 4.981 1.00 0.00 ? 46 ASP A CA 12 ATOM 4959 C C . ASP A 1 46 ? 9.629 -7.772 4.629 1.00 0.00 ? 46 ASP A C 12 ATOM 4960 O O . ASP A 1 46 ? 10.645 -7.079 4.666 1.00 0.00 ? 46 ASP A O 12 ATOM 4961 C CB . ASP A 1 46 ? 7.680 -7.977 6.143 1.00 0.00 ? 46 ASP A CB 12 ATOM 4962 C CG . ASP A 1 46 ? 6.160 -7.891 6.286 1.00 0.00 ? 46 ASP A CG 12 ATOM 4963 O OD1 . ASP A 1 46 ? 5.416 -8.034 5.303 1.00 0.00 ? 46 ASP A OD1 12 ATOM 4964 O OD2 . ASP A 1 46 ? 5.737 -7.666 7.482 1.00 0.00 ? 46 ASP A OD2 12 ATOM 4965 N N . LEU A 1 47 ? 9.607 -9.053 4.294 1.00 0.00 ? 47 LEU A N 12 ATOM 4966 C CA . LEU A 1 47 ? 10.826 -9.754 3.934 1.00 0.00 ? 47 LEU A CA 12 ATOM 4967 C C . LEU A 1 47 ? 11.623 -10.064 5.203 1.00 0.00 ? 47 LEU A C 12 ATOM 4968 O O . LEU A 1 47 ? 12.843 -10.212 5.152 1.00 0.00 ? 47 LEU A O 12 ATOM 4969 C CB . LEU A 1 47 ? 11.614 -8.959 2.891 1.00 0.00 ? 47 LEU A CB 12 ATOM 4970 C CG . LEU A 1 47 ? 11.630 -9.541 1.476 1.00 0.00 ? 47 LEU A CG 12 ATOM 4971 C CD1 . LEU A 1 47 ? 11.785 -8.436 0.430 1.00 0.00 ? 47 LEU A CD1 12 ATOM 4972 C CD2 . LEU A 1 47 ? 12.710 -10.616 1.336 1.00 0.00 ? 47 LEU A CD2 12 ATOM 4973 N N . ARG A 1 48 ? 10.902 -10.154 6.309 1.00 0.00 ? 48 ARG A N 12 ATOM 4974 C CA . ARG A 1 48 ? 11.527 -10.443 7.588 1.00 0.00 ? 48 ARG A CA 12 ATOM 4975 C C . ARG A 1 48 ? 11.843 -9.143 8.331 1.00 0.00 ? 48 ARG A C 12 ATOM 4976 O O . ARG A 1 48 ? 12.966 -8.941 8.786 1.00 0.00 ? 48 ARG A O 12 ATOM 4977 C CB . ARG A 1 48 ? 12.818 -11.243 7.403 1.00 0.00 ? 48 ARG A CB 12 ATOM 4978 C CG . ARG A 1 48 ? 13.130 -12.076 8.647 1.00 0.00 ? 48 ARG A CG 12 ATOM 4979 C CD . ARG A 1 48 ? 14.296 -13.032 8.389 1.00 0.00 ? 48 ARG A CD 12 ATOM 4980 N NE . ARG A 1 48 ? 14.564 -13.842 9.597 1.00 0.00 ? 48 ARG A NE 12 ATOM 4981 C CZ . ARG A 1 48 ? 15.485 -14.828 9.658 1.00 0.00 ? 48 ARG A CZ 12 ATOM 4982 N NH1 . ARG A 1 48 ? 16.774 -14.546 9.939 1.00 0.00 ? 48 ARG A NH1 12 ATOM 4983 N NH2 . ARG A 1 48 ? 15.103 -16.073 9.439 1.00 0.00 ? 48 ARG A NH2 12 ATOM 4984 N N . TRP A 1 49 ? 10.829 -8.296 8.432 1.00 0.00 ? 49 TRP A N 12 ATOM 4985 C CA . TRP A 1 49 ? 10.985 -7.020 9.112 1.00 0.00 ? 49 TRP A CA 12 ATOM 4986 C C . TRP A 1 49 ? 10.854 -7.266 10.616 1.00 0.00 ? 49 TRP A C 12 ATOM 4987 O O . TRP A 1 49 ? 10.917 -6.330 11.410 1.00 0.00 ? 49 TRP A O 12 ATOM 4988 C CB . TRP A 1 49 ? 9.981 -5.993 8.585 1.00 0.00 ? 49 TRP A CB 12 ATOM 4989 C CG . TRP A 1 49 ? 9.568 -4.941 9.616 1.00 0.00 ? 49 TRP A CG 12 ATOM 4990 C CD1 . TRP A 1 49 ? 9.771 -3.617 9.574 1.00 0.00 ? 49 TRP A CD1 12 ATOM 4991 C CD2 . TRP A 1 49 ? 8.867 -5.182 10.856 1.00 0.00 ? 49 TRP A CD2 12 ATOM 4992 N NE1 . TRP A 1 49 ? 9.255 -2.989 10.690 1.00 0.00 ? 49 TRP A NE1 12 ATOM 4993 C CE2 . TRP A 1 49 ? 8.688 -3.970 11.493 1.00 0.00 ? 49 TRP A CE2 12 ATOM 4994 C CE3 . TRP A 1 49 ? 8.399 -6.383 11.419 1.00 0.00 ? 49 TRP A CE3 12 ATOM 4995 C CZ2 . TRP A 1 49 ? 8.039 -3.843 12.726 1.00 0.00 ? 49 TRP A CZ2 12 ATOM 4996 C CZ3 . TRP A 1 49 ? 7.754 -6.237 12.652 1.00 0.00 ? 49 TRP A CZ3 12 ATOM 4997 C CH2 . TRP A 1 49 ? 7.566 -5.026 13.307 1.00 0.00 ? 49 TRP A CH2 12 ATOM 4998 N N . TRP A 1 50 ? 10.674 -8.534 10.961 1.00 0.00 ? 50 TRP A N 12 ATOM 4999 C CA . TRP A 1 50 ? 10.535 -8.915 12.356 1.00 0.00 ? 50 TRP A CA 12 ATOM 5000 C C . TRP A 1 50 ? 11.788 -9.692 12.762 1.00 0.00 ? 50 TRP A C 12 ATOM 5001 O O . TRP A 1 50 ? 11.815 -10.921 12.682 1.00 0.00 ? 50 TRP A O 12 ATOM 5002 C CB . TRP A 1 50 ? 9.244 -9.705 12.582 1.00 0.00 ? 50 TRP A CB 12 ATOM 5003 C CG . TRP A 1 50 ? 8.240 -9.596 11.431 1.00 0.00 ? 50 TRP A CG 12 ATOM 5004 C CD1 . TRP A 1 50 ? 8.464 -9.768 10.122 1.00 0.00 ? 50 TRP A CD1 12 ATOM 5005 C CD2 . TRP A 1 50 ? 6.834 -9.284 11.543 1.00 0.00 ? 50 TRP A CD2 12 ATOM 5006 N NE1 . TRP A 1 50 ? 7.312 -9.588 9.384 1.00 0.00 ? 50 TRP A NE1 12 ATOM 5007 C CE2 . TRP A 1 50 ? 6.290 -9.287 10.276 1.00 0.00 ? 50 TRP A CE2 12 ATOM 5008 C CE3 . TRP A 1 50 ? 6.051 -9.009 12.678 1.00 0.00 ? 50 TRP A CE3 12 ATOM 5009 C CZ2 . TRP A 1 50 ? 4.938 -9.021 10.022 1.00 0.00 ? 50 TRP A CZ2 12 ATOM 5010 C CZ3 . TRP A 1 50 ? 4.702 -8.746 12.407 1.00 0.00 ? 50 TRP A CZ3 12 ATOM 5011 C CH2 . TRP A 1 50 ? 4.138 -8.745 11.137 1.00 0.00 ? 50 TRP A CH2 12 ATOM 5012 N N . GLU A 1 51 ? 12.797 -8.947 13.188 1.00 0.00 ? 51 GLU A N 12 ATOM 5013 C CA . GLU A 1 51 ? 14.051 -9.551 13.606 1.00 0.00 ? 51 GLU A CA 12 ATOM 5014 C C . GLU A 1 51 ? 14.882 -8.546 14.405 1.00 0.00 ? 51 GLU A C 12 ATOM 5015 O O . GLU A 1 51 ? 15.270 -8.819 15.539 1.00 0.00 ? 51 GLU A O 12 ATOM 5016 C CB . GLU A 1 51 ? 14.834 -10.076 12.402 1.00 0.00 ? 51 GLU A CB 12 ATOM 5017 C CG . GLU A 1 51 ? 14.324 -9.453 11.101 1.00 0.00 ? 51 GLU A CG 12 ATOM 5018 C CD . GLU A 1 51 ? 15.371 -9.569 9.990 1.00 0.00 ? 51 GLU A CD 12 ATOM 5019 O OE1 . GLU A 1 51 ? 15.422 -10.592 9.291 1.00 0.00 ? 51 GLU A OE1 12 ATOM 5020 O OE2 . GLU A 1 51 ? 16.149 -8.548 9.866 1.00 0.00 ? 51 GLU A OE2 12 ATOM 5021 N N . LEU A 1 52 ? 15.134 -7.403 13.781 1.00 0.00 ? 52 LEU A N 12 ATOM 5022 C CA . LEU A 1 52 ? 15.913 -6.358 14.420 1.00 0.00 ? 52 LEU A CA 12 ATOM 5023 C C . LEU A 1 52 ? 15.022 -5.137 14.659 1.00 0.00 ? 52 LEU A C 12 ATOM 5024 O O . LEU A 1 52 ? 14.892 -4.672 15.791 1.00 0.00 ? 52 LEU A O 12 ATOM 5025 C CB . LEU A 1 52 ? 17.168 -6.050 13.601 1.00 0.00 ? 52 LEU A CB 12 ATOM 5026 C CG . LEU A 1 52 ? 18.248 -7.133 13.597 1.00 0.00 ? 52 LEU A CG 12 ATOM 5027 C CD1 . LEU A 1 52 ? 18.913 -7.241 12.223 1.00 0.00 ? 52 LEU A CD1 12 ATOM 5028 C CD2 . LEU A 1 52 ? 19.270 -6.895 14.710 1.00 0.00 ? 52 LEU A CD2 12 ATOM 5029 N N . ARG A 1 53 ? 14.429 -4.655 13.577 1.00 0.00 ? 53 ARG A N 12 ATOM 5030 C CA . ARG A 1 53 ? 13.553 -3.498 13.655 1.00 0.00 ? 53 ARG A CA 12 ATOM 5031 C C . ARG A 1 53 ? 14.337 -2.271 14.123 1.00 0.00 ? 53 ARG A C 12 ATOM 5032 O O . ARG A 1 53 ? 14.878 -2.260 15.228 1.00 0.00 ? 53 ARG A O 12 ATOM 5033 C CB . ARG A 1 53 ? 12.391 -3.752 14.617 1.00 0.00 ? 53 ARG A CB 12 ATOM 5034 C CG . ARG A 1 53 ? 11.190 -2.869 14.271 1.00 0.00 ? 53 ARG A CG 12 ATOM 5035 C CD . ARG A 1 53 ? 10.072 -3.036 15.303 1.00 0.00 ? 53 ARG A CD 12 ATOM 5036 N NE . ARG A 1 53 ? 10.426 -2.328 16.552 1.00 0.00 ? 53 ARG A NE 12 ATOM 5037 C CZ . ARG A 1 53 ? 10.037 -1.068 16.842 1.00 0.00 ? 53 ARG A CZ 12 ATOM 5038 N NH1 . ARG A 1 53 ? 8.853 -0.837 17.448 1.00 0.00 ? 53 ARG A NH1 12 ATOM 5039 N NH2 . ARG A 1 53 ? 10.835 -0.063 16.526 1.00 0.00 ? 53 ARG A NH2 12 ATOM 5040 O OXT . ARG A 1 53 ? 14.369 -1.292 13.285 1.00 0.00 ? 53 ARG A OXT 12 ATOM 5041 N N . ASN A 1 1 ? -1.202 12.869 4.186 1.00 0.00 ? 1 ASN A N 13 ATOM 5042 C CA . ASN A 1 1 ? -2.504 13.133 3.598 1.00 0.00 ? 1 ASN A CA 13 ATOM 5043 C C . ASN A 1 1 ? -2.927 11.938 2.743 1.00 0.00 ? 1 ASN A C 13 ATOM 5044 O O . ASN A 1 1 ? -2.101 11.345 2.048 1.00 0.00 ? 1 ASN A O 13 ATOM 5045 C CB . ASN A 1 1 ? -2.460 14.368 2.694 1.00 0.00 ? 1 ASN A CB 13 ATOM 5046 C CG . ASN A 1 1 ? -2.196 15.636 3.511 1.00 0.00 ? 1 ASN A CG 13 ATOM 5047 O OD1 . ASN A 1 1 ? -3.093 16.245 4.066 1.00 0.00 ? 1 ASN A OD1 13 ATOM 5048 N ND2 . ASN A 1 1 ? -0.916 15.996 3.549 1.00 0.00 ? 1 ASN A ND2 13 ATOM 5049 N N . SER A 1 2 ? -4.208 11.616 2.824 1.00 0.00 ? 2 SER A N 13 ATOM 5050 C CA . SER A 1 2 ? -4.750 10.500 2.067 1.00 0.00 ? 2 SER A CA 13 ATOM 5051 C C . SER A 1 2 ? -6.248 10.704 1.834 1.00 0.00 ? 2 SER A C 13 ATOM 5052 O O . SER A 1 2 ? -6.898 11.447 2.565 1.00 0.00 ? 2 SER A O 13 ATOM 5053 C CB . SER A 1 2 ? -4.500 9.173 2.786 1.00 0.00 ? 2 SER A CB 13 ATOM 5054 O OG . SER A 1 2 ? -3.124 8.995 3.114 1.00 0.00 ? 2 SER A OG 13 ATOM 5055 N N . TYR A 1 3 ? -6.753 10.029 0.812 1.00 0.00 ? 3 TYR A N 13 ATOM 5056 C CA . TYR A 1 3 ? -8.164 10.126 0.474 1.00 0.00 ? 3 TYR A CA 13 ATOM 5057 C C . TYR A 1 3 ? -8.705 8.778 -0.007 1.00 0.00 ? 3 TYR A C 13 ATOM 5058 O O . TYR A 1 3 ? -8.026 8.054 -0.733 1.00 0.00 ? 3 TYR A O 13 ATOM 5059 C CB . TYR A 1 3 ? -8.253 11.136 -0.670 1.00 0.00 ? 3 TYR A CB 13 ATOM 5060 C CG . TYR A 1 3 ? -7.933 12.573 -0.258 1.00 0.00 ? 3 TYR A CG 13 ATOM 5061 C CD1 . TYR A 1 3 ? -6.635 12.929 0.050 1.00 0.00 ? 3 TYR A CD1 13 ATOM 5062 C CD2 . TYR A 1 3 ? -8.939 13.515 -0.195 1.00 0.00 ? 3 TYR A CD2 13 ATOM 5063 C CE1 . TYR A 1 3 ? -6.333 14.283 0.440 1.00 0.00 ? 3 TYR A CE1 13 ATOM 5064 C CE2 . TYR A 1 3 ? -8.638 14.867 0.193 1.00 0.00 ? 3 TYR A CE2 13 ATOM 5065 C CZ . TYR A 1 3 ? -7.350 15.186 0.491 1.00 0.00 ? 3 TYR A CZ 13 ATOM 5066 O OH . TYR A 1 3 ? -7.063 16.463 0.857 1.00 0.00 ? 3 TYR A OH 13 ATOM 5067 N N . PRO A 1 4 ? -9.957 8.473 0.428 1.00 0.00 ? 4 PRO A N 13 ATOM 5068 C CA . PRO A 1 4 ? -10.599 7.227 0.048 1.00 0.00 ? 4 PRO A CA 13 ATOM 5069 C C . PRO A 1 4 ? -11.077 7.274 -1.405 1.00 0.00 ? 4 PRO A C 13 ATOM 5070 O O . PRO A 1 4 ? -12.243 7.568 -1.669 1.00 0.00 ? 4 PRO A O 13 ATOM 5071 C CB . PRO A 1 4 ? -11.735 7.051 1.041 1.00 0.00 ? 4 PRO A CB 13 ATOM 5072 C CG . PRO A 1 4 ? -11.978 8.425 1.643 1.00 0.00 ? 4 PRO A CG 13 ATOM 5073 C CD . PRO A 1 4 ? -10.794 9.307 1.286 1.00 0.00 ? 4 PRO A CD 13 ATOM 5074 N N . GLY A 1 5 ? -10.153 6.982 -2.308 1.00 0.00 ? 5 GLY A N 13 ATOM 5075 C CA . GLY A 1 5 ? -10.464 6.988 -3.728 1.00 0.00 ? 5 GLY A CA 13 ATOM 5076 C C . GLY A 1 5 ? -9.736 5.856 -4.453 1.00 0.00 ? 5 GLY A C 13 ATOM 5077 O O . GLY A 1 5 ? -8.780 5.289 -3.926 1.00 0.00 ? 5 GLY A O 13 ATOM 5078 N N . CYS A 1 6 ? -10.213 5.562 -5.654 1.00 0.00 ? 6 CYS A N 13 ATOM 5079 C CA . CYS A 1 6 ? -9.618 4.509 -6.459 1.00 0.00 ? 6 CYS A CA 13 ATOM 5080 C C . CYS A 1 6 ? -10.449 4.351 -7.733 1.00 0.00 ? 6 CYS A C 13 ATOM 5081 O O . CYS A 1 6 ? -11.591 3.892 -7.682 1.00 0.00 ? 6 CYS A O 13 ATOM 5082 C CB . CYS A 1 6 ? -9.510 3.195 -5.680 1.00 0.00 ? 6 CYS A CB 13 ATOM 5083 S SG . CYS A 1 6 ? -7.885 2.363 -5.802 1.00 0.00 ? 6 CYS A SG 13 ATOM 5084 N N . PRO A 1 7 ? -9.830 4.747 -8.876 1.00 0.00 ? 7 PRO A N 13 ATOM 5085 C CA . PRO A 1 7 ? -10.500 4.653 -10.162 1.00 0.00 ? 7 PRO A CA 13 ATOM 5086 C C . PRO A 1 7 ? -10.549 3.205 -10.652 1.00 0.00 ? 7 PRO A C 13 ATOM 5087 O O . PRO A 1 7 ? -11.562 2.761 -11.191 1.00 0.00 ? 7 PRO A O 13 ATOM 5088 C CB . PRO A 1 7 ? -9.711 5.565 -11.086 1.00 0.00 ? 7 PRO A CB 13 ATOM 5089 C CG . PRO A 1 7 ? -8.362 5.772 -10.415 1.00 0.00 ? 7 PRO A CG 13 ATOM 5090 C CD . PRO A 1 7 ? -8.480 5.294 -8.976 1.00 0.00 ? 7 PRO A CD 13 ATOM 5091 N N . SER A 1 8 ? -9.443 2.506 -10.445 1.00 0.00 ? 8 SER A N 13 ATOM 5092 C CA . SER A 1 8 ? -9.346 1.117 -10.856 1.00 0.00 ? 8 SER A CA 13 ATOM 5093 C C . SER A 1 8 ? -8.692 1.025 -12.238 1.00 0.00 ? 8 SER A C 13 ATOM 5094 O O . SER A 1 8 ? -8.414 -0.071 -12.725 1.00 0.00 ? 8 SER A O 13 ATOM 5095 C CB . SER A 1 8 ? -10.724 0.451 -10.876 1.00 0.00 ? 8 SER A CB 13 ATOM 5096 O OG . SER A 1 8 ? -11.362 0.581 -12.143 1.00 0.00 ? 8 SER A OG 13 ATOM 5097 N N . SER A 1 9 ? -8.469 2.189 -12.830 1.00 0.00 ? 9 SER A N 13 ATOM 5098 C CA . SER A 1 9 ? -7.855 2.253 -14.145 1.00 0.00 ? 9 SER A CA 13 ATOM 5099 C C . SER A 1 9 ? -6.349 2.004 -14.030 1.00 0.00 ? 9 SER A C 13 ATOM 5100 O O . SER A 1 9 ? -5.639 2.001 -15.035 1.00 0.00 ? 9 SER A O 13 ATOM 5101 C CB . SER A 1 9 ? -8.120 3.605 -14.811 1.00 0.00 ? 9 SER A CB 13 ATOM 5102 O OG . SER A 1 9 ? -7.690 3.623 -16.169 1.00 0.00 ? 9 SER A OG 13 ATOM 5103 N N . TYR A 1 10 ? -5.907 1.801 -12.799 1.00 0.00 ? 10 TYR A N 13 ATOM 5104 C CA . TYR A 1 10 ? -4.499 1.551 -12.542 1.00 0.00 ? 10 TYR A CA 13 ATOM 5105 C C . TYR A 1 10 ? -4.166 0.067 -12.709 1.00 0.00 ? 10 TYR A C 13 ATOM 5106 O O . TYR A 1 10 ? -3.797 -0.371 -13.798 1.00 0.00 ? 10 TYR A O 13 ATOM 5107 C CB . TYR A 1 10 ? -4.258 1.953 -11.084 1.00 0.00 ? 10 TYR A CB 13 ATOM 5108 C CG . TYR A 1 10 ? -4.298 3.463 -10.842 1.00 0.00 ? 10 TYR A CG 13 ATOM 5109 C CD1 . TYR A 1 10 ? -3.388 4.286 -11.474 1.00 0.00 ? 10 TYR A CD1 13 ATOM 5110 C CD2 . TYR A 1 10 ? -5.242 4.001 -9.992 1.00 0.00 ? 10 TYR A CD2 13 ATOM 5111 C CE1 . TYR A 1 10 ? -3.424 5.708 -11.245 1.00 0.00 ? 10 TYR A CE1 13 ATOM 5112 C CE2 . TYR A 1 10 ? -5.278 5.423 -9.764 1.00 0.00 ? 10 TYR A CE2 13 ATOM 5113 C CZ . TYR A 1 10 ? -4.367 6.206 -10.401 1.00 0.00 ? 10 TYR A CZ 13 ATOM 5114 O OH . TYR A 1 10 ? -4.402 7.548 -10.186 1.00 0.00 ? 10 TYR A OH 13 ATOM 5115 N N . ASP A 1 11 ? -4.307 -0.667 -11.614 1.00 0.00 ? 11 ASP A N 13 ATOM 5116 C CA . ASP A 1 11 ? -4.026 -2.092 -11.627 1.00 0.00 ? 11 ASP A CA 13 ATOM 5117 C C . ASP A 1 11 ? -3.719 -2.560 -10.203 1.00 0.00 ? 11 ASP A C 13 ATOM 5118 O O . ASP A 1 11 ? -2.566 -2.552 -9.776 1.00 0.00 ? 11 ASP A O 13 ATOM 5119 C CB . ASP A 1 11 ? -2.806 -2.406 -12.499 1.00 0.00 ? 11 ASP A CB 13 ATOM 5120 C CG . ASP A 1 11 ? -3.125 -3.076 -13.838 1.00 0.00 ? 11 ASP A CG 13 ATOM 5121 O OD1 . ASP A 1 11 ? -3.758 -4.141 -13.883 1.00 0.00 ? 11 ASP A OD1 13 ATOM 5122 O OD2 . ASP A 1 11 ? -2.689 -2.451 -14.877 1.00 0.00 ? 11 ASP A OD2 13 ATOM 5123 N N . GLY A 1 12 ? -4.774 -2.957 -9.505 1.00 0.00 ? 12 GLY A N 13 ATOM 5124 C CA . GLY A 1 12 ? -4.632 -3.427 -8.137 1.00 0.00 ? 12 GLY A CA 13 ATOM 5125 C C . GLY A 1 12 ? -3.609 -2.588 -7.372 1.00 0.00 ? 12 GLY A C 13 ATOM 5126 O O . GLY A 1 12 ? -2.678 -3.127 -6.777 1.00 0.00 ? 12 GLY A O 13 ATOM 5127 N N . TYR A 1 13 ? -3.815 -1.279 -7.412 1.00 0.00 ? 13 TYR A N 13 ATOM 5128 C CA . TYR A 1 13 ? -2.921 -0.359 -6.729 1.00 0.00 ? 13 TYR A CA 13 ATOM 5129 C C . TYR A 1 13 ? -2.574 -0.869 -5.329 1.00 0.00 ? 13 TYR A C 13 ATOM 5130 O O . TYR A 1 13 ? -1.559 -0.478 -4.757 1.00 0.00 ? 13 TYR A O 13 ATOM 5131 C CB . TYR A 1 13 ? -3.687 0.959 -6.603 1.00 0.00 ? 13 TYR A CB 13 ATOM 5132 C CG . TYR A 1 13 ? -2.824 2.204 -6.818 1.00 0.00 ? 13 TYR A CG 13 ATOM 5133 C CD1 . TYR A 1 13 ? -1.956 2.620 -5.829 1.00 0.00 ? 13 TYR A CD1 13 ATOM 5134 C CD2 . TYR A 1 13 ? -2.913 2.909 -8.000 1.00 0.00 ? 13 TYR A CD2 13 ATOM 5135 C CE1 . TYR A 1 13 ? -1.144 3.791 -6.031 1.00 0.00 ? 13 TYR A CE1 13 ATOM 5136 C CE2 . TYR A 1 13 ? -2.101 4.081 -8.201 1.00 0.00 ? 13 TYR A CE2 13 ATOM 5137 C CZ . TYR A 1 13 ? -1.256 4.465 -7.207 1.00 0.00 ? 13 TYR A CZ 13 ATOM 5138 O OH . TYR A 1 13 ? -0.488 5.571 -7.396 1.00 0.00 ? 13 TYR A OH 13 ATOM 5139 N N . CYS A 1 14 ? -3.439 -1.735 -4.819 1.00 0.00 ? 14 CYS A N 13 ATOM 5140 C CA . CYS A 1 14 ? -3.237 -2.302 -3.496 1.00 0.00 ? 14 CYS A CA 13 ATOM 5141 C C . CYS A 1 14 ? -3.382 -3.821 -3.597 1.00 0.00 ? 14 CYS A C 13 ATOM 5142 O O . CYS A 1 14 ? -4.482 -4.331 -3.811 1.00 0.00 ? 14 CYS A O 13 ATOM 5143 C CB . CYS A 1 14 ? -4.201 -1.703 -2.471 1.00 0.00 ? 14 CYS A CB 13 ATOM 5144 S SG . CYS A 1 14 ? -4.919 -0.089 -2.944 1.00 0.00 ? 14 CYS A SG 13 ATOM 5145 N N . LEU A 1 15 ? -2.257 -4.504 -3.443 1.00 0.00 ? 15 LEU A N 13 ATOM 5146 C CA . LEU A 1 15 ? -2.246 -5.956 -3.516 1.00 0.00 ? 15 LEU A CA 13 ATOM 5147 C C . LEU A 1 15 ? -1.611 -6.520 -2.243 1.00 0.00 ? 15 LEU A C 13 ATOM 5148 O O . LEU A 1 15 ? -0.972 -5.789 -1.487 1.00 0.00 ? 15 LEU A O 13 ATOM 5149 C CB . LEU A 1 15 ? -1.563 -6.422 -4.804 1.00 0.00 ? 15 LEU A CB 13 ATOM 5150 C CG . LEU A 1 15 ? -0.841 -5.341 -5.610 1.00 0.00 ? 15 LEU A CG 13 ATOM 5151 C CD1 . LEU A 1 15 ? 0.531 -5.031 -5.007 1.00 0.00 ? 15 LEU A CD1 13 ATOM 5152 C CD2 . LEU A 1 15 ? -0.743 -5.733 -7.086 1.00 0.00 ? 15 LEU A CD2 13 ATOM 5153 N N . ASN A 1 16 ? -1.812 -7.815 -2.045 1.00 0.00 ? 16 ASN A N 13 ATOM 5154 C CA . ASN A 1 16 ? -1.266 -8.486 -0.878 1.00 0.00 ? 16 ASN A CA 13 ATOM 5155 C C . ASN A 1 16 ? -2.192 -8.251 0.319 1.00 0.00 ? 16 ASN A C 13 ATOM 5156 O O . ASN A 1 16 ? -2.632 -9.202 0.964 1.00 0.00 ? 16 ASN A O 13 ATOM 5157 C CB . ASN A 1 16 ? 0.115 -7.935 -0.520 1.00 0.00 ? 16 ASN A CB 13 ATOM 5158 C CG . ASN A 1 16 ? 0.984 -7.780 -1.769 1.00 0.00 ? 16 ASN A CG 13 ATOM 5159 O OD1 . ASN A 1 16 ? 0.515 -7.846 -2.895 1.00 0.00 ? 16 ASN A OD1 13 ATOM 5160 N ND2 . ASN A 1 16 ? 2.270 -7.570 -1.511 1.00 0.00 ? 16 ASN A ND2 13 ATOM 5161 N N . GLY A 1 17 ? -2.460 -6.980 0.579 1.00 0.00 ? 17 GLY A N 13 ATOM 5162 C CA . GLY A 1 17 ? -3.326 -6.607 1.685 1.00 0.00 ? 17 GLY A CA 13 ATOM 5163 C C . GLY A 1 17 ? -3.128 -5.140 2.067 1.00 0.00 ? 17 GLY A C 13 ATOM 5164 O O . GLY A 1 17 ? -2.448 -4.835 3.047 1.00 0.00 ? 17 GLY A O 13 ATOM 5165 N N . GLY A 1 18 ? -3.732 -4.268 1.272 1.00 0.00 ? 18 GLY A N 13 ATOM 5166 C CA . GLY A 1 18 ? -3.631 -2.840 1.515 1.00 0.00 ? 18 GLY A CA 13 ATOM 5167 C C . GLY A 1 18 ? -4.871 -2.107 1.001 1.00 0.00 ? 18 GLY A C 13 ATOM 5168 O O . GLY A 1 18 ? -5.488 -2.534 0.026 1.00 0.00 ? 18 GLY A O 13 ATOM 5169 N N . VAL A 1 19 ? -5.197 -1.015 1.678 1.00 0.00 ? 19 VAL A N 13 ATOM 5170 C CA . VAL A 1 19 ? -6.353 -0.219 1.301 1.00 0.00 ? 19 VAL A CA 13 ATOM 5171 C C . VAL A 1 19 ? -5.947 0.777 0.212 1.00 0.00 ? 19 VAL A C 13 ATOM 5172 O O . VAL A 1 19 ? -4.760 0.964 -0.052 1.00 0.00 ? 19 VAL A O 13 ATOM 5173 C CB . VAL A 1 19 ? -6.949 0.457 2.537 1.00 0.00 ? 19 VAL A CB 13 ATOM 5174 C CG1 . VAL A 1 19 ? -6.382 1.865 2.719 1.00 0.00 ? 19 VAL A CG1 13 ATOM 5175 C CG2 . VAL A 1 19 ? -8.476 0.485 2.463 1.00 0.00 ? 19 VAL A CG2 13 ATOM 5176 N N . CYS A 1 20 ? -6.956 1.391 -0.389 1.00 0.00 ? 20 CYS A N 13 ATOM 5177 C CA . CYS A 1 20 ? -6.718 2.364 -1.443 1.00 0.00 ? 20 CYS A CA 13 ATOM 5178 C C . CYS A 1 20 ? -6.844 3.764 -0.841 1.00 0.00 ? 20 CYS A C 13 ATOM 5179 O O . CYS A 1 20 ? -7.848 4.083 -0.205 1.00 0.00 ? 20 CYS A O 13 ATOM 5180 C CB . CYS A 1 20 ? -7.671 2.161 -2.623 1.00 0.00 ? 20 CYS A CB 13 ATOM 5181 S SG . CYS A 1 20 ? -7.176 3.017 -4.164 1.00 0.00 ? 20 CYS A SG 13 ATOM 5182 N N . MET A 1 21 ? -5.811 4.564 -1.063 1.00 0.00 ? 21 MET A N 13 ATOM 5183 C CA . MET A 1 21 ? -5.793 5.923 -0.549 1.00 0.00 ? 21 MET A CA 13 ATOM 5184 C C . MET A 1 21 ? -5.235 6.895 -1.591 1.00 0.00 ? 21 MET A C 13 ATOM 5185 O O . MET A 1 21 ? -4.077 6.786 -1.989 1.00 0.00 ? 21 MET A O 13 ATOM 5186 C CB . MET A 1 21 ? -4.934 5.980 0.715 1.00 0.00 ? 21 MET A CB 13 ATOM 5187 C CG . MET A 1 21 ? -5.781 5.728 1.965 1.00 0.00 ? 21 MET A CG 13 ATOM 5188 S SD . MET A 1 21 ? -7.034 6.987 2.119 1.00 0.00 ? 21 MET A SD 13 ATOM 5189 C CE . MET A 1 21 ? -7.469 6.784 3.838 1.00 0.00 ? 21 MET A CE 13 ATOM 5190 N N . HIS A 1 22 ? -6.086 7.825 -2.003 1.00 0.00 ? 22 HIS A N 13 ATOM 5191 C CA . HIS A 1 22 ? -5.692 8.815 -2.990 1.00 0.00 ? 22 HIS A CA 13 ATOM 5192 C C . HIS A 1 22 ? -5.013 9.993 -2.292 1.00 0.00 ? 22 HIS A C 13 ATOM 5193 O O . HIS A 1 22 ? -5.470 10.447 -1.243 1.00 0.00 ? 22 HIS A O 13 ATOM 5194 C CB . HIS A 1 22 ? -6.891 9.240 -3.841 1.00 0.00 ? 22 HIS A CB 13 ATOM 5195 C CG . HIS A 1 22 ? -6.528 10.105 -5.024 1.00 0.00 ? 22 HIS A CG 13 ATOM 5196 N ND1 . HIS A 1 22 ? -7.313 11.163 -5.447 1.00 0.00 ? 22 HIS A ND1 13 ATOM 5197 C CD2 . HIS A 1 22 ? -5.457 10.058 -5.868 1.00 0.00 ? 22 HIS A CD2 13 ATOM 5198 C CE1 . HIS A 1 22 ? -6.732 11.722 -6.498 1.00 0.00 ? 22 HIS A CE1 13 ATOM 5199 N NE2 . HIS A 1 22 ? -5.583 11.034 -6.758 1.00 0.00 ? 22 HIS A NE2 13 ATOM 5200 N N . ILE A 1 23 ? -3.931 10.457 -2.901 1.00 0.00 ? 23 ILE A N 13 ATOM 5201 C CA . ILE A 1 23 ? -3.186 11.576 -2.351 1.00 0.00 ? 23 ILE A CA 13 ATOM 5202 C C . ILE A 1 23 ? -3.623 12.866 -3.045 1.00 0.00 ? 23 ILE A C 13 ATOM 5203 O O . ILE A 1 23 ? -4.141 12.832 -4.160 1.00 0.00 ? 23 ILE A O 13 ATOM 5204 C CB . ILE A 1 23 ? -1.681 11.310 -2.438 1.00 0.00 ? 23 ILE A CB 13 ATOM 5205 C CG1 . ILE A 1 23 ? -1.400 9.835 -2.732 1.00 0.00 ? 23 ILE A CG1 13 ATOM 5206 C CG2 . ILE A 1 23 ? -0.966 11.788 -1.173 1.00 0.00 ? 23 ILE A CG2 13 ATOM 5207 C CD1 . ILE A 1 23 ? 0.084 9.512 -2.553 1.00 0.00 ? 23 ILE A CD1 13 ATOM 5208 N N . GLU A 1 24 ? -3.397 13.977 -2.358 1.00 0.00 ? 24 GLU A N 13 ATOM 5209 C CA . GLU A 1 24 ? -3.762 15.277 -2.894 1.00 0.00 ? 24 GLU A CA 13 ATOM 5210 C C . GLU A 1 24 ? -2.519 16.156 -3.046 1.00 0.00 ? 24 GLU A C 13 ATOM 5211 O O . GLU A 1 24 ? -2.595 17.261 -3.582 1.00 0.00 ? 24 GLU A O 13 ATOM 5212 C CB . GLU A 1 24 ? -4.811 15.959 -2.013 1.00 0.00 ? 24 GLU A CB 13 ATOM 5213 C CG . GLU A 1 24 ? -6.153 16.064 -2.741 1.00 0.00 ? 24 GLU A CG 13 ATOM 5214 C CD . GLU A 1 24 ? -7.028 17.158 -2.125 1.00 0.00 ? 24 GLU A CD 13 ATOM 5215 O OE1 . GLU A 1 24 ? -6.733 18.360 -2.488 1.00 0.00 ? 24 GLU A OE1 13 ATOM 5216 O OE2 . GLU A 1 24 ? -7.937 16.856 -1.339 1.00 0.00 ? 24 GLU A OE2 13 ATOM 5217 N N . SER A 1 25 ? -1.401 15.632 -2.565 1.00 0.00 ? 25 SER A N 13 ATOM 5218 C CA . SER A 1 25 ? -0.143 16.356 -2.641 1.00 0.00 ? 25 SER A CA 13 ATOM 5219 C C . SER A 1 25 ? 0.178 16.695 -4.098 1.00 0.00 ? 25 SER A C 13 ATOM 5220 O O . SER A 1 25 ? 0.867 17.676 -4.372 1.00 0.00 ? 25 SER A O 13 ATOM 5221 C CB . SER A 1 25 ? 0.997 15.544 -2.021 1.00 0.00 ? 25 SER A CB 13 ATOM 5222 O OG . SER A 1 25 ? 2.220 16.274 -1.998 1.00 0.00 ? 25 SER A OG 13 ATOM 5223 N N . LEU A 1 26 ? -0.336 15.865 -4.993 1.00 0.00 ? 26 LEU A N 13 ATOM 5224 C CA . LEU A 1 26 ? -0.113 16.065 -6.415 1.00 0.00 ? 26 LEU A CA 13 ATOM 5225 C C . LEU A 1 26 ? -1.153 15.272 -7.207 1.00 0.00 ? 26 LEU A C 13 ATOM 5226 O O . LEU A 1 26 ? -0.908 14.888 -8.349 1.00 0.00 ? 26 LEU A O 13 ATOM 5227 C CB . LEU A 1 26 ? 1.332 15.723 -6.783 1.00 0.00 ? 26 LEU A CB 13 ATOM 5228 C CG . LEU A 1 26 ? 2.208 16.898 -7.220 1.00 0.00 ? 26 LEU A CG 13 ATOM 5229 C CD1 . LEU A 1 26 ? 3.683 16.490 -7.282 1.00 0.00 ? 26 LEU A CD1 13 ATOM 5230 C CD2 . LEU A 1 26 ? 1.721 17.485 -8.545 1.00 0.00 ? 26 LEU A CD2 13 ATOM 5231 N N . ASP A 1 27 ? -2.292 15.046 -6.568 1.00 0.00 ? 27 ASP A N 13 ATOM 5232 C CA . ASP A 1 27 ? -3.371 14.305 -7.199 1.00 0.00 ? 27 ASP A CA 13 ATOM 5233 C C . ASP A 1 27 ? -2.907 12.874 -7.475 1.00 0.00 ? 27 ASP A C 13 ATOM 5234 O O . ASP A 1 27 ? -3.422 12.214 -8.376 1.00 0.00 ? 27 ASP A O 13 ATOM 5235 C CB . ASP A 1 27 ? -3.770 14.939 -8.532 1.00 0.00 ? 27 ASP A CB 13 ATOM 5236 C CG . ASP A 1 27 ? -5.273 14.971 -8.810 1.00 0.00 ? 27 ASP A CG 13 ATOM 5237 O OD1 . ASP A 1 27 ? -6.011 15.793 -8.245 1.00 0.00 ? 27 ASP A OD1 13 ATOM 5238 O OD2 . ASP A 1 27 ? -5.689 14.092 -9.659 1.00 0.00 ? 27 ASP A OD2 13 ATOM 5239 N N . SER A 1 28 ? -1.939 12.437 -6.684 1.00 0.00 ? 28 SER A N 13 ATOM 5240 C CA . SER A 1 28 ? -1.398 11.097 -6.833 1.00 0.00 ? 28 SER A CA 13 ATOM 5241 C C . SER A 1 28 ? -2.229 10.103 -6.019 1.00 0.00 ? 28 SER A C 13 ATOM 5242 O O . SER A 1 28 ? -3.025 10.504 -5.170 1.00 0.00 ? 28 SER A O 13 ATOM 5243 C CB . SER A 1 28 ? 0.069 11.042 -6.400 1.00 0.00 ? 28 SER A CB 13 ATOM 5244 O OG . SER A 1 28 ? 0.478 9.717 -6.070 1.00 0.00 ? 28 SER A OG 13 ATOM 5245 N N . TYR A 1 29 ? -2.018 8.827 -6.307 1.00 0.00 ? 29 TYR A N 13 ATOM 5246 C CA . TYR A 1 29 ? -2.739 7.775 -5.611 1.00 0.00 ? 29 TYR A CA 13 ATOM 5247 C C . TYR A 1 29 ? -1.777 6.865 -4.845 1.00 0.00 ? 29 TYR A C 13 ATOM 5248 O O . TYR A 1 29 ? -0.643 6.653 -5.274 1.00 0.00 ? 29 TYR A O 13 ATOM 5249 C CB . TYR A 1 29 ? -3.441 6.956 -6.696 1.00 0.00 ? 29 TYR A CB 13 ATOM 5250 C CG . TYR A 1 29 ? -4.887 7.380 -6.958 1.00 0.00 ? 29 TYR A CG 13 ATOM 5251 C CD1 . TYR A 1 29 ? -5.162 8.356 -7.894 1.00 0.00 ? 29 TYR A CD1 13 ATOM 5252 C CD2 . TYR A 1 29 ? -5.917 6.785 -6.259 1.00 0.00 ? 29 TYR A CD2 13 ATOM 5253 C CE1 . TYR A 1 29 ? -6.523 8.755 -8.139 1.00 0.00 ? 29 TYR A CE1 13 ATOM 5254 C CE2 . TYR A 1 29 ? -7.279 7.185 -6.506 1.00 0.00 ? 29 TYR A CE2 13 ATOM 5255 C CZ . TYR A 1 29 ? -7.515 8.149 -7.433 1.00 0.00 ? 29 TYR A CZ 13 ATOM 5256 O OH . TYR A 1 29 ? -8.802 8.527 -7.666 1.00 0.00 ? 29 TYR A OH 13 ATOM 5257 N N . THR A 1 30 ? -2.264 6.350 -3.726 1.00 0.00 ? 30 THR A N 13 ATOM 5258 C CA . THR A 1 30 ? -1.460 5.467 -2.897 1.00 0.00 ? 30 THR A CA 13 ATOM 5259 C C . THR A 1 30 ? -2.304 4.294 -2.394 1.00 0.00 ? 30 THR A C 13 ATOM 5260 O O . THR A 1 30 ? -3.464 4.151 -2.777 1.00 0.00 ? 30 THR A O 13 ATOM 5261 C CB . THR A 1 30 ? -0.850 6.304 -1.769 1.00 0.00 ? 30 THR A CB 13 ATOM 5262 O OG1 . THR A 1 30 ? 0.054 5.411 -1.125 1.00 0.00 ? 30 THR A OG1 13 ATOM 5263 C CG2 . THR A 1 30 ? -1.868 6.652 -0.681 1.00 0.00 ? 30 THR A CG2 13 ATOM 5264 N N . CYS A 1 31 ? -1.689 3.486 -1.544 1.00 0.00 ? 31 CYS A N 13 ATOM 5265 C CA . CYS A 1 31 ? -2.368 2.329 -0.986 1.00 0.00 ? 31 CYS A CA 13 ATOM 5266 C C . CYS A 1 31 ? -1.724 1.999 0.362 1.00 0.00 ? 31 CYS A C 13 ATOM 5267 O O . CYS A 1 31 ? -0.506 1.856 0.455 1.00 0.00 ? 31 CYS A O 13 ATOM 5268 C CB . CYS A 1 31 ? -2.334 1.137 -1.943 1.00 0.00 ? 31 CYS A CB 13 ATOM 5269 S SG . CYS A 1 31 ? -3.778 1.007 -3.059 1.00 0.00 ? 31 CYS A SG 13 ATOM 5270 N N . ASN A 1 32 ? -2.571 1.885 1.376 1.00 0.00 ? 32 ASN A N 13 ATOM 5271 C CA . ASN A 1 32 ? -2.100 1.573 2.714 1.00 0.00 ? 32 ASN A CA 13 ATOM 5272 C C . ASN A 1 32 ? -1.774 0.081 2.801 1.00 0.00 ? 32 ASN A C 13 ATOM 5273 O O . ASN A 1 32 ? -2.657 -0.736 3.060 1.00 0.00 ? 32 ASN A O 13 ATOM 5274 C CB . ASN A 1 32 ? -3.170 1.886 3.762 1.00 0.00 ? 32 ASN A CB 13 ATOM 5275 C CG . ASN A 1 32 ? -3.763 3.280 3.542 1.00 0.00 ? 32 ASN A CG 13 ATOM 5276 O OD1 . ASN A 1 32 ? -3.662 3.864 2.476 1.00 0.00 ? 32 ASN A OD1 13 ATOM 5277 N ND2 . ASN A 1 32 ? -4.385 3.778 4.606 1.00 0.00 ? 32 ASN A ND2 13 ATOM 5278 N N . CYS A 1 33 ? -0.506 -0.229 2.579 1.00 0.00 ? 33 CYS A N 13 ATOM 5279 C CA . CYS A 1 33 ? -0.053 -1.609 2.630 1.00 0.00 ? 33 CYS A CA 13 ATOM 5280 C C . CYS A 1 33 ? -0.307 -2.146 4.040 1.00 0.00 ? 33 CYS A C 13 ATOM 5281 O O . CYS A 1 33 ? -1.274 -1.756 4.692 1.00 0.00 ? 33 CYS A O 13 ATOM 5282 C CB . CYS A 1 33 ? 1.417 -1.737 2.226 1.00 0.00 ? 33 CYS A CB 13 ATOM 5283 S SG . CYS A 1 33 ? 1.873 -3.348 1.487 1.00 0.00 ? 33 CYS A SG 13 ATOM 5284 N N . VAL A 1 34 ? 0.578 -3.035 4.468 1.00 0.00 ? 34 VAL A N 13 ATOM 5285 C CA . VAL A 1 34 ? 0.461 -3.631 5.788 1.00 0.00 ? 34 VAL A CA 13 ATOM 5286 C C . VAL A 1 34 ? 1.855 -3.998 6.300 1.00 0.00 ? 34 VAL A C 13 ATOM 5287 O O . VAL A 1 34 ? 2.859 -3.508 5.788 1.00 0.00 ? 34 VAL A O 13 ATOM 5288 C CB . VAL A 1 34 ? -0.493 -4.826 5.740 1.00 0.00 ? 34 VAL A CB 13 ATOM 5289 C CG1 . VAL A 1 34 ? 0.260 -6.117 5.410 1.00 0.00 ? 34 VAL A CG1 13 ATOM 5290 C CG2 . VAL A 1 34 ? -1.266 -4.963 7.053 1.00 0.00 ? 34 VAL A CG2 13 ATOM 5291 N N . ILE A 1 35 ? 1.871 -4.859 7.309 1.00 0.00 ? 35 ILE A N 13 ATOM 5292 C CA . ILE A 1 35 ? 3.126 -5.297 7.898 1.00 0.00 ? 35 ILE A CA 13 ATOM 5293 C C . ILE A 1 35 ? 3.779 -6.333 6.980 1.00 0.00 ? 35 ILE A C 13 ATOM 5294 O O . ILE A 1 35 ? 3.144 -7.311 6.591 1.00 0.00 ? 35 ILE A O 13 ATOM 5295 C CB . ILE A 1 35 ? 2.900 -5.796 9.327 1.00 0.00 ? 35 ILE A CB 13 ATOM 5296 C CG1 . ILE A 1 35 ? 1.938 -4.877 10.083 1.00 0.00 ? 35 ILE A CG1 13 ATOM 5297 C CG2 . ILE A 1 35 ? 4.230 -5.965 10.065 1.00 0.00 ? 35 ILE A CG2 13 ATOM 5298 C CD1 . ILE A 1 35 ? 2.703 -3.902 10.980 1.00 0.00 ? 35 ILE A CD1 13 ATOM 5299 N N . GLY A 1 36 ? 5.040 -6.082 6.664 1.00 0.00 ? 36 GLY A N 13 ATOM 5300 C CA . GLY A 1 36 ? 5.788 -6.980 5.800 1.00 0.00 ? 36 GLY A CA 13 ATOM 5301 C C . GLY A 1 36 ? 5.651 -6.571 4.333 1.00 0.00 ? 36 GLY A C 13 ATOM 5302 O O . GLY A 1 36 ? 6.158 -7.253 3.444 1.00 0.00 ? 36 GLY A O 13 ATOM 5303 N N . TYR A 1 37 ? 4.961 -5.459 4.124 1.00 0.00 ? 37 TYR A N 13 ATOM 5304 C CA . TYR A 1 37 ? 4.749 -4.950 2.780 1.00 0.00 ? 37 TYR A CA 13 ATOM 5305 C C . TYR A 1 37 ? 4.448 -3.450 2.802 1.00 0.00 ? 37 TYR A C 13 ATOM 5306 O O . TYR A 1 37 ? 3.784 -2.960 3.713 1.00 0.00 ? 37 TYR A O 13 ATOM 5307 C CB . TYR A 1 37 ? 3.529 -5.696 2.234 1.00 0.00 ? 37 TYR A CB 13 ATOM 5308 C CG . TYR A 1 37 ? 3.698 -7.215 2.187 1.00 0.00 ? 37 TYR A CG 13 ATOM 5309 C CD1 . TYR A 1 37 ? 3.524 -7.965 3.333 1.00 0.00 ? 37 TYR A CD1 13 ATOM 5310 C CD2 . TYR A 1 37 ? 4.024 -7.837 0.999 1.00 0.00 ? 37 TYR A CD2 13 ATOM 5311 C CE1 . TYR A 1 37 ? 3.681 -9.395 3.289 1.00 0.00 ? 37 TYR A CE1 13 ATOM 5312 C CE2 . TYR A 1 37 ? 4.183 -9.267 0.955 1.00 0.00 ? 37 TYR A CE2 13 ATOM 5313 C CZ . TYR A 1 37 ? 4.004 -9.975 2.102 1.00 0.00 ? 37 TYR A CZ 13 ATOM 5314 O OH . TYR A 1 37 ? 4.152 -11.327 2.060 1.00 0.00 ? 37 TYR A OH 13 ATOM 5315 N N . SER A 1 38 ? 4.951 -2.763 1.787 1.00 0.00 ? 38 SER A N 13 ATOM 5316 C CA . SER A 1 38 ? 4.744 -1.329 1.678 1.00 0.00 ? 38 SER A CA 13 ATOM 5317 C C . SER A 1 38 ? 4.977 -0.876 0.235 1.00 0.00 ? 38 SER A C 13 ATOM 5318 O O . SER A 1 38 ? 5.256 -1.693 -0.638 1.00 0.00 ? 38 SER A O 13 ATOM 5319 C CB . SER A 1 38 ? 5.670 -0.566 2.631 1.00 0.00 ? 38 SER A CB 13 ATOM 5320 O OG . SER A 1 38 ? 5.695 -1.148 3.929 1.00 0.00 ? 38 SER A OG 13 ATOM 5321 N N . GLY A 1 39 ? 4.853 0.429 0.032 1.00 0.00 ? 39 GLY A N 13 ATOM 5322 C CA . GLY A 1 39 ? 5.044 1.001 -1.290 1.00 0.00 ? 39 GLY A CA 13 ATOM 5323 C C . GLY A 1 39 ? 3.713 1.463 -1.885 1.00 0.00 ? 39 GLY A C 13 ATOM 5324 O O . GLY A 1 39 ? 2.660 1.284 -1.276 1.00 0.00 ? 39 GLY A O 13 ATOM 5325 N N . ASP A 1 40 ? 3.803 2.050 -3.070 1.00 0.00 ? 40 ASP A N 13 ATOM 5326 C CA . ASP A 1 40 ? 2.619 2.539 -3.756 1.00 0.00 ? 40 ASP A CA 13 ATOM 5327 C C . ASP A 1 40 ? 1.517 1.480 -3.680 1.00 0.00 ? 40 ASP A C 13 ATOM 5328 O O . ASP A 1 40 ? 0.334 1.806 -3.746 1.00 0.00 ? 40 ASP A O 13 ATOM 5329 C CB . ASP A 1 40 ? 2.911 2.811 -5.232 1.00 0.00 ? 40 ASP A CB 13 ATOM 5330 C CG . ASP A 1 40 ? 1.743 3.399 -6.025 1.00 0.00 ? 40 ASP A CG 13 ATOM 5331 O OD1 . ASP A 1 40 ? 1.576 4.671 -5.887 1.00 0.00 ? 40 ASP A OD1 13 ATOM 5332 O OD2 . ASP A 1 40 ? 1.027 2.680 -6.737 1.00 0.00 ? 40 ASP A OD2 13 ATOM 5333 N N . ARG A 1 41 ? 1.947 0.234 -3.541 1.00 0.00 ? 41 ARG A N 13 ATOM 5334 C CA . ARG A 1 41 ? 1.012 -0.874 -3.454 1.00 0.00 ? 41 ARG A CA 13 ATOM 5335 C C . ARG A 1 41 ? 1.320 -1.735 -2.227 1.00 0.00 ? 41 ARG A C 13 ATOM 5336 O O . ARG A 1 41 ? 0.694 -1.578 -1.182 1.00 0.00 ? 41 ARG A O 13 ATOM 5337 C CB . ARG A 1 41 ? 1.073 -1.746 -4.710 1.00 0.00 ? 41 ARG A CB 13 ATOM 5338 C CG . ARG A 1 41 ? 0.652 -0.953 -5.949 1.00 0.00 ? 41 ARG A CG 13 ATOM 5339 C CD . ARG A 1 41 ? 1.741 -0.995 -7.023 1.00 0.00 ? 41 ARG A CD 13 ATOM 5340 N NE . ARG A 1 41 ? 1.302 -0.243 -8.220 1.00 0.00 ? 41 ARG A NE 13 ATOM 5341 C CZ . ARG A 1 41 ? 2.123 0.125 -9.226 1.00 0.00 ? 41 ARG A CZ 13 ATOM 5342 N NH1 . ARG A 1 41 ? 2.346 -0.707 -10.268 1.00 0.00 ? 41 ARG A NH1 13 ATOM 5343 N NH2 . ARG A 1 41 ? 2.707 1.308 -9.177 1.00 0.00 ? 41 ARG A NH2 13 ATOM 5344 N N . CYS A 1 42 ? 2.286 -2.626 -2.398 1.00 0.00 ? 42 CYS A N 13 ATOM 5345 C CA . CYS A 1 42 ? 2.685 -3.512 -1.319 1.00 0.00 ? 42 CYS A CA 13 ATOM 5346 C C . CYS A 1 42 ? 3.670 -4.541 -1.881 1.00 0.00 ? 42 CYS A C 13 ATOM 5347 O O . CYS A 1 42 ? 3.777 -5.651 -1.362 1.00 0.00 ? 42 CYS A O 13 ATOM 5348 C CB . CYS A 1 42 ? 1.478 -4.179 -0.659 1.00 0.00 ? 42 CYS A CB 13 ATOM 5349 S SG . CYS A 1 42 ? 1.265 -3.797 1.118 1.00 0.00 ? 42 CYS A SG 13 ATOM 5350 N N . GLN A 1 43 ? 4.363 -4.134 -2.935 1.00 0.00 ? 43 GLN A N 13 ATOM 5351 C CA . GLN A 1 43 ? 5.335 -5.007 -3.571 1.00 0.00 ? 43 GLN A CA 13 ATOM 5352 C C . GLN A 1 43 ? 6.612 -5.083 -2.730 1.00 0.00 ? 43 GLN A C 13 ATOM 5353 O O . GLN A 1 43 ? 7.328 -6.082 -2.773 1.00 0.00 ? 43 GLN A O 13 ATOM 5354 C CB . GLN A 1 43 ? 5.644 -4.536 -4.994 1.00 0.00 ? 43 GLN A CB 13 ATOM 5355 C CG . GLN A 1 43 ? 6.893 -3.653 -5.021 1.00 0.00 ? 43 GLN A CG 13 ATOM 5356 C CD . GLN A 1 43 ? 6.815 -2.626 -6.152 1.00 0.00 ? 43 GLN A CD 13 ATOM 5357 O OE1 . GLN A 1 43 ? 5.749 -2.207 -6.572 1.00 0.00 ? 43 GLN A OE1 13 ATOM 5358 N NE2 . GLN A 1 43 ? 8.000 -2.244 -6.619 1.00 0.00 ? 43 GLN A NE2 13 ATOM 5359 N N . THR A 1 44 ? 6.856 -4.014 -1.986 1.00 0.00 ? 44 THR A N 13 ATOM 5360 C CA . THR A 1 44 ? 8.033 -3.949 -1.136 1.00 0.00 ? 44 THR A CA 13 ATOM 5361 C C . THR A 1 44 ? 7.843 -4.820 0.106 1.00 0.00 ? 44 THR A C 13 ATOM 5362 O O . THR A 1 44 ? 7.318 -4.356 1.118 1.00 0.00 ? 44 THR A O 13 ATOM 5363 C CB . THR A 1 44 ? 8.303 -2.478 -0.813 1.00 0.00 ? 44 THR A CB 13 ATOM 5364 O OG1 . THR A 1 44 ? 8.846 -1.952 -2.021 1.00 0.00 ? 44 THR A OG1 13 ATOM 5365 C CG2 . THR A 1 44 ? 9.423 -2.299 0.210 1.00 0.00 ? 44 THR A CG2 13 ATOM 5366 N N . ARG A 1 45 ? 8.280 -6.065 -0.009 1.00 0.00 ? 45 ARG A N 13 ATOM 5367 C CA . ARG A 1 45 ? 8.163 -7.005 1.094 1.00 0.00 ? 45 ARG A CA 13 ATOM 5368 C C . ARG A 1 45 ? 9.250 -6.735 2.138 1.00 0.00 ? 45 ARG A C 13 ATOM 5369 O O . ARG A 1 45 ? 10.439 -6.770 1.825 1.00 0.00 ? 45 ARG A O 13 ATOM 5370 C CB . ARG A 1 45 ? 8.286 -8.449 0.603 1.00 0.00 ? 45 ARG A CB 13 ATOM 5371 C CG . ARG A 1 45 ? 7.011 -9.239 0.898 1.00 0.00 ? 45 ARG A CG 13 ATOM 5372 C CD . ARG A 1 45 ? 7.328 -10.712 1.165 1.00 0.00 ? 45 ARG A CD 13 ATOM 5373 N NE . ARG A 1 45 ? 7.960 -11.318 -0.028 1.00 0.00 ? 45 ARG A NE 13 ATOM 5374 C CZ . ARG A 1 45 ? 7.282 -11.991 -0.981 1.00 0.00 ? 45 ARG A CZ 13 ATOM 5375 N NH1 . ARG A 1 45 ? 7.036 -13.313 -0.844 1.00 0.00 ? 45 ARG A NH1 13 ATOM 5376 N NH2 . ARG A 1 45 ? 6.864 -11.340 -2.051 1.00 0.00 ? 45 ARG A NH2 13 ATOM 5377 N N . ASP A 1 46 ? 8.802 -6.470 3.356 1.00 0.00 ? 46 ASP A N 13 ATOM 5378 C CA . ASP A 1 46 ? 9.718 -6.193 4.448 1.00 0.00 ? 46 ASP A CA 13 ATOM 5379 C C . ASP A 1 46 ? 10.562 -7.439 4.727 1.00 0.00 ? 46 ASP A C 13 ATOM 5380 O O . ASP A 1 46 ? 10.901 -8.181 3.807 1.00 0.00 ? 46 ASP A O 13 ATOM 5381 C CB . ASP A 1 46 ? 8.962 -5.839 5.729 1.00 0.00 ? 46 ASP A CB 13 ATOM 5382 C CG . ASP A 1 46 ? 9.672 -4.844 6.646 1.00 0.00 ? 46 ASP A CG 13 ATOM 5383 O OD1 . ASP A 1 46 ? 10.575 -5.356 7.413 1.00 0.00 ? 46 ASP A OD1 13 ATOM 5384 O OD2 . ASP A 1 46 ? 9.380 -3.639 6.631 1.00 0.00 ? 46 ASP A OD2 13 ATOM 5385 N N . LEU A 1 47 ? 10.877 -7.629 6.000 1.00 0.00 ? 47 LEU A N 13 ATOM 5386 C CA . LEU A 1 47 ? 11.674 -8.771 6.411 1.00 0.00 ? 47 LEU A CA 13 ATOM 5387 C C . LEU A 1 47 ? 10.889 -9.594 7.432 1.00 0.00 ? 47 LEU A C 13 ATOM 5388 O O . LEU A 1 47 ? 10.749 -10.806 7.283 1.00 0.00 ? 47 LEU A O 13 ATOM 5389 C CB . LEU A 1 47 ? 13.046 -8.315 6.914 1.00 0.00 ? 47 LEU A CB 13 ATOM 5390 C CG . LEU A 1 47 ? 14.067 -7.949 5.835 1.00 0.00 ? 47 LEU A CG 13 ATOM 5391 C CD1 . LEU A 1 47 ? 14.343 -9.140 4.914 1.00 0.00 ? 47 LEU A CD1 13 ATOM 5392 C CD2 . LEU A 1 47 ? 13.622 -6.712 5.055 1.00 0.00 ? 47 LEU A CD2 13 ATOM 5393 N N . ARG A 1 48 ? 10.395 -8.902 8.450 1.00 0.00 ? 48 ARG A N 13 ATOM 5394 C CA . ARG A 1 48 ? 9.627 -9.554 9.497 1.00 0.00 ? 48 ARG A CA 13 ATOM 5395 C C . ARG A 1 48 ? 9.303 -8.561 10.614 1.00 0.00 ? 48 ARG A C 13 ATOM 5396 O O . ARG A 1 48 ? 9.894 -8.618 11.691 1.00 0.00 ? 48 ARG A O 13 ATOM 5397 C CB . ARG A 1 48 ? 10.394 -10.742 10.084 1.00 0.00 ? 48 ARG A CB 13 ATOM 5398 C CG . ARG A 1 48 ? 9.718 -12.065 9.721 1.00 0.00 ? 48 ARG A CG 13 ATOM 5399 C CD . ARG A 1 48 ? 10.469 -13.249 10.332 1.00 0.00 ? 48 ARG A CD 13 ATOM 5400 N NE . ARG A 1 48 ? 9.795 -14.517 9.973 1.00 0.00 ? 48 ARG A NE 13 ATOM 5401 C CZ . ARG A 1 48 ? 8.922 -15.164 10.774 1.00 0.00 ? 48 ARG A CZ 13 ATOM 5402 N NH1 . ARG A 1 48 ? 9.364 -16.046 11.694 1.00 0.00 ? 48 ARG A NH1 13 ATOM 5403 N NH2 . ARG A 1 48 ? 7.632 -14.920 10.645 1.00 0.00 ? 48 ARG A NH2 13 ATOM 5404 N N . TRP A 1 49 ? 8.363 -7.674 10.319 1.00 0.00 ? 49 TRP A N 13 ATOM 5405 C CA . TRP A 1 49 ? 7.952 -6.671 11.284 1.00 0.00 ? 49 TRP A CA 13 ATOM 5406 C C . TRP A 1 49 ? 6.827 -7.265 12.136 1.00 0.00 ? 49 TRP A C 13 ATOM 5407 O O . TRP A 1 49 ? 5.800 -6.622 12.349 1.00 0.00 ? 49 TRP A O 13 ATOM 5408 C CB . TRP A 1 49 ? 7.551 -5.369 10.587 1.00 0.00 ? 49 TRP A CB 13 ATOM 5409 C CG . TRP A 1 49 ? 7.201 -4.231 11.546 1.00 0.00 ? 49 TRP A CG 13 ATOM 5410 C CD1 . TRP A 1 49 ? 6.022 -3.975 12.129 1.00 0.00 ? 49 TRP A CD1 13 ATOM 5411 C CD2 . TRP A 1 49 ? 8.092 -3.197 12.014 1.00 0.00 ? 49 TRP A CD2 13 ATOM 5412 N NE1 . TRP A 1 49 ? 6.087 -2.857 12.934 1.00 0.00 ? 49 TRP A NE1 13 ATOM 5413 C CE2 . TRP A 1 49 ? 7.387 -2.367 12.863 1.00 0.00 ? 49 TRP A CE2 13 ATOM 5414 C CE3 . TRP A 1 49 ? 9.450 -2.969 11.732 1.00 0.00 ? 49 TRP A CE3 13 ATOM 5415 C CZ2 . TRP A 1 49 ? 7.954 -1.257 13.497 1.00 0.00 ? 49 TRP A CZ2 13 ATOM 5416 C CZ3 . TRP A 1 49 ? 10.004 -1.854 12.373 1.00 0.00 ? 49 TRP A CZ3 13 ATOM 5417 C CH2 . TRP A 1 49 ? 9.306 -1.010 13.229 1.00 0.00 ? 49 TRP A CH2 13 ATOM 5418 N N . TRP A 1 50 ? 7.059 -8.484 12.597 1.00 0.00 ? 50 TRP A N 13 ATOM 5419 C CA . TRP A 1 50 ? 6.077 -9.172 13.420 1.00 0.00 ? 50 TRP A CA 13 ATOM 5420 C C . TRP A 1 50 ? 6.770 -9.615 14.710 1.00 0.00 ? 50 TRP A C 13 ATOM 5421 O O . TRP A 1 50 ? 6.290 -10.513 15.398 1.00 0.00 ? 50 TRP A O 13 ATOM 5422 C CB . TRP A 1 50 ? 5.439 -10.333 12.655 1.00 0.00 ? 50 TRP A CB 13 ATOM 5423 C CG . TRP A 1 50 ? 5.184 -10.038 11.174 1.00 0.00 ? 50 TRP A CG 13 ATOM 5424 C CD1 . TRP A 1 50 ? 6.079 -9.709 10.234 1.00 0.00 ? 50 TRP A CD1 13 ATOM 5425 C CD2 . TRP A 1 50 ? 3.908 -10.059 10.501 1.00 0.00 ? 50 TRP A CD2 13 ATOM 5426 N NE1 . TRP A 1 50 ? 5.476 -9.516 9.007 1.00 0.00 ? 50 TRP A NE1 13 ATOM 5427 C CE2 . TRP A 1 50 ? 4.115 -9.738 9.175 1.00 0.00 ? 50 TRP A CE2 13 ATOM 5428 C CE3 . TRP A 1 50 ? 2.623 -10.342 10.996 1.00 0.00 ? 50 TRP A CE3 13 ATOM 5429 C CZ2 . TRP A 1 50 ? 3.080 -9.668 8.233 1.00 0.00 ? 50 TRP A CZ2 13 ATOM 5430 C CZ3 . TRP A 1 50 ? 1.601 -10.267 10.042 1.00 0.00 ? 50 TRP A CZ3 13 ATOM 5431 C CH2 . TRP A 1 50 ? 1.790 -9.944 8.705 1.00 0.00 ? 50 TRP A CH2 13 ATOM 5432 N N . GLU A 1 51 ? 7.887 -8.964 14.998 1.00 0.00 ? 51 GLU A N 13 ATOM 5433 C CA . GLU A 1 51 ? 8.650 -9.281 16.194 1.00 0.00 ? 51 GLU A CA 13 ATOM 5434 C C . GLU A 1 51 ? 9.558 -8.107 16.569 1.00 0.00 ? 51 GLU A C 13 ATOM 5435 O O . GLU A 1 51 ? 10.072 -7.412 15.695 1.00 0.00 ? 51 GLU A O 13 ATOM 5436 C CB . GLU A 1 51 ? 9.462 -10.563 16.002 1.00 0.00 ? 51 GLU A CB 13 ATOM 5437 C CG . GLU A 1 51 ? 9.816 -10.774 14.530 1.00 0.00 ? 51 GLU A CG 13 ATOM 5438 C CD . GLU A 1 51 ? 10.967 -11.771 14.379 1.00 0.00 ? 51 GLU A CD 13 ATOM 5439 O OE1 . GLU A 1 51 ? 10.732 -12.987 14.347 1.00 0.00 ? 51 GLU A OE1 13 ATOM 5440 O OE2 . GLU A 1 51 ? 12.141 -11.243 14.295 1.00 0.00 ? 51 GLU A OE2 13 ATOM 5441 N N . LEU A 1 52 ? 9.727 -7.925 17.870 1.00 0.00 ? 52 LEU A N 13 ATOM 5442 C CA . LEU A 1 52 ? 10.565 -6.848 18.371 1.00 0.00 ? 52 LEU A CA 13 ATOM 5443 C C . LEU A 1 52 ? 11.400 -7.363 19.545 1.00 0.00 ? 52 LEU A C 13 ATOM 5444 O O . LEU A 1 52 ? 11.001 -8.302 20.234 1.00 0.00 ? 52 LEU A O 13 ATOM 5445 C CB . LEU A 1 52 ? 9.714 -5.623 18.715 1.00 0.00 ? 52 LEU A CB 13 ATOM 5446 C CG . LEU A 1 52 ? 9.107 -5.599 20.118 1.00 0.00 ? 52 LEU A CG 13 ATOM 5447 C CD1 . LEU A 1 52 ? 8.863 -4.163 20.586 1.00 0.00 ? 52 LEU A CD1 13 ATOM 5448 C CD2 . LEU A 1 52 ? 7.834 -6.445 20.179 1.00 0.00 ? 52 LEU A CD2 13 ATOM 5449 N N . ARG A 1 53 ? 12.547 -6.727 19.738 1.00 0.00 ? 53 ARG A N 13 ATOM 5450 C CA . ARG A 1 53 ? 13.443 -7.108 20.817 1.00 0.00 ? 53 ARG A CA 13 ATOM 5451 C C . ARG A 1 53 ? 13.843 -5.879 21.634 1.00 0.00 ? 53 ARG A C 13 ATOM 5452 O O . ARG A 1 53 ? 13.042 -5.352 22.403 1.00 0.00 ? 53 ARG A O 13 ATOM 5453 C CB . ARG A 1 53 ? 14.703 -7.785 20.271 1.00 0.00 ? 53 ARG A CB 13 ATOM 5454 C CG . ARG A 1 53 ? 14.391 -9.187 19.746 1.00 0.00 ? 53 ARG A CG 13 ATOM 5455 C CD . ARG A 1 53 ? 15.648 -9.857 19.192 1.00 0.00 ? 53 ARG A CD 13 ATOM 5456 N NE . ARG A 1 53 ? 16.020 -9.246 17.898 1.00 0.00 ? 53 ARG A NE 13 ATOM 5457 C CZ . ARG A 1 53 ? 15.645 -9.733 16.695 1.00 0.00 ? 53 ARG A CZ 13 ATOM 5458 N NH1 . ARG A 1 53 ? 16.417 -10.621 16.096 1.00 0.00 ? 53 ARG A NH1 13 ATOM 5459 N NH2 . ARG A 1 53 ? 14.500 -9.319 16.115 1.00 0.00 ? 53 ARG A NH2 13 ATOM 5460 O OXT . ARG A 1 53 ? 15.054 -5.471 21.446 1.00 0.00 ? 53 ARG A OXT 13 ATOM 5461 N N . ASN A 1 1 ? -2.182 15.283 2.293 1.00 0.00 ? 1 ASN A N 14 ATOM 5462 C CA . ASN A 1 1 ? -3.346 14.703 2.940 1.00 0.00 ? 1 ASN A CA 14 ATOM 5463 C C . ASN A 1 1 ? -3.809 13.479 2.147 1.00 0.00 ? 1 ASN A C 14 ATOM 5464 O O . ASN A 1 1 ? -3.952 13.544 0.925 1.00 0.00 ? 1 ASN A O 14 ATOM 5465 C CB . ASN A 1 1 ? -4.505 15.699 2.990 1.00 0.00 ? 1 ASN A CB 14 ATOM 5466 C CG . ASN A 1 1 ? -4.401 16.717 1.852 1.00 0.00 ? 1 ASN A CG 14 ATOM 5467 O OD1 . ASN A 1 1 ? -4.972 16.556 0.785 1.00 0.00 ? 1 ASN A OD1 14 ATOM 5468 N ND2 . ASN A 1 1 ? -3.641 17.772 2.136 1.00 0.00 ? 1 ASN A ND2 14 ATOM 5469 N N . SER A 1 2 ? -4.030 12.392 2.870 1.00 0.00 ? 2 SER A N 14 ATOM 5470 C CA . SER A 1 2 ? -4.472 11.155 2.248 1.00 0.00 ? 2 SER A CA 14 ATOM 5471 C C . SER A 1 2 ? -5.949 11.266 1.859 1.00 0.00 ? 2 SER A C 14 ATOM 5472 O O . SER A 1 2 ? -6.781 11.667 2.671 1.00 0.00 ? 2 SER A O 14 ATOM 5473 C CB . SER A 1 2 ? -4.259 9.962 3.180 1.00 0.00 ? 2 SER A CB 14 ATOM 5474 O OG . SER A 1 2 ? -2.894 9.825 3.567 1.00 0.00 ? 2 SER A OG 14 ATOM 5475 N N . TYR A 1 3 ? -6.228 10.904 0.615 1.00 0.00 ? 3 TYR A N 14 ATOM 5476 C CA . TYR A 1 3 ? -7.589 10.957 0.107 1.00 0.00 ? 3 TYR A CA 14 ATOM 5477 C C . TYR A 1 3 ? -8.016 9.600 -0.459 1.00 0.00 ? 3 TYR A C 14 ATOM 5478 O O . TYR A 1 3 ? -7.278 8.983 -1.226 1.00 0.00 ? 3 TYR A O 14 ATOM 5479 C CB . TYR A 1 3 ? -7.577 11.986 -1.024 1.00 0.00 ? 3 TYR A CB 14 ATOM 5480 C CG . TYR A 1 3 ? -8.943 12.208 -1.679 1.00 0.00 ? 3 TYR A CG 14 ATOM 5481 C CD1 . TYR A 1 3 ? -9.324 11.434 -2.755 1.00 0.00 ? 3 TYR A CD1 14 ATOM 5482 C CD2 . TYR A 1 3 ? -9.791 13.181 -1.190 1.00 0.00 ? 3 TYR A CD2 14 ATOM 5483 C CE1 . TYR A 1 3 ? -10.608 11.642 -3.372 1.00 0.00 ? 3 TYR A CE1 14 ATOM 5484 C CE2 . TYR A 1 3 ? -11.076 13.389 -1.808 1.00 0.00 ? 3 TYR A CE2 14 ATOM 5485 C CZ . TYR A 1 3 ? -11.421 12.609 -2.866 1.00 0.00 ? 3 TYR A CZ 14 ATOM 5486 O OH . TYR A 1 3 ? -12.635 12.806 -3.449 1.00 0.00 ? 3 TYR A OH 14 ATOM 5487 N N . PRO A 1 4 ? -9.237 9.166 -0.047 1.00 0.00 ? 4 PRO A N 14 ATOM 5488 C CA . PRO A 1 4 ? -9.772 7.894 -0.504 1.00 0.00 ? 4 PRO A CA 14 ATOM 5489 C C . PRO A 1 4 ? -10.256 7.992 -1.953 1.00 0.00 ? 4 PRO A C 14 ATOM 5490 O O . PRO A 1 4 ? -11.275 8.622 -2.229 1.00 0.00 ? 4 PRO A O 14 ATOM 5491 C CB . PRO A 1 4 ? -10.886 7.561 0.473 1.00 0.00 ? 4 PRO A CB 14 ATOM 5492 C CG . PRO A 1 4 ? -11.243 8.870 1.160 1.00 0.00 ? 4 PRO A CG 14 ATOM 5493 C CD . PRO A 1 4 ? -10.138 9.868 0.861 1.00 0.00 ? 4 PRO A CD 14 ATOM 5494 N N . GLY A 1 5 ? -9.501 7.359 -2.839 1.00 0.00 ? 5 GLY A N 14 ATOM 5495 C CA . GLY A 1 5 ? -9.841 7.367 -4.253 1.00 0.00 ? 5 GLY A CA 14 ATOM 5496 C C . GLY A 1 5 ? -9.359 6.089 -4.940 1.00 0.00 ? 5 GLY A C 14 ATOM 5497 O O . GLY A 1 5 ? -8.363 5.495 -4.527 1.00 0.00 ? 5 GLY A O 14 ATOM 5498 N N . CYS A 1 6 ? -10.084 5.702 -5.979 1.00 0.00 ? 6 CYS A N 14 ATOM 5499 C CA . CYS A 1 6 ? -9.742 4.505 -6.727 1.00 0.00 ? 6 CYS A CA 14 ATOM 5500 C C . CYS A 1 6 ? -10.718 4.375 -7.897 1.00 0.00 ? 6 CYS A C 14 ATOM 5501 O O . CYS A 1 6 ? -11.708 3.649 -7.809 1.00 0.00 ? 6 CYS A O 14 ATOM 5502 C CB . CYS A 1 6 ? -9.749 3.260 -5.838 1.00 0.00 ? 6 CYS A CB 14 ATOM 5503 S SG . CYS A 1 6 ? -8.566 1.955 -6.334 1.00 0.00 ? 6 CYS A SG 14 ATOM 5504 N N . PRO A 1 7 ? -10.398 5.108 -8.997 1.00 0.00 ? 7 PRO A N 14 ATOM 5505 C CA . PRO A 1 7 ? -11.235 5.081 -10.184 1.00 0.00 ? 7 PRO A CA 14 ATOM 5506 C C . PRO A 1 7 ? -11.048 3.775 -10.959 1.00 0.00 ? 7 PRO A C 14 ATOM 5507 O O . PRO A 1 7 ? -10.222 2.942 -10.588 1.00 0.00 ? 7 PRO A O 14 ATOM 5508 C CB . PRO A 1 7 ? -10.826 6.309 -10.983 1.00 0.00 ? 7 PRO A CB 14 ATOM 5509 C CG . PRO A 1 7 ? -9.463 6.717 -10.447 1.00 0.00 ? 7 PRO A CG 14 ATOM 5510 C CD . PRO A 1 7 ? -9.235 5.978 -9.140 1.00 0.00 ? 7 PRO A CD 14 ATOM 5511 N N . SER A 1 8 ? -11.829 3.636 -12.019 1.00 0.00 ? 8 SER A N 14 ATOM 5512 C CA . SER A 1 8 ? -11.760 2.444 -12.849 1.00 0.00 ? 8 SER A CA 14 ATOM 5513 C C . SER A 1 8 ? -10.331 2.241 -13.354 1.00 0.00 ? 8 SER A C 14 ATOM 5514 O O . SER A 1 8 ? -9.953 1.133 -13.731 1.00 0.00 ? 8 SER A O 14 ATOM 5515 C CB . SER A 1 8 ? -12.733 2.536 -14.027 1.00 0.00 ? 8 SER A CB 14 ATOM 5516 O OG . SER A 1 8 ? -12.744 1.342 -14.802 1.00 0.00 ? 8 SER A OG 14 ATOM 5517 N N . SER A 1 9 ? -9.574 3.329 -13.347 1.00 0.00 ? 9 SER A N 14 ATOM 5518 C CA . SER A 1 9 ? -8.194 3.286 -13.801 1.00 0.00 ? 9 SER A CA 14 ATOM 5519 C C . SER A 1 9 ? -7.291 2.767 -12.680 1.00 0.00 ? 9 SER A C 14 ATOM 5520 O O . SER A 1 9 ? -6.069 2.766 -12.813 1.00 0.00 ? 9 SER A O 14 ATOM 5521 C CB . SER A 1 9 ? -7.724 4.664 -14.268 1.00 0.00 ? 9 SER A CB 14 ATOM 5522 O OG . SER A 1 9 ? -6.391 4.631 -14.769 1.00 0.00 ? 9 SER A OG 14 ATOM 5523 N N . TYR A 1 10 ? -7.930 2.339 -11.600 1.00 0.00 ? 10 TYR A N 14 ATOM 5524 C CA . TYR A 1 10 ? -7.199 1.820 -10.456 1.00 0.00 ? 10 TYR A CA 14 ATOM 5525 C C . TYR A 1 10 ? -7.889 0.581 -9.882 1.00 0.00 ? 10 TYR A C 14 ATOM 5526 O O . TYR A 1 10 ? -8.426 0.621 -8.776 1.00 0.00 ? 10 TYR A O 14 ATOM 5527 C CB . TYR A 1 10 ? -7.214 2.932 -9.405 1.00 0.00 ? 10 TYR A CB 14 ATOM 5528 C CG . TYR A 1 10 ? -6.094 3.959 -9.571 1.00 0.00 ? 10 TYR A CG 14 ATOM 5529 C CD1 . TYR A 1 10 ? -6.265 5.037 -10.417 1.00 0.00 ? 10 TYR A CD1 14 ATOM 5530 C CD2 . TYR A 1 10 ? -4.912 3.810 -8.875 1.00 0.00 ? 10 TYR A CD2 14 ATOM 5531 C CE1 . TYR A 1 10 ? -5.210 6.005 -10.573 1.00 0.00 ? 10 TYR A CE1 14 ATOM 5532 C CE2 . TYR A 1 10 ? -3.857 4.777 -9.032 1.00 0.00 ? 10 TYR A CE2 14 ATOM 5533 C CZ . TYR A 1 10 ? -4.058 5.828 -9.871 1.00 0.00 ? 10 TYR A CZ 14 ATOM 5534 O OH . TYR A 1 10 ? -3.062 6.742 -10.018 1.00 0.00 ? 10 TYR A OH 14 ATOM 5535 N N . ASP A 1 11 ? -7.852 -0.492 -10.659 1.00 0.00 ? 11 ASP A N 14 ATOM 5536 C CA . ASP A 1 11 ? -8.466 -1.740 -10.240 1.00 0.00 ? 11 ASP A CA 14 ATOM 5537 C C . ASP A 1 11 ? -7.379 -2.794 -10.028 1.00 0.00 ? 11 ASP A C 14 ATOM 5538 O O . ASP A 1 11 ? -7.425 -3.868 -10.624 1.00 0.00 ? 11 ASP A O 14 ATOM 5539 C CB . ASP A 1 11 ? -9.431 -2.263 -11.307 1.00 0.00 ? 11 ASP A CB 14 ATOM 5540 C CG . ASP A 1 11 ? -10.710 -1.444 -11.482 1.00 0.00 ? 11 ASP A CG 14 ATOM 5541 O OD1 . ASP A 1 11 ? -11.426 -1.317 -10.416 1.00 0.00 ? 11 ASP A OD1 14 ATOM 5542 O OD2 . ASP A 1 11 ? -11.008 -0.951 -12.580 1.00 0.00 ? 11 ASP A OD2 14 ATOM 5543 N N . GLY A 1 12 ? -6.423 -2.449 -9.177 1.00 0.00 ? 12 GLY A N 14 ATOM 5544 C CA . GLY A 1 12 ? -5.325 -3.352 -8.878 1.00 0.00 ? 12 GLY A CA 14 ATOM 5545 C C . GLY A 1 12 ? -4.065 -2.575 -8.493 1.00 0.00 ? 12 GLY A C 14 ATOM 5546 O O . GLY A 1 12 ? -2.966 -2.913 -8.927 1.00 0.00 ? 12 GLY A O 14 ATOM 5547 N N . TYR A 1 13 ? -4.268 -1.548 -7.678 1.00 0.00 ? 13 TYR A N 14 ATOM 5548 C CA . TYR A 1 13 ? -3.162 -0.719 -7.231 1.00 0.00 ? 13 TYR A CA 14 ATOM 5549 C C . TYR A 1 13 ? -2.763 -1.070 -5.795 1.00 0.00 ? 13 TYR A C 14 ATOM 5550 O O . TYR A 1 13 ? -2.001 -0.340 -5.162 1.00 0.00 ? 13 TYR A O 14 ATOM 5551 C CB . TYR A 1 13 ? -3.673 0.721 -7.267 1.00 0.00 ? 13 TYR A CB 14 ATOM 5552 C CG . TYR A 1 13 ? -2.574 1.768 -7.468 1.00 0.00 ? 13 TYR A CG 14 ATOM 5553 C CD1 . TYR A 1 13 ? -1.929 2.309 -6.376 1.00 0.00 ? 13 TYR A CD1 14 ATOM 5554 C CD2 . TYR A 1 13 ? -2.228 2.167 -8.743 1.00 0.00 ? 13 TYR A CD2 14 ATOM 5555 C CE1 . TYR A 1 13 ? -0.894 3.294 -6.565 1.00 0.00 ? 13 TYR A CE1 14 ATOM 5556 C CE2 . TYR A 1 13 ? -1.195 3.151 -8.933 1.00 0.00 ? 13 TYR A CE2 14 ATOM 5557 C CZ . TYR A 1 13 ? -0.579 3.665 -7.835 1.00 0.00 ? 13 TYR A CZ 14 ATOM 5558 O OH . TYR A 1 13 ? 0.399 4.594 -8.015 1.00 0.00 ? 13 TYR A OH 14 ATOM 5559 N N . CYS A 1 14 ? -3.293 -2.188 -5.323 1.00 0.00 ? 14 CYS A N 14 ATOM 5560 C CA . CYS A 1 14 ? -3.001 -2.645 -3.975 1.00 0.00 ? 14 CYS A CA 14 ATOM 5561 C C . CYS A 1 14 ? -2.661 -4.135 -4.036 1.00 0.00 ? 14 CYS A C 14 ATOM 5562 O O . CYS A 1 14 ? -3.471 -4.941 -4.493 1.00 0.00 ? 14 CYS A O 14 ATOM 5563 C CB . CYS A 1 14 ? -4.160 -2.363 -3.019 1.00 0.00 ? 14 CYS A CB 14 ATOM 5564 S SG . CYS A 1 14 ? -5.167 -0.895 -3.443 1.00 0.00 ? 14 CYS A SG 14 ATOM 5565 N N . LEU A 1 15 ? -1.463 -4.456 -3.569 1.00 0.00 ? 15 LEU A N 14 ATOM 5566 C CA . LEU A 1 15 ? -1.008 -5.837 -3.564 1.00 0.00 ? 15 LEU A CA 14 ATOM 5567 C C . LEU A 1 15 ? -0.908 -6.331 -2.120 1.00 0.00 ? 15 LEU A C 14 ATOM 5568 O O . LEU A 1 15 ? -1.262 -5.610 -1.187 1.00 0.00 ? 15 LEU A O 14 ATOM 5569 C CB . LEU A 1 15 ? 0.296 -5.971 -4.353 1.00 0.00 ? 15 LEU A CB 14 ATOM 5570 C CG . LEU A 1 15 ? 0.297 -5.361 -5.755 1.00 0.00 ? 15 LEU A CG 14 ATOM 5571 C CD1 . LEU A 1 15 ? 1.726 -5.132 -6.253 1.00 0.00 ? 15 LEU A CD1 14 ATOM 5572 C CD2 . LEU A 1 15 ? -0.517 -6.217 -6.728 1.00 0.00 ? 15 LEU A CD2 14 ATOM 5573 N N . ASN A 1 16 ? -0.421 -7.555 -1.979 1.00 0.00 ? 16 ASN A N 14 ATOM 5574 C CA . ASN A 1 16 ? -0.269 -8.154 -0.665 1.00 0.00 ? 16 ASN A CA 14 ATOM 5575 C C . ASN A 1 16 ? -1.563 -7.967 0.129 1.00 0.00 ? 16 ASN A C 14 ATOM 5576 O O . ASN A 1 16 ? -1.553 -8.003 1.359 1.00 0.00 ? 16 ASN A O 14 ATOM 5577 C CB . ASN A 1 16 ? 0.864 -7.486 0.116 1.00 0.00 ? 16 ASN A CB 14 ATOM 5578 C CG . ASN A 1 16 ? 2.209 -7.693 -0.581 1.00 0.00 ? 16 ASN A CG 14 ATOM 5579 O OD1 . ASN A 1 16 ? 2.633 -8.805 -0.852 1.00 0.00 ? 16 ASN A OD1 14 ATOM 5580 N ND2 . ASN A 1 16 ? 2.852 -6.563 -0.862 1.00 0.00 ? 16 ASN A ND2 14 ATOM 5581 N N . GLY A 1 17 ? -2.647 -7.777 -0.606 1.00 0.00 ? 17 GLY A N 14 ATOM 5582 C CA . GLY A 1 17 ? -3.949 -7.585 0.012 1.00 0.00 ? 17 GLY A CA 14 ATOM 5583 C C . GLY A 1 17 ? -4.010 -6.250 0.756 1.00 0.00 ? 17 GLY A C 14 ATOM 5584 O O . GLY A 1 17 ? -4.048 -6.221 1.985 1.00 0.00 ? 17 GLY A O 14 ATOM 5585 N N . GLY A 1 18 ? -4.020 -5.175 -0.020 1.00 0.00 ? 18 GLY A N 14 ATOM 5586 C CA . GLY A 1 18 ? -4.076 -3.841 0.551 1.00 0.00 ? 18 GLY A CA 14 ATOM 5587 C C . GLY A 1 18 ? -5.305 -3.082 0.047 1.00 0.00 ? 18 GLY A C 14 ATOM 5588 O O . GLY A 1 18 ? -5.919 -3.473 -0.945 1.00 0.00 ? 18 GLY A O 14 ATOM 5589 N N . VAL A 1 19 ? -5.628 -2.007 0.752 1.00 0.00 ? 19 VAL A N 14 ATOM 5590 C CA . VAL A 1 19 ? -6.772 -1.188 0.389 1.00 0.00 ? 19 VAL A CA 14 ATOM 5591 C C . VAL A 1 19 ? -6.332 -0.122 -0.616 1.00 0.00 ? 19 VAL A C 14 ATOM 5592 O O . VAL A 1 19 ? -5.137 0.080 -0.830 1.00 0.00 ? 19 VAL A O 14 ATOM 5593 C CB . VAL A 1 19 ? -7.413 -0.598 1.646 1.00 0.00 ? 19 VAL A CB 14 ATOM 5594 C CG1 . VAL A 1 19 ? -8.815 -0.064 1.346 1.00 0.00 ? 19 VAL A CG1 14 ATOM 5595 C CG2 . VAL A 1 19 ? -7.447 -1.625 2.778 1.00 0.00 ? 19 VAL A CG2 14 ATOM 5596 N N . CYS A 1 20 ? -7.322 0.532 -1.207 1.00 0.00 ? 20 CYS A N 14 ATOM 5597 C CA . CYS A 1 20 ? -7.052 1.573 -2.184 1.00 0.00 ? 20 CYS A CA 14 ATOM 5598 C C . CYS A 1 20 ? -7.101 2.926 -1.471 1.00 0.00 ? 20 CYS A C 14 ATOM 5599 O O . CYS A 1 20 ? -7.994 3.173 -0.661 1.00 0.00 ? 20 CYS A O 14 ATOM 5600 C CB . CYS A 1 20 ? -8.029 1.511 -3.361 1.00 0.00 ? 20 CYS A CB 14 ATOM 5601 S SG . CYS A 1 20 ? -7.362 2.137 -4.945 1.00 0.00 ? 20 CYS A SG 14 ATOM 5602 N N . MET A 1 21 ? -6.132 3.765 -1.798 1.00 0.00 ? 21 MET A N 14 ATOM 5603 C CA . MET A 1 21 ? -6.053 5.089 -1.199 1.00 0.00 ? 21 MET A CA 14 ATOM 5604 C C . MET A 1 21 ? -5.321 6.066 -2.122 1.00 0.00 ? 21 MET A C 14 ATOM 5605 O O . MET A 1 21 ? -4.285 5.728 -2.692 1.00 0.00 ? 21 MET A O 14 ATOM 5606 C CB . MET A 1 21 ? -5.316 4.999 0.139 1.00 0.00 ? 21 MET A CB 14 ATOM 5607 C CG . MET A 1 21 ? -6.246 5.352 1.301 1.00 0.00 ? 21 MET A CG 14 ATOM 5608 S SD . MET A 1 21 ? -5.307 6.067 2.640 1.00 0.00 ? 21 MET A SD 14 ATOM 5609 C CE . MET A 1 21 ? -6.431 7.357 3.150 1.00 0.00 ? 21 MET A CE 14 ATOM 5610 N N . HIS A 1 22 ? -5.889 7.257 -2.237 1.00 0.00 ? 22 HIS A N 14 ATOM 5611 C CA . HIS A 1 22 ? -5.304 8.286 -3.081 1.00 0.00 ? 22 HIS A CA 14 ATOM 5612 C C . HIS A 1 22 ? -4.578 9.313 -2.208 1.00 0.00 ? 22 HIS A C 14 ATOM 5613 O O . HIS A 1 22 ? -4.982 9.565 -1.074 1.00 0.00 ? 22 HIS A O 14 ATOM 5614 C CB . HIS A 1 22 ? -6.366 8.919 -3.982 1.00 0.00 ? 22 HIS A CB 14 ATOM 5615 C CG . HIS A 1 22 ? -5.802 9.809 -5.063 1.00 0.00 ? 22 HIS A CG 14 ATOM 5616 N ND1 . HIS A 1 22 ? -6.361 11.030 -5.396 1.00 0.00 ? 22 HIS A ND1 14 ATOM 5617 C CD2 . HIS A 1 22 ? -4.724 9.643 -5.882 1.00 0.00 ? 22 HIS A CD2 14 ATOM 5618 C CE1 . HIS A 1 22 ? -5.644 11.566 -6.373 1.00 0.00 ? 22 HIS A CE1 14 ATOM 5619 N NE2 . HIS A 1 22 ? -4.629 10.705 -6.674 1.00 0.00 ? 22 HIS A NE2 14 ATOM 5620 N N . ILE A 1 23 ? -3.520 9.876 -2.770 1.00 0.00 ? 23 ILE A N 14 ATOM 5621 C CA . ILE A 1 23 ? -2.734 10.870 -2.059 1.00 0.00 ? 23 ILE A CA 14 ATOM 5622 C C . ILE A 1 23 ? -2.961 12.244 -2.692 1.00 0.00 ? 23 ILE A C 14 ATOM 5623 O O . ILE A 1 23 ? -3.320 12.340 -3.866 1.00 0.00 ? 23 ILE A O 14 ATOM 5624 C CB . ILE A 1 23 ? -1.263 10.453 -2.007 1.00 0.00 ? 23 ILE A CB 14 ATOM 5625 C CG1 . ILE A 1 23 ? -1.102 8.968 -2.339 1.00 0.00 ? 23 ILE A CG1 14 ATOM 5626 C CG2 . ILE A 1 23 ? -0.639 10.810 -0.656 1.00 0.00 ? 23 ILE A CG2 14 ATOM 5627 C CD1 . ILE A 1 23 ? 0.375 8.563 -2.341 1.00 0.00 ? 23 ILE A CD1 14 ATOM 5628 N N . GLU A 1 24 ? -2.743 13.275 -1.889 1.00 0.00 ? 24 GLU A N 14 ATOM 5629 C CA . GLU A 1 24 ? -2.920 14.639 -2.356 1.00 0.00 ? 24 GLU A CA 14 ATOM 5630 C C . GLU A 1 24 ? -1.584 15.385 -2.335 1.00 0.00 ? 24 GLU A C 14 ATOM 5631 O O . GLU A 1 24 ? -1.434 16.414 -2.991 1.00 0.00 ? 24 GLU A O 14 ATOM 5632 C CB . GLU A 1 24 ? -3.970 15.374 -1.521 1.00 0.00 ? 24 GLU A CB 14 ATOM 5633 C CG . GLU A 1 24 ? -5.381 14.883 -1.860 1.00 0.00 ? 24 GLU A CG 14 ATOM 5634 C CD . GLU A 1 24 ? -6.442 15.771 -1.206 1.00 0.00 ? 24 GLU A CD 14 ATOM 5635 O OE1 . GLU A 1 24 ? -6.735 16.863 -1.715 1.00 0.00 ? 24 GLU A OE1 14 ATOM 5636 O OE2 . GLU A 1 24 ? -6.969 15.289 -0.131 1.00 0.00 ? 24 GLU A OE2 14 ATOM 5637 N N . SER A 1 25 ? -0.648 14.834 -1.575 1.00 0.00 ? 25 SER A N 14 ATOM 5638 C CA . SER A 1 25 ? 0.670 15.436 -1.460 1.00 0.00 ? 25 SER A CA 14 ATOM 5639 C C . SER A 1 25 ? 1.280 15.629 -2.851 1.00 0.00 ? 25 SER A C 14 ATOM 5640 O O . SER A 1 25 ? 2.191 16.437 -3.025 1.00 0.00 ? 25 SER A O 14 ATOM 5641 C CB . SER A 1 25 ? 1.592 14.577 -0.592 1.00 0.00 ? 25 SER A CB 14 ATOM 5642 O OG . SER A 1 25 ? 2.857 15.200 -0.379 1.00 0.00 ? 25 SER A OG 14 ATOM 5643 N N . LEU A 1 26 ? 0.752 14.878 -3.804 1.00 0.00 ? 26 LEU A N 14 ATOM 5644 C CA . LEU A 1 26 ? 1.231 14.957 -5.173 1.00 0.00 ? 26 LEU A CA 14 ATOM 5645 C C . LEU A 1 26 ? 0.210 14.304 -6.106 1.00 0.00 ? 26 LEU A C 14 ATOM 5646 O O . LEU A 1 26 ? 0.577 13.731 -7.131 1.00 0.00 ? 26 LEU A O 14 ATOM 5647 C CB . LEU A 1 26 ? 2.636 14.360 -5.284 1.00 0.00 ? 26 LEU A CB 14 ATOM 5648 C CG . LEU A 1 26 ? 3.760 15.345 -5.609 1.00 0.00 ? 26 LEU A CG 14 ATOM 5649 C CD1 . LEU A 1 26 ? 5.131 14.694 -5.420 1.00 0.00 ? 26 LEU A CD1 14 ATOM 5650 C CD2 . LEU A 1 26 ? 3.590 15.926 -7.016 1.00 0.00 ? 26 LEU A CD2 14 ATOM 5651 N N . ASP A 1 27 ? -1.052 14.413 -5.719 1.00 0.00 ? 27 ASP A N 14 ATOM 5652 C CA . ASP A 1 27 ? -2.130 13.839 -6.508 1.00 0.00 ? 27 ASP A CA 14 ATOM 5653 C C . ASP A 1 27 ? -1.753 12.415 -6.920 1.00 0.00 ? 27 ASP A C 14 ATOM 5654 O O . ASP A 1 27 ? -2.193 11.928 -7.960 1.00 0.00 ? 27 ASP A O 14 ATOM 5655 C CB . ASP A 1 27 ? -2.370 14.650 -7.783 1.00 0.00 ? 27 ASP A CB 14 ATOM 5656 C CG . ASP A 1 27 ? -1.108 15.007 -8.571 1.00 0.00 ? 27 ASP A CG 14 ATOM 5657 O OD1 . ASP A 1 27 ? -0.383 15.952 -8.222 1.00 0.00 ? 27 ASP A OD1 14 ATOM 5658 O OD2 . ASP A 1 27 ? -0.874 14.260 -9.596 1.00 0.00 ? 27 ASP A OD2 14 ATOM 5659 N N . SER A 1 28 ? -0.943 11.786 -6.081 1.00 0.00 ? 28 SER A N 14 ATOM 5660 C CA . SER A 1 28 ? -0.501 10.427 -6.343 1.00 0.00 ? 28 SER A CA 14 ATOM 5661 C C . SER A 1 28 ? -1.490 9.429 -5.737 1.00 0.00 ? 28 SER A C 14 ATOM 5662 O O . SER A 1 28 ? -2.371 9.812 -4.967 1.00 0.00 ? 28 SER A O 14 ATOM 5663 C CB . SER A 1 28 ? 0.903 10.186 -5.787 1.00 0.00 ? 28 SER A CB 14 ATOM 5664 O OG . SER A 1 28 ? 1.168 8.801 -5.588 1.00 0.00 ? 28 SER A OG 14 ATOM 5665 N N . TYR A 1 29 ? -1.313 8.169 -6.106 1.00 0.00 ? 29 TYR A N 14 ATOM 5666 C CA . TYR A 1 29 ? -2.178 7.115 -5.607 1.00 0.00 ? 29 TYR A CA 14 ATOM 5667 C C . TYR A 1 29 ? -1.391 6.111 -4.764 1.00 0.00 ? 29 TYR A C 14 ATOM 5668 O O . TYR A 1 29 ? -0.235 5.814 -5.066 1.00 0.00 ? 29 TYR A O 14 ATOM 5669 C CB . TYR A 1 29 ? -2.731 6.403 -6.844 1.00 0.00 ? 29 TYR A CB 14 ATOM 5670 C CG . TYR A 1 29 ? -4.042 6.989 -7.367 1.00 0.00 ? 29 TYR A CG 14 ATOM 5671 C CD1 . TYR A 1 29 ? -4.026 8.138 -8.136 1.00 0.00 ? 29 TYR A CD1 14 ATOM 5672 C CD2 . TYR A 1 29 ? -5.241 6.375 -7.074 1.00 0.00 ? 29 TYR A CD2 14 ATOM 5673 C CE1 . TYR A 1 29 ? -5.260 8.692 -8.628 1.00 0.00 ? 29 TYR A CE1 14 ATOM 5674 C CE2 . TYR A 1 29 ? -6.475 6.929 -7.566 1.00 0.00 ? 29 TYR A CE2 14 ATOM 5675 C CZ . TYR A 1 29 ? -6.424 8.060 -8.318 1.00 0.00 ? 29 TYR A CZ 14 ATOM 5676 O OH . TYR A 1 29 ? -7.591 8.582 -8.784 1.00 0.00 ? 29 TYR A OH 14 ATOM 5677 N N . THR A 1 30 ? -2.045 5.614 -3.727 1.00 0.00 ? 30 THR A N 14 ATOM 5678 C CA . THR A 1 30 ? -1.421 4.649 -2.838 1.00 0.00 ? 30 THR A CA 14 ATOM 5679 C C . THR A 1 30 ? -2.372 3.483 -2.562 1.00 0.00 ? 30 THR A C 14 ATOM 5680 O O . THR A 1 30 ? -3.413 3.361 -3.206 1.00 0.00 ? 30 THR A O 14 ATOM 5681 C CB . THR A 1 30 ? -0.982 5.387 -1.572 1.00 0.00 ? 30 THR A CB 14 ATOM 5682 O OG1 . THR A 1 30 ? -0.176 4.438 -0.879 1.00 0.00 ? 30 THR A OG1 14 ATOM 5683 C CG2 . THR A 1 30 ? -2.146 5.655 -0.616 1.00 0.00 ? 30 THR A CG2 14 ATOM 5684 N N . CYS A 1 31 ? -1.980 2.654 -1.606 1.00 0.00 ? 31 CYS A N 14 ATOM 5685 C CA . CYS A 1 31 ? -2.784 1.502 -1.238 1.00 0.00 ? 31 CYS A CA 14 ATOM 5686 C C . CYS A 1 31 ? -2.403 1.085 0.184 1.00 0.00 ? 31 CYS A C 14 ATOM 5687 O O . CYS A 1 31 ? -1.222 0.979 0.508 1.00 0.00 ? 31 CYS A O 14 ATOM 5688 C CB . CYS A 1 31 ? -2.617 0.353 -2.234 1.00 0.00 ? 31 CYS A CB 14 ATOM 5689 S SG . CYS A 1 31 ? -4.025 0.119 -3.379 1.00 0.00 ? 31 CYS A SG 14 ATOM 5690 N N . ASN A 1 32 ? -3.428 0.857 0.994 1.00 0.00 ? 32 ASN A N 14 ATOM 5691 C CA . ASN A 1 32 ? -3.215 0.454 2.373 1.00 0.00 ? 32 ASN A CA 14 ATOM 5692 C C . ASN A 1 32 ? -2.710 -0.989 2.405 1.00 0.00 ? 32 ASN A C 14 ATOM 5693 O O . ASN A 1 32 ? -3.503 -1.928 2.459 1.00 0.00 ? 32 ASN A O 14 ATOM 5694 C CB . ASN A 1 32 ? -4.518 0.517 3.173 1.00 0.00 ? 32 ASN A CB 14 ATOM 5695 C CG . ASN A 1 32 ? -5.268 1.820 2.898 1.00 0.00 ? 32 ASN A CG 14 ATOM 5696 O OD1 . ASN A 1 32 ? -5.054 2.492 1.901 1.00 0.00 ? 32 ASN A OD1 14 ATOM 5697 N ND2 . ASN A 1 32 ? -6.157 2.142 3.832 1.00 0.00 ? 32 ASN A ND2 14 ATOM 5698 N N . CYS A 1 33 ? -1.392 -1.123 2.372 1.00 0.00 ? 33 CYS A N 14 ATOM 5699 C CA . CYS A 1 33 ? -0.771 -2.436 2.397 1.00 0.00 ? 33 CYS A CA 14 ATOM 5700 C C . CYS A 1 33 ? -0.863 -2.984 3.823 1.00 0.00 ? 33 CYS A C 14 ATOM 5701 O O . CYS A 1 33 ? -1.910 -2.893 4.460 1.00 0.00 ? 33 CYS A O 14 ATOM 5702 C CB . CYS A 1 33 ? 0.674 -2.388 1.896 1.00 0.00 ? 33 CYS A CB 14 ATOM 5703 S SG . CYS A 1 33 ? 0.944 -1.324 0.432 1.00 0.00 ? 33 CYS A SG 14 ATOM 5704 N N . VAL A 1 34 ? 0.249 -3.542 4.281 1.00 0.00 ? 34 VAL A N 14 ATOM 5705 C CA . VAL A 1 34 ? 0.307 -4.104 5.619 1.00 0.00 ? 34 VAL A CA 14 ATOM 5706 C C . VAL A 1 34 ? 1.702 -3.875 6.204 1.00 0.00 ? 34 VAL A C 14 ATOM 5707 O O . VAL A 1 34 ? 2.545 -3.237 5.576 1.00 0.00 ? 34 VAL A O 14 ATOM 5708 C CB . VAL A 1 34 ? -0.092 -5.581 5.584 1.00 0.00 ? 34 VAL A CB 14 ATOM 5709 C CG1 . VAL A 1 34 ? -1.592 -5.739 5.322 1.00 0.00 ? 34 VAL A CG1 14 ATOM 5710 C CG2 . VAL A 1 34 ? 0.730 -6.346 4.543 1.00 0.00 ? 34 VAL A CG2 14 ATOM 5711 N N . ILE A 1 35 ? 1.901 -4.411 7.399 1.00 0.00 ? 35 ILE A N 14 ATOM 5712 C CA . ILE A 1 35 ? 3.181 -4.271 8.076 1.00 0.00 ? 35 ILE A CA 14 ATOM 5713 C C . ILE A 1 35 ? 4.298 -4.762 7.152 1.00 0.00 ? 35 ILE A C 14 ATOM 5714 O O . ILE A 1 35 ? 4.071 -5.622 6.304 1.00 0.00 ? 35 ILE A O 14 ATOM 5715 C CB . ILE A 1 35 ? 3.148 -4.980 9.432 1.00 0.00 ? 35 ILE A CB 14 ATOM 5716 C CG1 . ILE A 1 35 ? 3.554 -6.449 9.293 1.00 0.00 ? 35 ILE A CG1 14 ATOM 5717 C CG2 . ILE A 1 35 ? 1.782 -4.824 10.100 1.00 0.00 ? 35 ILE A CG2 14 ATOM 5718 C CD1 . ILE A 1 35 ? 4.735 -6.780 10.207 1.00 0.00 ? 35 ILE A CD1 14 ATOM 5719 N N . GLY A 1 36 ? 5.477 -4.191 7.348 1.00 0.00 ? 36 GLY A N 14 ATOM 5720 C CA . GLY A 1 36 ? 6.630 -4.559 6.543 1.00 0.00 ? 36 GLY A CA 14 ATOM 5721 C C . GLY A 1 36 ? 6.277 -4.571 5.055 1.00 0.00 ? 36 GLY A C 14 ATOM 5722 O O . GLY A 1 36 ? 6.946 -5.228 4.259 1.00 0.00 ? 36 GLY A O 14 ATOM 5723 N N . TYR A 1 37 ? 5.226 -3.835 4.722 1.00 0.00 ? 37 TYR A N 14 ATOM 5724 C CA . TYR A 1 37 ? 4.777 -3.752 3.343 1.00 0.00 ? 37 TYR A CA 14 ATOM 5725 C C . TYR A 1 37 ? 4.179 -2.375 3.043 1.00 0.00 ? 37 TYR A C 14 ATOM 5726 O O . TYR A 1 37 ? 3.140 -2.013 3.594 1.00 0.00 ? 37 TYR A O 14 ATOM 5727 C CB . TYR A 1 37 ? 3.685 -4.812 3.191 1.00 0.00 ? 37 TYR A CB 14 ATOM 5728 C CG . TYR A 1 37 ? 4.207 -6.184 2.759 1.00 0.00 ? 37 TYR A CG 14 ATOM 5729 C CD1 . TYR A 1 37 ? 4.694 -6.366 1.480 1.00 0.00 ? 37 TYR A CD1 14 ATOM 5730 C CD2 . TYR A 1 37 ? 4.191 -7.240 3.649 1.00 0.00 ? 37 TYR A CD2 14 ATOM 5731 C CE1 . TYR A 1 37 ? 5.185 -7.658 1.074 1.00 0.00 ? 37 TYR A CE1 14 ATOM 5732 C CE2 . TYR A 1 37 ? 4.684 -8.531 3.243 1.00 0.00 ? 37 TYR A CE2 14 ATOM 5733 C CZ . TYR A 1 37 ? 5.156 -8.677 1.976 1.00 0.00 ? 37 TYR A CZ 14 ATOM 5734 O OH . TYR A 1 37 ? 5.619 -9.897 1.594 1.00 0.00 ? 37 TYR A OH 14 ATOM 5735 N N . SER A 1 38 ? 4.861 -1.647 2.173 1.00 0.00 ? 38 SER A N 14 ATOM 5736 C CA . SER A 1 38 ? 4.410 -0.318 1.793 1.00 0.00 ? 38 SER A CA 14 ATOM 5737 C C . SER A 1 38 ? 5.139 0.139 0.528 1.00 0.00 ? 38 SER A C 14 ATOM 5738 O O . SER A 1 38 ? 5.581 -0.685 -0.269 1.00 0.00 ? 38 SER A O 14 ATOM 5739 C CB . SER A 1 38 ? 4.636 0.685 2.928 1.00 0.00 ? 38 SER A CB 14 ATOM 5740 O OG . SER A 1 38 ? 6.010 1.039 3.062 1.00 0.00 ? 38 SER A OG 14 ATOM 5741 N N . GLY A 1 39 ? 5.238 1.453 0.383 1.00 0.00 ? 39 GLY A N 14 ATOM 5742 C CA . GLY A 1 39 ? 5.904 2.030 -0.773 1.00 0.00 ? 39 GLY A CA 14 ATOM 5743 C C . GLY A 1 39 ? 4.886 2.502 -1.813 1.00 0.00 ? 39 GLY A C 14 ATOM 5744 O O . GLY A 1 39 ? 4.667 3.701 -1.974 1.00 0.00 ? 39 GLY A O 14 ATOM 5745 N N . ASP A 1 40 ? 4.292 1.532 -2.493 1.00 0.00 ? 40 ASP A N 14 ATOM 5746 C CA . ASP A 1 40 ? 3.302 1.833 -3.514 1.00 0.00 ? 40 ASP A CA 14 ATOM 5747 C C . ASP A 1 40 ? 2.752 0.524 -4.085 1.00 0.00 ? 40 ASP A C 14 ATOM 5748 O O . ASP A 1 40 ? 3.447 -0.180 -4.816 1.00 0.00 ? 40 ASP A O 14 ATOM 5749 C CB . ASP A 1 40 ? 3.923 2.626 -4.666 1.00 0.00 ? 40 ASP A CB 14 ATOM 5750 C CG . ASP A 1 40 ? 2.939 3.068 -5.750 1.00 0.00 ? 40 ASP A CG 14 ATOM 5751 O OD1 . ASP A 1 40 ? 2.295 4.122 -5.637 1.00 0.00 ? 40 ASP A OD1 14 ATOM 5752 O OD2 . ASP A 1 40 ? 2.844 2.270 -6.759 1.00 0.00 ? 40 ASP A OD2 14 ATOM 5753 N N . ARG A 1 41 ? 1.508 0.237 -3.729 1.00 0.00 ? 41 ARG A N 14 ATOM 5754 C CA . ARG A 1 41 ? 0.855 -0.974 -4.198 1.00 0.00 ? 41 ARG A CA 14 ATOM 5755 C C . ARG A 1 41 ? 1.338 -2.181 -3.390 1.00 0.00 ? 41 ARG A C 14 ATOM 5756 O O . ARG A 1 41 ? 1.107 -3.324 -3.780 1.00 0.00 ? 41 ARG A O 14 ATOM 5757 C CB . ARG A 1 41 ? 1.141 -1.214 -5.681 1.00 0.00 ? 41 ARG A CB 14 ATOM 5758 C CG . ARG A 1 41 ? -0.098 -1.757 -6.397 1.00 0.00 ? 41 ARG A CG 14 ATOM 5759 C CD . ARG A 1 41 ? 0.295 -2.710 -7.527 1.00 0.00 ? 41 ARG A CD 14 ATOM 5760 N NE . ARG A 1 41 ? 0.174 -2.023 -8.832 1.00 0.00 ? 41 ARG A NE 14 ATOM 5761 C CZ . ARG A 1 41 ? 1.228 -1.621 -9.574 1.00 0.00 ? 41 ARG A CZ 14 ATOM 5762 N NH1 . ARG A 1 41 ? 1.784 -2.478 -10.412 1.00 0.00 ? 41 ARG A NH1 14 ATOM 5763 N NH2 . ARG A 1 41 ? 1.705 -0.364 -9.464 1.00 0.00 ? 41 ARG A NH2 14 ATOM 5764 N N . CYS A 1 42 ? 1.997 -1.885 -2.281 1.00 0.00 ? 42 CYS A N 14 ATOM 5765 C CA . CYS A 1 42 ? 2.512 -2.933 -1.415 1.00 0.00 ? 42 CYS A CA 14 ATOM 5766 C C . CYS A 1 42 ? 3.645 -3.651 -2.151 1.00 0.00 ? 42 CYS A C 14 ATOM 5767 O O . CYS A 1 42 ? 3.496 -4.805 -2.548 1.00 0.00 ? 42 CYS A O 14 ATOM 5768 C CB . CYS A 1 42 ? 1.411 -3.900 -0.979 1.00 0.00 ? 42 CYS A CB 14 ATOM 5769 S SG . CYS A 1 42 ? -0.205 -3.115 -0.624 1.00 0.00 ? 42 CYS A SG 14 ATOM 5770 N N . GLN A 1 43 ? 4.750 -2.938 -2.310 1.00 0.00 ? 43 GLN A N 14 ATOM 5771 C CA . GLN A 1 43 ? 5.906 -3.493 -2.992 1.00 0.00 ? 43 GLN A CA 14 ATOM 5772 C C . GLN A 1 43 ? 7.114 -3.520 -2.054 1.00 0.00 ? 43 GLN A C 14 ATOM 5773 O O . GLN A 1 43 ? 7.836 -4.514 -1.991 1.00 0.00 ? 43 GLN A O 14 ATOM 5774 C CB . GLN A 1 43 ? 6.221 -2.707 -4.266 1.00 0.00 ? 43 GLN A CB 14 ATOM 5775 C CG . GLN A 1 43 ? 7.514 -3.207 -4.913 1.00 0.00 ? 43 GLN A CG 14 ATOM 5776 C CD . GLN A 1 43 ? 7.419 -4.696 -5.251 1.00 0.00 ? 43 GLN A CD 14 ATOM 5777 O OE1 . GLN A 1 43 ? 7.430 -5.099 -6.403 1.00 0.00 ? 43 GLN A OE1 14 ATOM 5778 N NE2 . GLN A 1 43 ? 7.325 -5.486 -4.186 1.00 0.00 ? 43 GLN A NE2 14 ATOM 5779 N N . THR A 1 44 ? 7.298 -2.414 -1.346 1.00 0.00 ? 44 THR A N 14 ATOM 5780 C CA . THR A 1 44 ? 8.406 -2.299 -0.413 1.00 0.00 ? 44 THR A CA 14 ATOM 5781 C C . THR A 1 44 ? 8.235 -3.287 0.742 1.00 0.00 ? 44 THR A C 14 ATOM 5782 O O . THR A 1 44 ? 7.921 -2.891 1.863 1.00 0.00 ? 44 THR A O 14 ATOM 5783 C CB . THR A 1 44 ? 8.489 -0.841 0.042 1.00 0.00 ? 44 THR A CB 14 ATOM 5784 O OG1 . THR A 1 44 ? 8.696 -0.111 -1.164 1.00 0.00 ? 44 THR A OG1 14 ATOM 5785 C CG2 . THR A 1 44 ? 9.746 -0.557 0.869 1.00 0.00 ? 44 THR A CG2 14 ATOM 5786 N N . ARG A 1 45 ? 8.451 -4.557 0.430 1.00 0.00 ? 45 ARG A N 14 ATOM 5787 C CA . ARG A 1 45 ? 8.325 -5.604 1.427 1.00 0.00 ? 45 ARG A CA 14 ATOM 5788 C C . ARG A 1 45 ? 9.520 -5.575 2.383 1.00 0.00 ? 45 ARG A C 14 ATOM 5789 O O . ARG A 1 45 ? 10.592 -6.084 2.059 1.00 0.00 ? 45 ARG A O 14 ATOM 5790 C CB . ARG A 1 45 ? 8.242 -6.984 0.769 1.00 0.00 ? 45 ARG A CB 14 ATOM 5791 C CG . ARG A 1 45 ? 8.148 -8.088 1.824 1.00 0.00 ? 45 ARG A CG 14 ATOM 5792 C CD . ARG A 1 45 ? 8.207 -9.473 1.175 1.00 0.00 ? 45 ARG A CD 14 ATOM 5793 N NE . ARG A 1 45 ? 9.541 -9.691 0.568 1.00 0.00 ? 45 ARG A NE 14 ATOM 5794 C CZ . ARG A 1 45 ? 9.748 -9.901 -0.749 1.00 0.00 ? 45 ARG A CZ 14 ATOM 5795 N NH1 . ARG A 1 45 ? 9.618 -11.123 -1.230 1.00 0.00 ? 45 ARG A NH1 14 ATOM 5796 N NH2 . ARG A 1 45 ? 10.083 -8.875 -1.561 1.00 0.00 ? 45 ARG A NH2 14 ATOM 5797 N N . ASP A 1 46 ? 9.295 -4.971 3.541 1.00 0.00 ? 46 ASP A N 14 ATOM 5798 C CA . ASP A 1 46 ? 10.340 -4.866 4.545 1.00 0.00 ? 46 ASP A CA 14 ATOM 5799 C C . ASP A 1 46 ? 10.595 -6.246 5.155 1.00 0.00 ? 46 ASP A C 14 ATOM 5800 O O . ASP A 1 46 ? 10.531 -7.258 4.459 1.00 0.00 ? 46 ASP A O 14 ATOM 5801 C CB . ASP A 1 46 ? 9.926 -3.920 5.674 1.00 0.00 ? 46 ASP A CB 14 ATOM 5802 C CG . ASP A 1 46 ? 9.272 -2.616 5.216 1.00 0.00 ? 46 ASP A CG 14 ATOM 5803 O OD1 . ASP A 1 46 ? 8.051 -2.730 4.815 1.00 0.00 ? 46 ASP A OD1 14 ATOM 5804 O OD2 . ASP A 1 46 ? 9.895 -1.543 5.241 1.00 0.00 ? 46 ASP A OD2 14 ATOM 5805 N N . LEU A 1 47 ? 10.877 -6.243 6.449 1.00 0.00 ? 47 LEU A N 14 ATOM 5806 C CA . LEU A 1 47 ? 11.141 -7.482 7.160 1.00 0.00 ? 47 LEU A CA 14 ATOM 5807 C C . LEU A 1 47 ? 9.839 -8.004 7.770 1.00 0.00 ? 47 LEU A C 14 ATOM 5808 O O . LEU A 1 47 ? 9.666 -9.210 7.934 1.00 0.00 ? 47 LEU A O 14 ATOM 5809 C CB . LEU A 1 47 ? 12.262 -7.284 8.184 1.00 0.00 ? 47 LEU A CB 14 ATOM 5810 C CG . LEU A 1 47 ? 13.307 -6.222 7.837 1.00 0.00 ? 47 LEU A CG 14 ATOM 5811 C CD1 . LEU A 1 47 ? 14.445 -6.217 8.859 1.00 0.00 ? 47 LEU A CD1 14 ATOM 5812 C CD2 . LEU A 1 47 ? 13.819 -6.403 6.407 1.00 0.00 ? 47 LEU A CD2 14 ATOM 5813 N N . ARG A 1 48 ? 8.955 -7.069 8.086 1.00 0.00 ? 48 ARG A N 14 ATOM 5814 C CA . ARG A 1 48 ? 7.673 -7.418 8.672 1.00 0.00 ? 48 ARG A CA 14 ATOM 5815 C C . ARG A 1 48 ? 7.848 -7.792 10.147 1.00 0.00 ? 48 ARG A C 14 ATOM 5816 O O . ARG A 1 48 ? 7.669 -8.949 10.522 1.00 0.00 ? 48 ARG A O 14 ATOM 5817 C CB . ARG A 1 48 ? 7.028 -8.591 7.930 1.00 0.00 ? 48 ARG A CB 14 ATOM 5818 C CG . ARG A 1 48 ? 5.591 -8.260 7.524 1.00 0.00 ? 48 ARG A CG 14 ATOM 5819 C CD . ARG A 1 48 ? 5.198 -8.999 6.243 1.00 0.00 ? 48 ARG A CD 14 ATOM 5820 N NE . ARG A 1 48 ? 3.726 -9.020 6.103 1.00 0.00 ? 48 ARG A NE 14 ATOM 5821 C CZ . ARG A 1 48 ? 3.001 -10.142 5.904 1.00 0.00 ? 48 ARG A CZ 14 ATOM 5822 N NH1 . ARG A 1 48 ? 3.093 -10.820 4.741 1.00 0.00 ? 48 ARG A NH1 14 ATOM 5823 N NH2 . ARG A 1 48 ? 2.200 -10.564 6.866 1.00 0.00 ? 48 ARG A NH2 14 ATOM 5824 N N . TRP A 1 49 ? 8.195 -6.789 10.941 1.00 0.00 ? 49 TRP A N 14 ATOM 5825 C CA . TRP A 1 49 ? 8.396 -6.998 12.364 1.00 0.00 ? 49 TRP A CA 14 ATOM 5826 C C . TRP A 1 49 ? 7.288 -7.926 12.867 1.00 0.00 ? 49 TRP A C 14 ATOM 5827 O O . TRP A 1 49 ? 6.127 -7.772 12.494 1.00 0.00 ? 49 TRP A O 14 ATOM 5828 C CB . TRP A 1 49 ? 8.441 -5.665 13.112 1.00 0.00 ? 49 TRP A CB 14 ATOM 5829 C CG . TRP A 1 49 ? 7.087 -4.963 13.220 1.00 0.00 ? 49 TRP A CG 14 ATOM 5830 C CD1 . TRP A 1 49 ? 5.951 -5.437 13.749 1.00 0.00 ? 49 TRP A CD1 14 ATOM 5831 C CD2 . TRP A 1 49 ? 6.770 -3.632 12.762 1.00 0.00 ? 49 TRP A CD2 14 ATOM 5832 N NE1 . TRP A 1 49 ? 4.930 -4.514 13.666 1.00 0.00 ? 49 TRP A NE1 14 ATOM 5833 C CE2 . TRP A 1 49 ? 5.443 -3.381 13.048 1.00 0.00 ? 49 TRP A CE2 14 ATOM 5834 C CE3 . TRP A 1 49 ? 7.578 -2.671 12.128 1.00 0.00 ? 49 TRP A CE3 14 ATOM 5835 C CZ2 . TRP A 1 49 ? 4.806 -2.173 12.735 1.00 0.00 ? 49 TRP A CZ2 14 ATOM 5836 C CZ3 . TRP A 1 49 ? 6.926 -1.469 11.822 1.00 0.00 ? 49 TRP A CZ3 14 ATOM 5837 C CH2 . TRP A 1 49 ? 5.591 -1.201 12.103 1.00 0.00 ? 49 TRP A CH2 14 ATOM 5838 N N . TRP A 1 50 ? 7.686 -8.871 13.704 1.00 0.00 ? 50 TRP A N 14 ATOM 5839 C CA . TRP A 1 50 ? 6.742 -9.825 14.262 1.00 0.00 ? 50 TRP A CA 14 ATOM 5840 C C . TRP A 1 50 ? 7.237 -10.220 15.656 1.00 0.00 ? 50 TRP A C 14 ATOM 5841 O O . TRP A 1 50 ? 8.210 -9.658 16.156 1.00 0.00 ? 50 TRP A O 14 ATOM 5842 C CB . TRP A 1 50 ? 6.560 -11.025 13.331 1.00 0.00 ? 50 TRP A CB 14 ATOM 5843 C CG . TRP A 1 50 ? 5.740 -10.719 12.077 1.00 0.00 ? 50 TRP A CG 14 ATOM 5844 C CD1 . TRP A 1 50 ? 4.595 -10.027 11.988 1.00 0.00 ? 50 TRP A CD1 14 ATOM 5845 C CD2 . TRP A 1 50 ? 6.048 -11.125 10.727 1.00 0.00 ? 50 TRP A CD2 14 ATOM 5846 N NE1 . TRP A 1 50 ? 4.145 -9.959 10.684 1.00 0.00 ? 50 TRP A NE1 14 ATOM 5847 C CE2 . TRP A 1 50 ? 5.057 -10.648 9.893 1.00 0.00 ? 50 TRP A CE2 14 ATOM 5848 C CE3 . TRP A 1 50 ? 7.130 -11.872 10.225 1.00 0.00 ? 50 TRP A CE3 14 ATOM 5849 C CZ2 . TRP A 1 50 ? 5.049 -10.863 8.511 1.00 0.00 ? 50 TRP A CZ2 14 ATOM 5850 C CZ3 . TRP A 1 50 ? 7.106 -12.077 8.841 1.00 0.00 ? 50 TRP A CZ3 14 ATOM 5851 C CH2 . TRP A 1 50 ? 6.116 -11.603 7.989 1.00 0.00 ? 50 TRP A CH2 14 ATOM 5852 N N . GLU A 1 51 ? 6.544 -11.185 16.244 1.00 0.00 ? 51 GLU A N 14 ATOM 5853 C CA . GLU A 1 51 ? 6.901 -11.662 17.568 1.00 0.00 ? 51 GLU A CA 14 ATOM 5854 C C . GLU A 1 51 ? 7.128 -13.174 17.545 1.00 0.00 ? 51 GLU A C 14 ATOM 5855 O O . GLU A 1 51 ? 6.510 -13.886 16.754 1.00 0.00 ? 51 GLU A O 14 ATOM 5856 C CB . GLU A 1 51 ? 5.828 -11.284 18.593 1.00 0.00 ? 51 GLU A CB 14 ATOM 5857 C CG . GLU A 1 51 ? 4.473 -11.069 17.915 1.00 0.00 ? 51 GLU A CG 14 ATOM 5858 C CD . GLU A 1 51 ? 3.341 -11.056 18.944 1.00 0.00 ? 51 GLU A CD 14 ATOM 5859 O OE1 . GLU A 1 51 ? 3.254 -10.122 19.756 1.00 0.00 ? 51 GLU A OE1 14 ATOM 5860 O OE2 . GLU A 1 51 ? 2.534 -12.059 18.881 1.00 0.00 ? 51 GLU A OE2 14 ATOM 5861 N N . LEU A 1 52 ? 8.017 -13.621 18.421 1.00 0.00 ? 52 LEU A N 14 ATOM 5862 C CA . LEU A 1 52 ? 8.335 -15.035 18.510 1.00 0.00 ? 52 LEU A CA 14 ATOM 5863 C C . LEU A 1 52 ? 8.553 -15.412 19.976 1.00 0.00 ? 52 LEU A C 14 ATOM 5864 O O . LEU A 1 52 ? 8.847 -14.553 20.805 1.00 0.00 ? 52 LEU A O 14 ATOM 5865 C CB . LEU A 1 52 ? 9.518 -15.377 17.604 1.00 0.00 ? 52 LEU A CB 14 ATOM 5866 C CG . LEU A 1 52 ? 10.908 -15.135 18.197 1.00 0.00 ? 52 LEU A CG 14 ATOM 5867 C CD1 . LEU A 1 52 ? 11.033 -13.708 18.734 1.00 0.00 ? 52 LEU A CD1 14 ATOM 5868 C CD2 . LEU A 1 52 ? 11.240 -16.181 19.262 1.00 0.00 ? 52 LEU A CD2 14 ATOM 5869 N N . ARG A 1 53 ? 8.402 -16.699 20.253 1.00 0.00 ? 53 ARG A N 14 ATOM 5870 C CA . ARG A 1 53 ? 8.581 -17.202 21.604 1.00 0.00 ? 53 ARG A CA 14 ATOM 5871 C C . ARG A 1 53 ? 9.098 -18.641 21.573 1.00 0.00 ? 53 ARG A C 14 ATOM 5872 O O . ARG A 1 53 ? 9.505 -19.135 20.522 1.00 0.00 ? 53 ARG A O 14 ATOM 5873 C CB . ARG A 1 53 ? 7.266 -17.154 22.387 1.00 0.00 ? 53 ARG A CB 14 ATOM 5874 C CG . ARG A 1 53 ? 7.506 -17.409 23.876 1.00 0.00 ? 53 ARG A CG 14 ATOM 5875 C CD . ARG A 1 53 ? 6.898 -18.745 24.310 1.00 0.00 ? 53 ARG A CD 14 ATOM 5876 N NE . ARG A 1 53 ? 5.423 -18.637 24.366 1.00 0.00 ? 53 ARG A NE 14 ATOM 5877 C CZ . ARG A 1 53 ? 4.728 -18.345 25.484 1.00 0.00 ? 53 ARG A CZ 14 ATOM 5878 N NH1 . ARG A 1 53 ? 4.349 -19.326 26.330 1.00 0.00 ? 53 ARG A NH1 14 ATOM 5879 N NH2 . ARG A 1 53 ? 4.423 -17.086 25.739 1.00 0.00 ? 53 ARG A NH2 14 ATOM 5880 O OXT . ARG A 1 53 ? 9.065 -19.256 22.706 1.00 0.00 ? 53 ARG A OXT 14 ATOM 5881 N N . ASN A 1 1 ? -3.173 15.963 1.222 1.00 0.00 ? 1 ASN A N 15 ATOM 5882 C CA . ASN A 1 1 ? -4.206 15.353 2.042 1.00 0.00 ? 1 ASN A CA 15 ATOM 5883 C C . ASN A 1 1 ? -4.567 13.983 1.467 1.00 0.00 ? 1 ASN A C 15 ATOM 5884 O O . ASN A 1 1 ? -4.486 13.773 0.257 1.00 0.00 ? 1 ASN A O 15 ATOM 5885 C CB . ASN A 1 1 ? -5.472 16.210 2.058 1.00 0.00 ? 1 ASN A CB 15 ATOM 5886 C CG . ASN A 1 1 ? -6.012 16.366 3.481 1.00 0.00 ? 1 ASN A CG 15 ATOM 5887 O OD1 . ASN A 1 1 ? -6.709 15.513 4.006 1.00 0.00 ? 1 ASN A OD1 15 ATOM 5888 N ND2 . ASN A 1 1 ? -5.654 17.501 4.075 1.00 0.00 ? 1 ASN A ND2 15 ATOM 5889 N N . SER A 1 2 ? -4.958 13.086 2.359 1.00 0.00 ? 2 SER A N 15 ATOM 5890 C CA . SER A 1 2 ? -5.333 11.741 1.955 1.00 0.00 ? 2 SER A CA 15 ATOM 5891 C C . SER A 1 2 ? -6.810 11.705 1.560 1.00 0.00 ? 2 SER A C 15 ATOM 5892 O O . SER A 1 2 ? -7.679 12.039 2.365 1.00 0.00 ? 2 SER A O 15 ATOM 5893 C CB . SER A 1 2 ? -5.056 10.733 3.071 1.00 0.00 ? 2 SER A CB 15 ATOM 5894 O OG . SER A 1 2 ? -5.728 11.078 4.280 1.00 0.00 ? 2 SER A OG 15 ATOM 5895 N N . TYR A 1 3 ? -7.051 11.300 0.323 1.00 0.00 ? 3 TYR A N 15 ATOM 5896 C CA . TYR A 1 3 ? -8.408 11.217 -0.187 1.00 0.00 ? 3 TYR A CA 15 ATOM 5897 C C . TYR A 1 3 ? -8.697 9.825 -0.753 1.00 0.00 ? 3 TYR A C 15 ATOM 5898 O O . TYR A 1 3 ? -7.876 9.260 -1.474 1.00 0.00 ? 3 TYR A O 15 ATOM 5899 C CB . TYR A 1 3 ? -8.496 12.242 -1.320 1.00 0.00 ? 3 TYR A CB 15 ATOM 5900 C CG . TYR A 1 3 ? -9.791 12.164 -2.131 1.00 0.00 ? 3 TYR A CG 15 ATOM 5901 C CD1 . TYR A 1 3 ? -10.914 12.847 -1.709 1.00 0.00 ? 3 TYR A CD1 15 ATOM 5902 C CD2 . TYR A 1 3 ? -9.838 11.407 -3.286 1.00 0.00 ? 3 TYR A CD2 15 ATOM 5903 C CE1 . TYR A 1 3 ? -12.131 12.774 -2.472 1.00 0.00 ? 3 TYR A CE1 15 ATOM 5904 C CE2 . TYR A 1 3 ? -11.058 11.333 -4.048 1.00 0.00 ? 3 TYR A CE2 15 ATOM 5905 C CZ . TYR A 1 3 ? -12.145 12.019 -3.605 1.00 0.00 ? 3 TYR A CZ 15 ATOM 5906 O OH . TYR A 1 3 ? -13.294 11.950 -4.326 1.00 0.00 ? 3 TYR A OH 15 ATOM 5907 N N . PRO A 1 4 ? -9.899 9.297 -0.394 1.00 0.00 ? 4 PRO A N 15 ATOM 5908 C CA . PRO A 1 4 ? -10.307 7.982 -0.857 1.00 0.00 ? 4 PRO A CA 15 ATOM 5909 C C . PRO A 1 4 ? -10.725 8.024 -2.328 1.00 0.00 ? 4 PRO A C 15 ATOM 5910 O O . PRO A 1 4 ? -11.631 8.768 -2.698 1.00 0.00 ? 4 PRO A O 15 ATOM 5911 C CB . PRO A 1 4 ? -11.438 7.571 0.072 1.00 0.00 ? 4 PRO A CB 15 ATOM 5912 C CG . PRO A 1 4 ? -11.931 8.854 0.719 1.00 0.00 ? 4 PRO A CG 15 ATOM 5913 C CD . PRO A 1 4 ? -10.897 9.937 0.458 1.00 0.00 ? 4 PRO A CD 15 ATOM 5914 N N . GLY A 1 5 ? -10.046 7.213 -3.127 1.00 0.00 ? 5 GLY A N 15 ATOM 5915 C CA . GLY A 1 5 ? -10.337 7.149 -4.549 1.00 0.00 ? 5 GLY A CA 15 ATOM 5916 C C . GLY A 1 5 ? -9.215 6.432 -5.305 1.00 0.00 ? 5 GLY A C 15 ATOM 5917 O O . GLY A 1 5 ? -8.086 6.358 -4.824 1.00 0.00 ? 5 GLY A O 15 ATOM 5918 N N . CYS A 1 6 ? -9.568 5.921 -6.476 1.00 0.00 ? 6 CYS A N 15 ATOM 5919 C CA . CYS A 1 6 ? -8.607 5.211 -7.303 1.00 0.00 ? 6 CYS A CA 15 ATOM 5920 C C . CYS A 1 6 ? -9.374 4.288 -8.250 1.00 0.00 ? 6 CYS A C 15 ATOM 5921 O O . CYS A 1 6 ? -9.634 3.133 -7.921 1.00 0.00 ? 6 CYS A O 15 ATOM 5922 C CB . CYS A 1 6 ? -7.590 4.443 -6.456 1.00 0.00 ? 6 CYS A CB 15 ATOM 5923 S SG . CYS A 1 6 ? -8.293 3.594 -4.996 1.00 0.00 ? 6 CYS A SG 15 ATOM 5924 N N . PRO A 1 7 ? -9.728 4.849 -9.438 1.00 0.00 ? 7 PRO A N 15 ATOM 5925 C CA . PRO A 1 7 ? -10.461 4.088 -10.434 1.00 0.00 ? 7 PRO A CA 15 ATOM 5926 C C . PRO A 1 7 ? -9.548 3.083 -11.140 1.00 0.00 ? 7 PRO A C 15 ATOM 5927 O O . PRO A 1 7 ? -8.336 3.092 -10.937 1.00 0.00 ? 7 PRO A O 15 ATOM 5928 C CB . PRO A 1 7 ? -11.039 5.130 -11.378 1.00 0.00 ? 7 PRO A CB 15 ATOM 5929 C CG . PRO A 1 7 ? -10.228 6.395 -11.148 1.00 0.00 ? 7 PRO A CG 15 ATOM 5930 C CD . PRO A 1 7 ? -9.439 6.215 -9.863 1.00 0.00 ? 7 PRO A CD 15 ATOM 5931 N N . SER A 1 8 ? -10.167 2.241 -11.955 1.00 0.00 ? 8 SER A N 15 ATOM 5932 C CA . SER A 1 8 ? -9.425 1.232 -12.690 1.00 0.00 ? 8 SER A CA 15 ATOM 5933 C C . SER A 1 8 ? -8.459 0.503 -11.754 1.00 0.00 ? 8 SER A C 15 ATOM 5934 O O . SER A 1 8 ? -7.546 -0.184 -12.209 1.00 0.00 ? 8 SER A O 15 ATOM 5935 C CB . SER A 1 8 ? -8.660 1.854 -13.861 1.00 0.00 ? 8 SER A CB 15 ATOM 5936 O OG . SER A 1 8 ? -8.194 0.871 -14.780 1.00 0.00 ? 8 SER A OG 15 ATOM 5937 N N . SER A 1 9 ? -8.694 0.680 -10.463 1.00 0.00 ? 9 SER A N 15 ATOM 5938 C CA . SER A 1 9 ? -7.856 0.049 -9.456 1.00 0.00 ? 9 SER A CA 15 ATOM 5939 C C . SER A 1 9 ? -6.380 0.251 -9.804 1.00 0.00 ? 9 SER A C 15 ATOM 5940 O O . SER A 1 9 ? -5.524 -0.515 -9.360 1.00 0.00 ? 9 SER A O 15 ATOM 5941 C CB . SER A 1 9 ? -8.174 -1.443 -9.333 1.00 0.00 ? 9 SER A CB 15 ATOM 5942 O OG . SER A 1 9 ? -7.997 -1.919 -8.002 1.00 0.00 ? 9 SER A OG 15 ATOM 5943 N N . TYR A 1 10 ? -6.127 1.284 -10.591 1.00 0.00 ? 10 TYR A N 15 ATOM 5944 C CA . TYR A 1 10 ? -4.769 1.596 -11.003 1.00 0.00 ? 10 TYR A CA 15 ATOM 5945 C C . TYR A 1 10 ? -3.924 0.325 -11.118 1.00 0.00 ? 10 TYR A C 15 ATOM 5946 O O . TYR A 1 10 ? -2.746 0.324 -10.765 1.00 0.00 ? 10 TYR A O 15 ATOM 5947 C CB . TYR A 1 10 ? -4.187 2.480 -9.900 1.00 0.00 ? 10 TYR A CB 15 ATOM 5948 C CG . TYR A 1 10 ? -4.134 3.968 -10.255 1.00 0.00 ? 10 TYR A CG 15 ATOM 5949 C CD1 . TYR A 1 10 ? -5.277 4.737 -10.180 1.00 0.00 ? 10 TYR A CD1 15 ATOM 5950 C CD2 . TYR A 1 10 ? -2.943 4.541 -10.653 1.00 0.00 ? 10 TYR A CD2 15 ATOM 5951 C CE1 . TYR A 1 10 ? -5.227 6.136 -10.516 1.00 0.00 ? 10 TYR A CE1 15 ATOM 5952 C CE2 . TYR A 1 10 ? -2.894 5.940 -10.989 1.00 0.00 ? 10 TYR A CE2 15 ATOM 5953 C CZ . TYR A 1 10 ? -4.038 6.669 -10.903 1.00 0.00 ? 10 TYR A CZ 15 ATOM 5954 O OH . TYR A 1 10 ? -3.991 7.990 -11.222 1.00 0.00 ? 10 TYR A OH 15 ATOM 5955 N N . ASP A 1 11 ? -4.561 -0.725 -11.616 1.00 0.00 ? 11 ASP A N 15 ATOM 5956 C CA . ASP A 1 11 ? -3.883 -2.001 -11.782 1.00 0.00 ? 11 ASP A CA 15 ATOM 5957 C C . ASP A 1 11 ? -3.433 -2.517 -10.415 1.00 0.00 ? 11 ASP A C 15 ATOM 5958 O O . ASP A 1 11 ? -2.247 -2.473 -10.091 1.00 0.00 ? 11 ASP A O 15 ATOM 5959 C CB . ASP A 1 11 ? -2.641 -1.853 -12.664 1.00 0.00 ? 11 ASP A CB 15 ATOM 5960 C CG . ASP A 1 11 ? -1.867 -3.150 -12.913 1.00 0.00 ? 11 ASP A CG 15 ATOM 5961 O OD1 . ASP A 1 11 ? -2.307 -3.869 -13.888 1.00 0.00 ? 11 ASP A OD1 15 ATOM 5962 O OD2 . ASP A 1 11 ? -0.893 -3.455 -12.211 1.00 0.00 ? 11 ASP A OD2 15 ATOM 5963 N N . GLY A 1 12 ? -4.403 -2.994 -9.649 1.00 0.00 ? 12 GLY A N 15 ATOM 5964 C CA . GLY A 1 12 ? -4.124 -3.518 -8.324 1.00 0.00 ? 12 GLY A CA 15 ATOM 5965 C C . GLY A 1 12 ? -3.092 -2.651 -7.599 1.00 0.00 ? 12 GLY A C 15 ATOM 5966 O O . GLY A 1 12 ? -2.210 -3.170 -6.915 1.00 0.00 ? 12 GLY A O 15 ATOM 5967 N N . TYR A 1 13 ? -3.235 -1.347 -7.774 1.00 0.00 ? 13 TYR A N 15 ATOM 5968 C CA . TYR A 1 13 ? -2.326 -0.403 -7.145 1.00 0.00 ? 13 TYR A CA 15 ATOM 5969 C C . TYR A 1 13 ? -2.067 -0.780 -5.685 1.00 0.00 ? 13 TYR A C 15 ATOM 5970 O O . TYR A 1 13 ? -1.035 -0.421 -5.122 1.00 0.00 ? 13 TYR A O 15 ATOM 5971 C CB . TYR A 1 13 ? -3.031 0.954 -7.190 1.00 0.00 ? 13 TYR A CB 15 ATOM 5972 C CG . TYR A 1 13 ? -2.077 2.151 -7.157 1.00 0.00 ? 13 TYR A CG 15 ATOM 5973 C CD1 . TYR A 1 13 ? -1.273 2.423 -8.245 1.00 0.00 ? 13 TYR A CD1 15 ATOM 5974 C CD2 . TYR A 1 13 ? -2.022 2.959 -6.040 1.00 0.00 ? 13 TYR A CD2 15 ATOM 5975 C CE1 . TYR A 1 13 ? -0.375 3.549 -8.213 1.00 0.00 ? 13 TYR A CE1 15 ATOM 5976 C CE2 . TYR A 1 13 ? -1.126 4.085 -6.008 1.00 0.00 ? 13 TYR A CE2 15 ATOM 5977 C CZ . TYR A 1 13 ? -0.347 4.325 -7.098 1.00 0.00 ? 13 TYR A CZ 15 ATOM 5978 O OH . TYR A 1 13 ? 0.500 5.389 -7.067 1.00 0.00 ? 13 TYR A OH 15 ATOM 5979 N N . CYS A 1 14 ? -3.022 -1.502 -5.116 1.00 0.00 ? 14 CYS A N 15 ATOM 5980 C CA . CYS A 1 14 ? -2.910 -1.933 -3.733 1.00 0.00 ? 14 CYS A CA 15 ATOM 5981 C C . CYS A 1 14 ? -3.056 -3.456 -3.691 1.00 0.00 ? 14 CYS A C 15 ATOM 5982 O O . CYS A 1 14 ? -3.839 -4.028 -4.446 1.00 0.00 ? 14 CYS A O 15 ATOM 5983 C CB . CYS A 1 14 ? -3.937 -1.236 -2.838 1.00 0.00 ? 14 CYS A CB 15 ATOM 5984 S SG . CYS A 1 14 ? -4.661 0.289 -3.544 1.00 0.00 ? 14 CYS A SG 15 ATOM 5985 N N . LEU A 1 15 ? -2.289 -4.067 -2.800 1.00 0.00 ? 15 LEU A N 15 ATOM 5986 C CA . LEU A 1 15 ? -2.324 -5.512 -2.649 1.00 0.00 ? 15 LEU A CA 15 ATOM 5987 C C . LEU A 1 15 ? -1.705 -5.895 -1.304 1.00 0.00 ? 15 LEU A C 15 ATOM 5988 O O . LEU A 1 15 ? -1.164 -5.043 -0.600 1.00 0.00 ? 15 LEU A O 15 ATOM 5989 C CB . LEU A 1 15 ? -1.657 -6.191 -3.848 1.00 0.00 ? 15 LEU A CB 15 ATOM 5990 C CG . LEU A 1 15 ? -0.655 -5.341 -4.629 1.00 0.00 ? 15 LEU A CG 15 ATOM 5991 C CD1 . LEU A 1 15 ? 0.742 -5.429 -4.010 1.00 0.00 ? 15 LEU A CD1 15 ATOM 5992 C CD2 . LEU A 1 15 ? -0.649 -5.720 -6.112 1.00 0.00 ? 15 LEU A CD2 15 ATOM 5993 N N . ASN A 1 16 ? -1.804 -7.178 -0.985 1.00 0.00 ? 16 ASN A N 15 ATOM 5994 C CA . ASN A 1 16 ? -1.261 -7.685 0.263 1.00 0.00 ? 16 ASN A CA 15 ATOM 5995 C C . ASN A 1 16 ? -1.799 -6.846 1.425 1.00 0.00 ? 16 ASN A C 15 ATOM 5996 O O . ASN A 1 16 ? -1.040 -6.138 2.087 1.00 0.00 ? 16 ASN A O 15 ATOM 5997 C CB . ASN A 1 16 ? 0.265 -7.588 0.278 1.00 0.00 ? 16 ASN A CB 15 ATOM 5998 C CG . ASN A 1 16 ? 0.876 -8.396 -0.869 1.00 0.00 ? 16 ASN A CG 15 ATOM 5999 O OD1 . ASN A 1 16 ? 0.572 -9.558 -1.077 1.00 0.00 ? 16 ASN A OD1 15 ATOM 6000 N ND2 . ASN A 1 16 ? 1.755 -7.715 -1.601 1.00 0.00 ? 16 ASN A ND2 15 ATOM 6001 N N . GLY A 1 17 ? -3.103 -6.952 1.636 1.00 0.00 ? 17 GLY A N 15 ATOM 6002 C CA . GLY A 1 17 ? -3.750 -6.213 2.706 1.00 0.00 ? 17 GLY A CA 15 ATOM 6003 C C . GLY A 1 17 ? -3.473 -4.712 2.582 1.00 0.00 ? 17 GLY A C 15 ATOM 6004 O O . GLY A 1 17 ? -3.350 -4.016 3.587 1.00 0.00 ? 17 GLY A O 15 ATOM 6005 N N . GLY A 1 18 ? -3.384 -4.260 1.340 1.00 0.00 ? 18 GLY A N 15 ATOM 6006 C CA . GLY A 1 18 ? -3.124 -2.856 1.071 1.00 0.00 ? 18 GLY A CA 15 ATOM 6007 C C . GLY A 1 18 ? -4.408 -2.128 0.666 1.00 0.00 ? 18 GLY A C 15 ATOM 6008 O O . GLY A 1 18 ? -5.068 -2.516 -0.297 1.00 0.00 ? 18 GLY A O 15 ATOM 6009 N N . VAL A 1 19 ? -4.723 -1.088 1.424 1.00 0.00 ? 19 VAL A N 15 ATOM 6010 C CA . VAL A 1 19 ? -5.917 -0.303 1.155 1.00 0.00 ? 19 VAL A CA 15 ATOM 6011 C C . VAL A 1 19 ? -5.613 0.721 0.059 1.00 0.00 ? 19 VAL A C 15 ATOM 6012 O O . VAL A 1 19 ? -4.452 1.025 -0.207 1.00 0.00 ? 19 VAL A O 15 ATOM 6013 C CB . VAL A 1 19 ? -6.422 0.339 2.449 1.00 0.00 ? 19 VAL A CB 15 ATOM 6014 C CG1 . VAL A 1 19 ? -7.808 0.957 2.250 1.00 0.00 ? 19 VAL A CG1 15 ATOM 6015 C CG2 . VAL A 1 19 ? -6.432 -0.672 3.596 1.00 0.00 ? 19 VAL A CG2 15 ATOM 6016 N N . CYS A 1 20 ? -6.679 1.221 -0.548 1.00 0.00 ? 20 CYS A N 15 ATOM 6017 C CA . CYS A 1 20 ? -6.542 2.204 -1.610 1.00 0.00 ? 20 CYS A CA 15 ATOM 6018 C C . CYS A 1 20 ? -6.771 3.593 -1.012 1.00 0.00 ? 20 CYS A C 15 ATOM 6019 O O . CYS A 1 20 ? -7.719 3.798 -0.257 1.00 0.00 ? 20 CYS A O 15 ATOM 6020 C CB . CYS A 1 20 ? -7.496 1.918 -2.772 1.00 0.00 ? 20 CYS A CB 15 ATOM 6021 S SG . CYS A 1 20 ? -6.879 2.436 -4.417 1.00 0.00 ? 20 CYS A SG 15 ATOM 6022 N N . MET A 1 21 ? -5.886 4.511 -1.373 1.00 0.00 ? 21 MET A N 15 ATOM 6023 C CA . MET A 1 21 ? -5.981 5.875 -0.882 1.00 0.00 ? 21 MET A CA 15 ATOM 6024 C C . MET A 1 21 ? -5.318 6.854 -1.854 1.00 0.00 ? 21 MET A C 15 ATOM 6025 O O . MET A 1 21 ? -4.115 6.773 -2.099 1.00 0.00 ? 21 MET A O 15 ATOM 6026 C CB . MET A 1 21 ? -5.301 5.973 0.484 1.00 0.00 ? 21 MET A CB 15 ATOM 6027 C CG . MET A 1 21 ? -6.180 5.361 1.577 1.00 0.00 ? 21 MET A CG 15 ATOM 6028 S SD . MET A 1 21 ? -7.737 6.228 1.666 1.00 0.00 ? 21 MET A SD 15 ATOM 6029 C CE . MET A 1 21 ? -7.286 7.567 2.755 1.00 0.00 ? 21 MET A CE 15 ATOM 6030 N N . HIS A 1 22 ? -6.132 7.758 -2.382 1.00 0.00 ? 22 HIS A N 15 ATOM 6031 C CA . HIS A 1 22 ? -5.639 8.752 -3.320 1.00 0.00 ? 22 HIS A CA 15 ATOM 6032 C C . HIS A 1 22 ? -5.152 9.983 -2.555 1.00 0.00 ? 22 HIS A C 15 ATOM 6033 O O . HIS A 1 22 ? -5.852 10.493 -1.682 1.00 0.00 ? 22 HIS A O 15 ATOM 6034 C CB . HIS A 1 22 ? -6.706 9.088 -4.365 1.00 0.00 ? 22 HIS A CB 15 ATOM 6035 C CG . HIS A 1 22 ? -6.270 10.117 -5.378 1.00 0.00 ? 22 HIS A CG 15 ATOM 6036 N ND1 . HIS A 1 22 ? -7.004 11.258 -5.653 1.00 0.00 ? 22 HIS A ND1 15 ATOM 6037 C CD2 . HIS A 1 22 ? -5.166 10.167 -6.180 1.00 0.00 ? 22 HIS A CD2 15 ATOM 6038 C CE1 . HIS A 1 22 ? -6.363 11.955 -6.580 1.00 0.00 ? 22 HIS A CE1 15 ATOM 6039 N NE2 . HIS A 1 22 ? -5.226 11.277 -6.905 1.00 0.00 ? 22 HIS A NE2 15 ATOM 6040 N N . ILE A 1 23 ? -3.953 10.424 -2.908 1.00 0.00 ? 23 ILE A N 15 ATOM 6041 C CA . ILE A 1 23 ? -3.364 11.587 -2.266 1.00 0.00 ? 23 ILE A CA 15 ATOM 6042 C C . ILE A 1 23 ? -3.949 12.858 -2.884 1.00 0.00 ? 23 ILE A C 15 ATOM 6043 O O . ILE A 1 23 ? -4.469 12.827 -3.998 1.00 0.00 ? 23 ILE A O 15 ATOM 6044 C CB . ILE A 1 23 ? -1.836 11.516 -2.332 1.00 0.00 ? 23 ILE A CB 15 ATOM 6045 C CG1 . ILE A 1 23 ? -1.364 10.085 -2.591 1.00 0.00 ? 23 ILE A CG1 15 ATOM 6046 C CG2 . ILE A 1 23 ? -1.206 12.109 -1.069 1.00 0.00 ? 23 ILE A CG2 15 ATOM 6047 C CD1 . ILE A 1 23 ? 0.098 9.906 -2.175 1.00 0.00 ? 23 ILE A CD1 15 ATOM 6048 N N . GLU A 1 24 ? -3.842 13.944 -2.135 1.00 0.00 ? 24 GLU A N 15 ATOM 6049 C CA . GLU A 1 24 ? -4.355 15.224 -2.595 1.00 0.00 ? 24 GLU A CA 15 ATOM 6050 C C . GLU A 1 24 ? -3.220 16.245 -2.693 1.00 0.00 ? 24 GLU A C 15 ATOM 6051 O O . GLU A 1 24 ? -3.213 17.084 -3.591 1.00 0.00 ? 24 GLU A O 15 ATOM 6052 C CB . GLU A 1 24 ? -5.471 15.729 -1.678 1.00 0.00 ? 24 GLU A CB 15 ATOM 6053 C CG . GLU A 1 24 ? -6.753 14.917 -1.876 1.00 0.00 ? 24 GLU A CG 15 ATOM 6054 C CD . GLU A 1 24 ? -7.933 15.572 -1.155 1.00 0.00 ? 24 GLU A CD 15 ATOM 6055 O OE1 . GLU A 1 24 ? -7.994 15.344 0.112 1.00 0.00 ? 24 GLU A OE1 15 ATOM 6056 O OE2 . GLU A 1 24 ? -8.743 16.262 -1.795 1.00 0.00 ? 24 GLU A OE2 15 ATOM 6057 N N . SER A 1 25 ? -2.288 16.139 -1.755 1.00 0.00 ? 25 SER A N 15 ATOM 6058 C CA . SER A 1 25 ? -1.152 17.045 -1.723 1.00 0.00 ? 25 SER A CA 15 ATOM 6059 C C . SER A 1 25 ? -0.412 16.999 -3.062 1.00 0.00 ? 25 SER A C 15 ATOM 6060 O O . SER A 1 25 ? 0.076 18.023 -3.539 1.00 0.00 ? 25 SER A O 15 ATOM 6061 C CB . SER A 1 25 ? -0.200 16.692 -0.578 1.00 0.00 ? 25 SER A CB 15 ATOM 6062 O OG . SER A 1 25 ? -0.828 16.820 0.695 1.00 0.00 ? 25 SER A OG 15 ATOM 6063 N N . LEU A 1 26 ? -0.352 15.804 -3.631 1.00 0.00 ? 26 LEU A N 15 ATOM 6064 C CA . LEU A 1 26 ? 0.319 15.613 -4.904 1.00 0.00 ? 26 LEU A CA 15 ATOM 6065 C C . LEU A 1 26 ? -0.677 15.058 -5.924 1.00 0.00 ? 26 LEU A C 15 ATOM 6066 O O . LEU A 1 26 ? -0.282 14.556 -6.974 1.00 0.00 ? 26 LEU A O 15 ATOM 6067 C CB . LEU A 1 26 ? 1.565 14.745 -4.728 1.00 0.00 ? 26 LEU A CB 15 ATOM 6068 C CG . LEU A 1 26 ? 2.854 15.487 -4.359 1.00 0.00 ? 26 LEU A CG 15 ATOM 6069 C CD1 . LEU A 1 26 ? 3.706 15.754 -5.601 1.00 0.00 ? 26 LEU A CD1 15 ATOM 6070 C CD2 . LEU A 1 26 ? 2.544 16.772 -3.589 1.00 0.00 ? 26 LEU A CD2 15 ATOM 6071 N N . ASP A 1 27 ? -1.952 15.167 -5.578 1.00 0.00 ? 27 ASP A N 15 ATOM 6072 C CA . ASP A 1 27 ? -3.007 14.682 -6.450 1.00 0.00 ? 27 ASP A CA 15 ATOM 6073 C C . ASP A 1 27 ? -2.621 13.305 -6.996 1.00 0.00 ? 27 ASP A C 15 ATOM 6074 O O . ASP A 1 27 ? -3.094 12.899 -8.056 1.00 0.00 ? 27 ASP A O 15 ATOM 6075 C CB . ASP A 1 27 ? -3.215 15.621 -7.639 1.00 0.00 ? 27 ASP A CB 15 ATOM 6076 C CG . ASP A 1 27 ? -4.643 16.145 -7.807 1.00 0.00 ? 27 ASP A CG 15 ATOM 6077 O OD1 . ASP A 1 27 ? -5.058 17.096 -7.127 1.00 0.00 ? 27 ASP A OD1 15 ATOM 6078 O OD2 . ASP A 1 27 ? -5.349 15.527 -8.693 1.00 0.00 ? 27 ASP A OD2 15 ATOM 6079 N N . SER A 1 28 ? -1.763 12.627 -6.247 1.00 0.00 ? 28 SER A N 15 ATOM 6080 C CA . SER A 1 28 ? -1.307 11.306 -6.643 1.00 0.00 ? 28 SER A CA 15 ATOM 6081 C C . SER A 1 28 ? -2.123 10.232 -5.921 1.00 0.00 ? 28 SER A C 15 ATOM 6082 O O . SER A 1 28 ? -2.943 10.546 -5.060 1.00 0.00 ? 28 SER A O 15 ATOM 6083 C CB . SER A 1 28 ? 0.184 11.126 -6.349 1.00 0.00 ? 28 SER A CB 15 ATOM 6084 O OG . SER A 1 28 ? 0.617 11.953 -5.272 1.00 0.00 ? 28 SER A OG 15 ATOM 6085 N N . TYR A 1 29 ? -1.873 8.989 -6.302 1.00 0.00 ? 29 TYR A N 15 ATOM 6086 C CA . TYR A 1 29 ? -2.576 7.865 -5.701 1.00 0.00 ? 29 TYR A CA 15 ATOM 6087 C C . TYR A 1 29 ? -1.626 7.015 -4.855 1.00 0.00 ? 29 TYR A C 15 ATOM 6088 O O . TYR A 1 29 ? -0.468 6.818 -5.222 1.00 0.00 ? 29 TYR A O 15 ATOM 6089 C CB . TYR A 1 29 ? -3.095 7.022 -6.867 1.00 0.00 ? 29 TYR A CB 15 ATOM 6090 C CG . TYR A 1 29 ? -4.368 7.573 -7.513 1.00 0.00 ? 29 TYR A CG 15 ATOM 6091 C CD1 . TYR A 1 29 ? -5.591 7.382 -6.904 1.00 0.00 ? 29 TYR A CD1 15 ATOM 6092 C CD2 . TYR A 1 29 ? -4.292 8.262 -8.707 1.00 0.00 ? 29 TYR A CD2 15 ATOM 6093 C CE1 . TYR A 1 29 ? -6.788 7.900 -7.513 1.00 0.00 ? 29 TYR A CE1 15 ATOM 6094 C CE2 . TYR A 1 29 ? -5.489 8.778 -9.317 1.00 0.00 ? 29 TYR A CE2 15 ATOM 6095 C CZ . TYR A 1 29 ? -6.678 8.572 -8.689 1.00 0.00 ? 29 TYR A CZ 15 ATOM 6096 O OH . TYR A 1 29 ? -7.809 9.063 -9.265 1.00 0.00 ? 29 TYR A OH 15 ATOM 6097 N N . THR A 1 30 ? -2.150 6.535 -3.737 1.00 0.00 ? 30 THR A N 15 ATOM 6098 C CA . THR A 1 30 ? -1.365 5.708 -2.835 1.00 0.00 ? 30 THR A CA 15 ATOM 6099 C C . THR A 1 30 ? -2.142 4.447 -2.454 1.00 0.00 ? 30 THR A C 15 ATOM 6100 O O . THR A 1 30 ? -3.203 4.173 -3.014 1.00 0.00 ? 30 THR A O 15 ATOM 6101 C CB . THR A 1 30 ? -0.970 6.568 -1.633 1.00 0.00 ? 30 THR A CB 15 ATOM 6102 O OG1 . THR A 1 30 ? 0.327 6.096 -1.282 1.00 0.00 ? 30 THR A OG1 15 ATOM 6103 C CG2 . THR A 1 30 ? -1.821 6.270 -0.396 1.00 0.00 ? 30 THR A CG2 15 ATOM 6104 N N . CYS A 1 31 ? -1.585 3.713 -1.501 1.00 0.00 ? 31 CYS A N 15 ATOM 6105 C CA . CYS A 1 31 ? -2.213 2.487 -1.037 1.00 0.00 ? 31 CYS A CA 15 ATOM 6106 C C . CYS A 1 31 ? -1.599 2.116 0.314 1.00 0.00 ? 31 CYS A C 15 ATOM 6107 O O . CYS A 1 31 ? -0.396 1.878 0.408 1.00 0.00 ? 31 CYS A O 15 ATOM 6108 C CB . CYS A 1 31 ? -2.072 1.357 -2.060 1.00 0.00 ? 31 CYS A CB 15 ATOM 6109 S SG . CYS A 1 31 ? -3.457 1.218 -3.247 1.00 0.00 ? 31 CYS A SG 15 ATOM 6110 N N . ASN A 1 32 ? -2.455 2.076 1.324 1.00 0.00 ? 32 ASN A N 15 ATOM 6111 C CA . ASN A 1 32 ? -2.013 1.735 2.666 1.00 0.00 ? 32 ASN A CA 15 ATOM 6112 C C . ASN A 1 32 ? -1.743 0.231 2.744 1.00 0.00 ? 32 ASN A C 15 ATOM 6113 O O . ASN A 1 32 ? -2.655 -0.554 3.005 1.00 0.00 ? 32 ASN A O 15 ATOM 6114 C CB . ASN A 1 32 ? -3.083 2.078 3.704 1.00 0.00 ? 32 ASN A CB 15 ATOM 6115 C CG . ASN A 1 32 ? -2.561 1.862 5.123 1.00 0.00 ? 32 ASN A CG 15 ATOM 6116 O OD1 . ASN A 1 32 ? -1.367 1.807 5.373 1.00 0.00 ? 32 ASN A OD1 15 ATOM 6117 N ND2 . ASN A 1 32 ? -3.518 1.742 6.039 1.00 0.00 ? 32 ASN A ND2 15 ATOM 6118 N N . CYS A 1 33 ? -0.488 -0.125 2.515 1.00 0.00 ? 33 CYS A N 15 ATOM 6119 C CA . CYS A 1 33 ? -0.088 -1.523 2.557 1.00 0.00 ? 33 CYS A CA 15 ATOM 6120 C C . CYS A 1 33 ? -0.218 -2.016 3.998 1.00 0.00 ? 33 CYS A C 15 ATOM 6121 O O . CYS A 1 33 ? -1.092 -1.566 4.737 1.00 0.00 ? 33 CYS A O 15 ATOM 6122 C CB . CYS A 1 33 ? 1.327 -1.721 2.008 1.00 0.00 ? 33 CYS A CB 15 ATOM 6123 S SG . CYS A 1 33 ? 1.693 -0.796 0.474 1.00 0.00 ? 33 CYS A SG 15 ATOM 6124 N N . VAL A 1 34 ? 0.667 -2.936 4.356 1.00 0.00 ? 34 VAL A N 15 ATOM 6125 C CA . VAL A 1 34 ? 0.665 -3.496 5.697 1.00 0.00 ? 34 VAL A CA 15 ATOM 6126 C C . VAL A 1 34 ? 2.085 -3.924 6.070 1.00 0.00 ? 34 VAL A C 15 ATOM 6127 O O . VAL A 1 34 ? 3.052 -3.494 5.444 1.00 0.00 ? 34 VAL A O 15 ATOM 6128 C CB . VAL A 1 34 ? -0.349 -4.639 5.784 1.00 0.00 ? 34 VAL A CB 15 ATOM 6129 C CG1 . VAL A 1 34 ? 0.334 -5.992 5.583 1.00 0.00 ? 34 VAL A CG1 15 ATOM 6130 C CG2 . VAL A 1 34 ? -1.109 -4.600 7.112 1.00 0.00 ? 34 VAL A CG2 15 ATOM 6131 N N . ILE A 1 35 ? 2.166 -4.770 7.088 1.00 0.00 ? 35 ILE A N 15 ATOM 6132 C CA . ILE A 1 35 ? 3.451 -5.263 7.550 1.00 0.00 ? 35 ILE A CA 15 ATOM 6133 C C . ILE A 1 35 ? 4.172 -5.959 6.395 1.00 0.00 ? 35 ILE A C 15 ATOM 6134 O O . ILE A 1 35 ? 3.532 -6.451 5.466 1.00 0.00 ? 35 ILE A O 15 ATOM 6135 C CB . ILE A 1 35 ? 3.272 -6.148 8.786 1.00 0.00 ? 35 ILE A CB 15 ATOM 6136 C CG1 . ILE A 1 35 ? 2.423 -5.444 9.846 1.00 0.00 ? 35 ILE A CG1 15 ATOM 6137 C CG2 . ILE A 1 35 ? 4.627 -6.595 9.341 1.00 0.00 ? 35 ILE A CG2 15 ATOM 6138 C CD1 . ILE A 1 35 ? 3.303 -4.851 10.950 1.00 0.00 ? 35 ILE A CD1 15 ATOM 6139 N N . GLY A 1 36 ? 5.492 -5.979 6.489 1.00 0.00 ? 36 GLY A N 15 ATOM 6140 C CA . GLY A 1 36 ? 6.307 -6.605 5.463 1.00 0.00 ? 36 GLY A CA 15 ATOM 6141 C C . GLY A 1 36 ? 5.723 -6.357 4.071 1.00 0.00 ? 36 GLY A C 15 ATOM 6142 O O . GLY A 1 36 ? 5.883 -7.180 3.170 1.00 0.00 ? 36 GLY A O 15 ATOM 6143 N N . TYR A 1 37 ? 5.056 -5.221 3.939 1.00 0.00 ? 37 TYR A N 15 ATOM 6144 C CA . TYR A 1 37 ? 4.447 -4.854 2.671 1.00 0.00 ? 37 TYR A CA 15 ATOM 6145 C C . TYR A 1 37 ? 4.371 -3.333 2.519 1.00 0.00 ? 37 TYR A C 15 ATOM 6146 O O . TYR A 1 37 ? 3.690 -2.662 3.292 1.00 0.00 ? 37 TYR A O 15 ATOM 6147 C CB . TYR A 1 37 ? 3.027 -5.422 2.707 1.00 0.00 ? 37 TYR A CB 15 ATOM 6148 C CG . TYR A 1 37 ? 2.921 -6.862 2.200 1.00 0.00 ? 37 TYR A CG 15 ATOM 6149 C CD1 . TYR A 1 37 ? 3.446 -7.202 0.968 1.00 0.00 ? 37 TYR A CD1 15 ATOM 6150 C CD2 . TYR A 1 37 ? 2.300 -7.822 2.972 1.00 0.00 ? 37 TYR A CD2 15 ATOM 6151 C CE1 . TYR A 1 37 ? 3.346 -8.557 0.492 1.00 0.00 ? 37 TYR A CE1 15 ATOM 6152 C CE2 . TYR A 1 37 ? 2.199 -9.176 2.496 1.00 0.00 ? 37 TYR A CE2 15 ATOM 6153 C CZ . TYR A 1 37 ? 2.728 -9.478 1.280 1.00 0.00 ? 37 TYR A CZ 15 ATOM 6154 O OH . TYR A 1 37 ? 2.635 -10.757 0.828 1.00 0.00 ? 37 TYR A OH 15 ATOM 6155 N N . SER A 1 38 ? 5.080 -2.834 1.519 1.00 0.00 ? 38 SER A N 15 ATOM 6156 C CA . SER A 1 38 ? 5.103 -1.405 1.257 1.00 0.00 ? 38 SER A CA 15 ATOM 6157 C C . SER A 1 38 ? 5.586 -1.143 -0.171 1.00 0.00 ? 38 SER A C 15 ATOM 6158 O O . SER A 1 38 ? 5.690 -2.068 -0.977 1.00 0.00 ? 38 SER A O 15 ATOM 6159 C CB . SER A 1 38 ? 5.995 -0.674 2.261 1.00 0.00 ? 38 SER A CB 15 ATOM 6160 O OG . SER A 1 38 ? 7.368 -1.016 2.105 1.00 0.00 ? 38 SER A OG 15 ATOM 6161 N N . GLY A 1 39 ? 5.868 0.123 -0.444 1.00 0.00 ? 39 GLY A N 15 ATOM 6162 C CA . GLY A 1 39 ? 6.340 0.518 -1.760 1.00 0.00 ? 39 GLY A CA 15 ATOM 6163 C C . GLY A 1 39 ? 5.224 1.196 -2.560 1.00 0.00 ? 39 GLY A C 15 ATOM 6164 O O . GLY A 1 39 ? 5.033 0.900 -3.739 1.00 0.00 ? 39 GLY A O 15 ATOM 6165 N N . ASP A 1 40 ? 4.516 2.091 -1.887 1.00 0.00 ? 40 ASP A N 15 ATOM 6166 C CA . ASP A 1 40 ? 3.426 2.813 -2.521 1.00 0.00 ? 40 ASP A CA 15 ATOM 6167 C C . ASP A 1 40 ? 2.675 1.869 -3.462 1.00 0.00 ? 40 ASP A C 15 ATOM 6168 O O . ASP A 1 40 ? 2.419 2.211 -4.615 1.00 0.00 ? 40 ASP A O 15 ATOM 6169 C CB . ASP A 1 40 ? 3.950 3.988 -3.347 1.00 0.00 ? 40 ASP A CB 15 ATOM 6170 C CG . ASP A 1 40 ? 4.430 5.189 -2.531 1.00 0.00 ? 40 ASP A CG 15 ATOM 6171 O OD1 . ASP A 1 40 ? 4.633 5.095 -1.312 1.00 0.00 ? 40 ASP A OD1 15 ATOM 6172 O OD2 . ASP A 1 40 ? 4.598 6.276 -3.207 1.00 0.00 ? 40 ASP A OD2 15 ATOM 6173 N N . ARG A 1 41 ? 2.345 0.699 -2.936 1.00 0.00 ? 41 ARG A N 15 ATOM 6174 C CA . ARG A 1 41 ? 1.628 -0.296 -3.716 1.00 0.00 ? 41 ARG A CA 15 ATOM 6175 C C . ARG A 1 41 ? 1.492 -1.596 -2.920 1.00 0.00 ? 41 ARG A C 15 ATOM 6176 O O . ARG A 1 41 ? 0.523 -2.334 -3.090 1.00 0.00 ? 41 ARG A O 15 ATOM 6177 C CB . ARG A 1 41 ? 2.348 -0.586 -5.034 1.00 0.00 ? 41 ARG A CB 15 ATOM 6178 C CG . ARG A 1 41 ? 1.690 -1.751 -5.775 1.00 0.00 ? 41 ARG A CG 15 ATOM 6179 C CD . ARG A 1 41 ? 2.454 -2.089 -7.057 1.00 0.00 ? 41 ARG A CD 15 ATOM 6180 N NE . ARG A 1 41 ? 1.849 -1.382 -8.206 1.00 0.00 ? 41 ARG A NE 15 ATOM 6181 C CZ . ARG A 1 41 ? 2.421 -0.334 -8.837 1.00 0.00 ? 41 ARG A CZ 15 ATOM 6182 N NH1 . ARG A 1 41 ? 3.231 -0.562 -9.854 1.00 0.00 ? 41 ARG A NH1 15 ATOM 6183 N NH2 . ARG A 1 41 ? 2.169 0.930 -8.434 1.00 0.00 ? 41 ARG A NH2 15 ATOM 6184 N N . CYS A 1 42 ? 2.478 -1.838 -2.069 1.00 0.00 ? 42 CYS A N 15 ATOM 6185 C CA . CYS A 1 42 ? 2.481 -3.035 -1.247 1.00 0.00 ? 42 CYS A CA 15 ATOM 6186 C C . CYS A 1 42 ? 3.062 -4.184 -2.074 1.00 0.00 ? 42 CYS A C 15 ATOM 6187 O O . CYS A 1 42 ? 2.837 -5.352 -1.762 1.00 0.00 ? 42 CYS A O 15 ATOM 6188 C CB . CYS A 1 42 ? 1.083 -3.362 -0.719 1.00 0.00 ? 42 CYS A CB 15 ATOM 6189 S SG . CYS A 1 42 ? 0.020 -1.906 -0.410 1.00 0.00 ? 42 CYS A SG 15 ATOM 6190 N N . GLN A 1 43 ? 3.795 -3.811 -3.111 1.00 0.00 ? 43 GLN A N 15 ATOM 6191 C CA . GLN A 1 43 ? 4.410 -4.797 -3.987 1.00 0.00 ? 43 GLN A CA 15 ATOM 6192 C C . GLN A 1 43 ? 5.740 -5.272 -3.398 1.00 0.00 ? 43 GLN A C 15 ATOM 6193 O O . GLN A 1 43 ? 6.219 -6.354 -3.732 1.00 0.00 ? 43 GLN A O 15 ATOM 6194 C CB . GLN A 1 43 ? 4.604 -4.233 -5.396 1.00 0.00 ? 43 GLN A CB 15 ATOM 6195 C CG . GLN A 1 43 ? 5.948 -4.673 -5.981 1.00 0.00 ? 43 GLN A CG 15 ATOM 6196 C CD . GLN A 1 43 ? 7.089 -3.804 -5.446 1.00 0.00 ? 43 GLN A CD 15 ATOM 6197 O OE1 . GLN A 1 43 ? 8.250 -3.996 -5.765 1.00 0.00 ? 43 GLN A OE1 15 ATOM 6198 N NE2 . GLN A 1 43 ? 6.694 -2.842 -4.618 1.00 0.00 ? 43 GLN A NE2 15 ATOM 6199 N N . THR A 1 44 ? 6.299 -4.439 -2.531 1.00 0.00 ? 44 THR A N 15 ATOM 6200 C CA . THR A 1 44 ? 7.564 -4.761 -1.894 1.00 0.00 ? 44 THR A CA 15 ATOM 6201 C C . THR A 1 44 ? 7.323 -5.461 -0.554 1.00 0.00 ? 44 THR A C 15 ATOM 6202 O O . THR A 1 44 ? 6.599 -4.948 0.296 1.00 0.00 ? 44 THR A O 15 ATOM 6203 C CB . THR A 1 44 ? 8.373 -3.468 -1.766 1.00 0.00 ? 44 THR A CB 15 ATOM 6204 O OG1 . THR A 1 44 ? 8.896 -3.256 -3.074 1.00 0.00 ? 44 THR A OG1 15 ATOM 6205 C CG2 . THR A 1 44 ? 9.614 -3.637 -0.889 1.00 0.00 ? 44 THR A CG2 15 ATOM 6206 N N . ARG A 1 45 ? 7.944 -6.622 -0.409 1.00 0.00 ? 45 ARG A N 15 ATOM 6207 C CA . ARG A 1 45 ? 7.809 -7.397 0.811 1.00 0.00 ? 45 ARG A CA 15 ATOM 6208 C C . ARG A 1 45 ? 8.969 -7.099 1.763 1.00 0.00 ? 45 ARG A C 15 ATOM 6209 O O . ARG A 1 45 ? 10.072 -7.610 1.580 1.00 0.00 ? 45 ARG A O 15 ATOM 6210 C CB . ARG A 1 45 ? 7.775 -8.896 0.512 1.00 0.00 ? 45 ARG A CB 15 ATOM 6211 C CG . ARG A 1 45 ? 6.355 -9.358 0.180 1.00 0.00 ? 45 ARG A CG 15 ATOM 6212 C CD . ARG A 1 45 ? 6.328 -10.848 -0.166 1.00 0.00 ? 45 ARG A CD 15 ATOM 6213 N NE . ARG A 1 45 ? 6.680 -11.042 -1.591 1.00 0.00 ? 45 ARG A NE 15 ATOM 6214 C CZ . ARG A 1 45 ? 6.320 -12.120 -2.318 1.00 0.00 ? 45 ARG A CZ 15 ATOM 6215 N NH1 . ARG A 1 45 ? 7.092 -13.227 -2.331 1.00 0.00 ? 45 ARG A NH1 15 ATOM 6216 N NH2 . ARG A 1 45 ? 5.200 -12.076 -3.017 1.00 0.00 ? 45 ARG A NH2 15 ATOM 6217 N N . ASP A 1 46 ? 8.680 -6.275 2.758 1.00 0.00 ? 46 ASP A N 15 ATOM 6218 C CA . ASP A 1 46 ? 9.687 -5.903 3.739 1.00 0.00 ? 46 ASP A CA 15 ATOM 6219 C C . ASP A 1 46 ? 10.112 -7.146 4.523 1.00 0.00 ? 46 ASP A C 15 ATOM 6220 O O . ASP A 1 46 ? 11.287 -7.306 4.850 1.00 0.00 ? 46 ASP A O 15 ATOM 6221 C CB . ASP A 1 46 ? 9.135 -4.881 4.736 1.00 0.00 ? 46 ASP A CB 15 ATOM 6222 C CG . ASP A 1 46 ? 9.891 -3.552 4.784 1.00 0.00 ? 46 ASP A CG 15 ATOM 6223 O OD1 . ASP A 1 46 ? 11.030 -3.594 5.388 1.00 0.00 ? 46 ASP A OD1 15 ATOM 6224 O OD2 . ASP A 1 46 ? 9.415 -2.528 4.271 1.00 0.00 ? 46 ASP A OD2 15 ATOM 6225 N N . LEU A 1 47 ? 9.132 -7.993 4.804 1.00 0.00 ? 47 LEU A N 15 ATOM 6226 C CA . LEU A 1 47 ? 9.390 -9.217 5.543 1.00 0.00 ? 47 LEU A CA 15 ATOM 6227 C C . LEU A 1 47 ? 10.426 -8.939 6.635 1.00 0.00 ? 47 LEU A C 15 ATOM 6228 O O . LEU A 1 47 ? 11.610 -9.224 6.458 1.00 0.00 ? 47 LEU A O 15 ATOM 6229 C CB . LEU A 1 47 ? 9.789 -10.346 4.590 1.00 0.00 ? 47 LEU A CB 15 ATOM 6230 C CG . LEU A 1 47 ? 9.134 -11.704 4.847 1.00 0.00 ? 47 LEU A CG 15 ATOM 6231 C CD1 . LEU A 1 47 ? 9.284 -12.116 6.313 1.00 0.00 ? 47 LEU A CD1 15 ATOM 6232 C CD2 . LEU A 1 47 ? 7.670 -11.701 4.400 1.00 0.00 ? 47 LEU A CD2 15 ATOM 6233 N N . ARG A 1 48 ? 9.943 -8.386 7.737 1.00 0.00 ? 48 ARG A N 15 ATOM 6234 C CA . ARG A 1 48 ? 10.812 -8.067 8.856 1.00 0.00 ? 48 ARG A CA 15 ATOM 6235 C C . ARG A 1 48 ? 9.982 -7.808 10.115 1.00 0.00 ? 48 ARG A C 15 ATOM 6236 O O . ARG A 1 48 ? 10.371 -7.007 10.965 1.00 0.00 ? 48 ARG A O 15 ATOM 6237 C CB . ARG A 1 48 ? 11.669 -6.836 8.555 1.00 0.00 ? 48 ARG A CB 15 ATOM 6238 C CG . ARG A 1 48 ? 12.991 -6.887 9.322 1.00 0.00 ? 48 ARG A CG 15 ATOM 6239 C CD . ARG A 1 48 ? 13.800 -5.607 9.106 1.00 0.00 ? 48 ARG A CD 15 ATOM 6240 N NE . ARG A 1 48 ? 14.395 -5.607 7.750 1.00 0.00 ? 48 ARG A NE 15 ATOM 6241 C CZ . ARG A 1 48 ? 15.115 -4.586 7.239 1.00 0.00 ? 48 ARG A CZ 15 ATOM 6242 N NH1 . ARG A 1 48 ? 14.500 -3.568 6.597 1.00 0.00 ? 48 ARG A NH1 15 ATOM 6243 N NH2 . ARG A 1 48 ? 16.428 -4.595 7.377 1.00 0.00 ? 48 ARG A NH2 15 ATOM 6244 N N . TRP A 1 49 ? 8.855 -8.497 10.195 1.00 0.00 ? 49 TRP A N 15 ATOM 6245 C CA . TRP A 1 49 ? 7.967 -8.353 11.336 1.00 0.00 ? 49 TRP A CA 15 ATOM 6246 C C . TRP A 1 49 ? 7.636 -9.751 11.860 1.00 0.00 ? 49 TRP A C 15 ATOM 6247 O O . TRP A 1 49 ? 6.772 -9.907 12.722 1.00 0.00 ? 49 TRP A O 15 ATOM 6248 C CB . TRP A 1 49 ? 6.724 -7.543 10.962 1.00 0.00 ? 49 TRP A CB 15 ATOM 6249 C CG . TRP A 1 49 ? 6.042 -6.866 12.152 1.00 0.00 ? 49 TRP A CG 15 ATOM 6250 C CD1 . TRP A 1 49 ? 6.245 -5.630 12.625 1.00 0.00 ? 49 TRP A CD1 15 ATOM 6251 C CD2 . TRP A 1 49 ? 5.030 -7.442 13.006 1.00 0.00 ? 49 TRP A CD2 15 ATOM 6252 N NE1 . TRP A 1 49 ? 5.442 -5.366 13.717 1.00 0.00 ? 49 TRP A NE1 15 ATOM 6253 C CE2 . TRP A 1 49 ? 4.679 -6.503 13.957 1.00 0.00 ? 49 TRP A CE2 15 ATOM 6254 C CE3 . TRP A 1 49 ? 4.430 -8.713 12.977 1.00 0.00 ? 49 TRP A CE3 15 ATOM 6255 C CZ2 . TRP A 1 49 ? 3.719 -6.738 14.947 1.00 0.00 ? 49 TRP A CZ2 15 ATOM 6256 C CZ3 . TRP A 1 49 ? 3.472 -8.930 13.975 1.00 0.00 ? 49 TRP A CZ3 15 ATOM 6257 C CH2 . TRP A 1 49 ? 3.108 -7.997 14.938 1.00 0.00 ? 49 TRP A CH2 15 ATOM 6258 N N . TRP A 1 50 ? 8.340 -10.732 11.318 1.00 0.00 ? 50 TRP A N 15 ATOM 6259 C CA . TRP A 1 50 ? 8.133 -12.113 11.720 1.00 0.00 ? 50 TRP A CA 15 ATOM 6260 C C . TRP A 1 50 ? 9.502 -12.793 11.806 1.00 0.00 ? 50 TRP A C 15 ATOM 6261 O O . TRP A 1 50 ? 9.823 -13.429 12.808 1.00 0.00 ? 50 TRP A O 15 ATOM 6262 C CB . TRP A 1 50 ? 7.173 -12.825 10.766 1.00 0.00 ? 50 TRP A CB 15 ATOM 6263 C CG . TRP A 1 50 ? 6.589 -11.915 9.681 1.00 0.00 ? 50 TRP A CG 15 ATOM 6264 C CD1 . TRP A 1 50 ? 7.245 -11.095 8.851 1.00 0.00 ? 50 TRP A CD1 15 ATOM 6265 C CD2 . TRP A 1 50 ? 5.192 -11.771 9.340 1.00 0.00 ? 50 TRP A CD2 15 ATOM 6266 N NE1 . TRP A 1 50 ? 6.380 -10.432 8.004 1.00 0.00 ? 50 TRP A NE1 15 ATOM 6267 C CE2 . TRP A 1 50 ? 5.092 -10.858 8.311 1.00 0.00 ? 50 TRP A CE2 15 ATOM 6268 C CE3 . TRP A 1 50 ? 4.056 -12.392 9.883 1.00 0.00 ? 50 TRP A CE3 15 ATOM 6269 C CZ2 . TRP A 1 50 ? 3.872 -10.483 7.737 1.00 0.00 ? 50 TRP A CZ2 15 ATOM 6270 C CZ3 . TRP A 1 50 ? 2.842 -12.006 9.298 1.00 0.00 ? 50 TRP A CZ3 15 ATOM 6271 C CH2 . TRP A 1 50 ? 2.724 -11.088 8.261 1.00 0.00 ? 50 TRP A CH2 15 ATOM 6272 N N . GLU A 1 51 ? 10.274 -12.634 10.740 1.00 0.00 ? 51 GLU A N 15 ATOM 6273 C CA . GLU A 1 51 ? 11.599 -13.224 10.681 1.00 0.00 ? 51 GLU A CA 15 ATOM 6274 C C . GLU A 1 51 ? 12.655 -12.200 11.102 1.00 0.00 ? 51 GLU A C 15 ATOM 6275 O O . GLU A 1 51 ? 12.544 -11.019 10.779 1.00 0.00 ? 51 GLU A O 15 ATOM 6276 C CB . GLU A 1 51 ? 11.896 -13.772 9.284 1.00 0.00 ? 51 GLU A CB 15 ATOM 6277 C CG . GLU A 1 51 ? 10.756 -14.668 8.794 1.00 0.00 ? 51 GLU A CG 15 ATOM 6278 C CD . GLU A 1 51 ? 11.201 -15.519 7.601 1.00 0.00 ? 51 GLU A CD 15 ATOM 6279 O OE1 . GLU A 1 51 ? 11.107 -15.068 6.451 1.00 0.00 ? 51 GLU A OE1 15 ATOM 6280 O OE2 . GLU A 1 51 ? 11.658 -16.685 7.906 1.00 0.00 ? 51 GLU A OE2 15 ATOM 6281 N N . LEU A 1 52 ? 13.656 -12.690 11.820 1.00 0.00 ? 52 LEU A N 15 ATOM 6282 C CA . LEU A 1 52 ? 14.729 -11.831 12.290 1.00 0.00 ? 52 LEU A CA 15 ATOM 6283 C C . LEU A 1 52 ? 16.069 -12.390 11.808 1.00 0.00 ? 52 LEU A C 15 ATOM 6284 O O . LEU A 1 52 ? 16.902 -12.801 12.616 1.00 0.00 ? 52 LEU A O 15 ATOM 6285 C CB . LEU A 1 52 ? 14.648 -11.652 13.807 1.00 0.00 ? 52 LEU A CB 15 ATOM 6286 C CG . LEU A 1 52 ? 14.744 -12.931 14.640 1.00 0.00 ? 52 LEU A CG 15 ATOM 6287 C CD1 . LEU A 1 52 ? 15.735 -12.762 15.792 1.00 0.00 ? 52 LEU A CD1 15 ATOM 6288 C CD2 . LEU A 1 52 ? 13.363 -13.371 15.131 1.00 0.00 ? 52 LEU A CD2 15 ATOM 6289 N N . ARG A 1 53 ? 16.238 -12.389 10.494 1.00 0.00 ? 53 ARG A N 15 ATOM 6290 C CA . ARG A 1 53 ? 17.464 -12.889 9.895 1.00 0.00 ? 53 ARG A CA 15 ATOM 6291 C C . ARG A 1 53 ? 18.652 -12.018 10.307 1.00 0.00 ? 53 ARG A C 15 ATOM 6292 O O . ARG A 1 53 ? 19.769 -12.511 10.449 1.00 0.00 ? 53 ARG A O 15 ATOM 6293 C CB . ARG A 1 53 ? 17.361 -12.913 8.369 1.00 0.00 ? 53 ARG A CB 15 ATOM 6294 C CG . ARG A 1 53 ? 17.477 -11.502 7.791 1.00 0.00 ? 53 ARG A CG 15 ATOM 6295 C CD . ARG A 1 53 ? 17.135 -11.490 6.299 1.00 0.00 ? 53 ARG A CD 15 ATOM 6296 N NE . ARG A 1 53 ? 17.275 -10.120 5.758 1.00 0.00 ? 53 ARG A NE 15 ATOM 6297 C CZ . ARG A 1 53 ? 16.245 -9.265 5.590 1.00 0.00 ? 53 ARG A CZ 15 ATOM 6298 N NH1 . ARG A 1 53 ? 15.517 -9.283 4.453 1.00 0.00 ? 53 ARG A NH1 15 ATOM 6299 N NH2 . ARG A 1 53 ? 15.958 -8.410 6.555 1.00 0.00 ? 53 ARG A NH2 15 ATOM 6300 O OXT . ARG A 1 53 ? 18.376 -10.770 10.484 1.00 0.00 ? 53 ARG A OXT 15 ATOM 6301 N N . ASN A 1 1 ? -3.204 16.669 1.252 1.00 0.00 ? 1 ASN A N 16 ATOM 6302 C CA . ASN A 1 1 ? -4.265 16.040 2.019 1.00 0.00 ? 1 ASN A CA 16 ATOM 6303 C C . ASN A 1 1 ? -4.609 14.687 1.390 1.00 0.00 ? 1 ASN A C 16 ATOM 6304 O O . ASN A 1 1 ? -4.959 14.617 0.214 1.00 0.00 ? 1 ASN A O 16 ATOM 6305 C CB . ASN A 1 1 ? -5.533 16.898 2.013 1.00 0.00 ? 1 ASN A CB 16 ATOM 6306 C CG . ASN A 1 1 ? -5.584 17.793 0.774 1.00 0.00 ? 1 ASN A CG 16 ATOM 6307 O OD1 . ASN A 1 1 ? -6.117 17.430 -0.264 1.00 0.00 ? 1 ASN A OD1 16 ATOM 6308 N ND2 . ASN A 1 1 ? -5.001 18.977 0.935 1.00 0.00 ? 1 ASN A ND2 16 ATOM 6309 N N . SER A 1 2 ? -4.496 13.648 2.203 1.00 0.00 ? 2 SER A N 16 ATOM 6310 C CA . SER A 1 2 ? -4.790 12.302 1.741 1.00 0.00 ? 2 SER A CA 16 ATOM 6311 C C . SER A 1 2 ? -6.302 12.107 1.627 1.00 0.00 ? 2 SER A C 16 ATOM 6312 O O . SER A 1 2 ? -7.043 12.389 2.569 1.00 0.00 ? 2 SER A O 16 ATOM 6313 C CB . SER A 1 2 ? -4.188 11.253 2.681 1.00 0.00 ? 2 SER A CB 16 ATOM 6314 O OG . SER A 1 2 ? -2.778 11.403 2.815 1.00 0.00 ? 2 SER A OG 16 ATOM 6315 N N . TYR A 1 3 ? -6.719 11.624 0.466 1.00 0.00 ? 3 TYR A N 16 ATOM 6316 C CA . TYR A 1 3 ? -8.131 11.388 0.216 1.00 0.00 ? 3 TYR A CA 16 ATOM 6317 C C . TYR A 1 3 ? -8.371 9.953 -0.254 1.00 0.00 ? 3 TYR A C 16 ATOM 6318 O O . TYR A 1 3 ? -7.600 9.419 -1.049 1.00 0.00 ? 3 TYR A O 16 ATOM 6319 C CB . TYR A 1 3 ? -8.529 12.353 -0.903 1.00 0.00 ? 3 TYR A CB 16 ATOM 6320 C CG . TYR A 1 3 ? -9.986 12.220 -1.350 1.00 0.00 ? 3 TYR A CG 16 ATOM 6321 C CD1 . TYR A 1 3 ? -10.970 12.958 -0.723 1.00 0.00 ? 3 TYR A CD1 16 ATOM 6322 C CD2 . TYR A 1 3 ? -10.317 11.363 -2.381 1.00 0.00 ? 3 TYR A CD2 16 ATOM 6323 C CE1 . TYR A 1 3 ? -12.341 12.833 -1.144 1.00 0.00 ? 3 TYR A CE1 16 ATOM 6324 C CE2 . TYR A 1 3 ? -11.689 11.239 -2.801 1.00 0.00 ? 3 TYR A CE2 16 ATOM 6325 C CZ . TYR A 1 3 ? -12.632 11.980 -2.162 1.00 0.00 ? 3 TYR A CZ 16 ATOM 6326 O OH . TYR A 1 3 ? -13.928 11.862 -2.559 1.00 0.00 ? 3 TYR A OH 16 ATOM 6327 N N . PRO A 1 4 ? -9.474 9.352 0.270 1.00 0.00 ? 4 PRO A N 16 ATOM 6328 C CA . PRO A 1 4 ? -9.825 7.988 -0.087 1.00 0.00 ? 4 PRO A CA 16 ATOM 6329 C C . PRO A 1 4 ? -10.421 7.927 -1.496 1.00 0.00 ? 4 PRO A C 16 ATOM 6330 O O . PRO A 1 4 ? -11.501 8.461 -1.742 1.00 0.00 ? 4 PRO A O 16 ATOM 6331 C CB . PRO A 1 4 ? -10.801 7.538 0.988 1.00 0.00 ? 4 PRO A CB 16 ATOM 6332 C CG . PRO A 1 4 ? -11.317 8.811 1.643 1.00 0.00 ? 4 PRO A CG 16 ATOM 6333 C CD . PRO A 1 4 ? -10.411 9.955 1.215 1.00 0.00 ? 4 PRO A CD 16 ATOM 6334 N N . GLY A 1 5 ? -9.688 7.273 -2.385 1.00 0.00 ? 5 GLY A N 16 ATOM 6335 C CA . GLY A 1 5 ? -10.129 7.135 -3.763 1.00 0.00 ? 5 GLY A CA 16 ATOM 6336 C C . GLY A 1 5 ? -9.238 6.154 -4.528 1.00 0.00 ? 5 GLY A C 16 ATOM 6337 O O . GLY A 1 5 ? -8.063 5.996 -4.204 1.00 0.00 ? 5 GLY A O 16 ATOM 6338 N N . CYS A 1 6 ? -9.834 5.523 -5.529 1.00 0.00 ? 6 CYS A N 16 ATOM 6339 C CA . CYS A 1 6 ? -9.108 4.561 -6.343 1.00 0.00 ? 6 CYS A CA 16 ATOM 6340 C C . CYS A 1 6 ? -10.024 4.110 -7.484 1.00 0.00 ? 6 CYS A C 16 ATOM 6341 O O . CYS A 1 6 ? -10.842 3.208 -7.309 1.00 0.00 ? 6 CYS A O 16 ATOM 6342 C CB . CYS A 1 6 ? -8.609 3.378 -5.511 1.00 0.00 ? 6 CYS A CB 16 ATOM 6343 S SG . CYS A 1 6 ? -6.903 3.554 -4.875 1.00 0.00 ? 6 CYS A SG 16 ATOM 6344 N N . PRO A 1 7 ? -9.852 4.777 -8.657 1.00 0.00 ? 7 PRO A N 16 ATOM 6345 C CA . PRO A 1 7 ? -10.653 4.454 -9.825 1.00 0.00 ? 7 PRO A CA 16 ATOM 6346 C C . PRO A 1 7 ? -10.190 3.144 -10.462 1.00 0.00 ? 7 PRO A C 16 ATOM 6347 O O . PRO A 1 7 ? -9.290 2.480 -9.946 1.00 0.00 ? 7 PRO A O 16 ATOM 6348 C CB . PRO A 1 7 ? -10.500 5.651 -10.749 1.00 0.00 ? 7 PRO A CB 16 ATOM 6349 C CG . PRO A 1 7 ? -9.258 6.387 -10.274 1.00 0.00 ? 7 PRO A CG 16 ATOM 6350 C CD . PRO A 1 7 ? -8.894 5.852 -8.899 1.00 0.00 ? 7 PRO A CD 16 ATOM 6351 N N . SER A 1 8 ? -10.825 2.807 -11.574 1.00 0.00 ? 8 SER A N 16 ATOM 6352 C CA . SER A 1 8 ? -10.488 1.587 -12.289 1.00 0.00 ? 8 SER A CA 16 ATOM 6353 C C . SER A 1 8 ? -9.338 1.849 -13.261 1.00 0.00 ? 8 SER A C 16 ATOM 6354 O O . SER A 1 8 ? -9.034 1.011 -14.110 1.00 0.00 ? 8 SER A O 16 ATOM 6355 C CB . SER A 1 8 ? -11.703 1.034 -13.038 1.00 0.00 ? 8 SER A CB 16 ATOM 6356 O OG . SER A 1 8 ? -12.816 0.826 -12.172 1.00 0.00 ? 8 SER A OG 16 ATOM 6357 N N . SER A 1 9 ? -8.730 3.016 -13.109 1.00 0.00 ? 9 SER A N 16 ATOM 6358 C CA . SER A 1 9 ? -7.620 3.400 -13.965 1.00 0.00 ? 9 SER A CA 16 ATOM 6359 C C . SER A 1 9 ? -6.409 2.510 -13.680 1.00 0.00 ? 9 SER A C 16 ATOM 6360 O O . SER A 1 9 ? -5.814 1.952 -14.601 1.00 0.00 ? 9 SER A O 16 ATOM 6361 C CB . SER A 1 9 ? -7.255 4.872 -13.765 1.00 0.00 ? 9 SER A CB 16 ATOM 6362 O OG . SER A 1 9 ? -6.238 5.298 -14.671 1.00 0.00 ? 9 SER A OG 16 ATOM 6363 N N . TYR A 1 10 ? -6.079 2.404 -12.401 1.00 0.00 ? 10 TYR A N 16 ATOM 6364 C CA . TYR A 1 10 ? -4.948 1.592 -11.983 1.00 0.00 ? 10 TYR A CA 16 ATOM 6365 C C . TYR A 1 10 ? -5.378 0.144 -11.731 1.00 0.00 ? 10 TYR A C 16 ATOM 6366 O O . TYR A 1 10 ? -4.917 -0.771 -12.413 1.00 0.00 ? 10 TYR A O 16 ATOM 6367 C CB . TYR A 1 10 ? -4.455 2.201 -10.670 1.00 0.00 ? 10 TYR A CB 16 ATOM 6368 C CG . TYR A 1 10 ? -4.443 3.730 -10.657 1.00 0.00 ? 10 TYR A CG 16 ATOM 6369 C CD1 . TYR A 1 10 ? -3.394 4.417 -11.237 1.00 0.00 ? 10 TYR A CD1 16 ATOM 6370 C CD2 . TYR A 1 10 ? -5.479 4.424 -10.068 1.00 0.00 ? 10 TYR A CD2 16 ATOM 6371 C CE1 . TYR A 1 10 ? -3.385 5.855 -11.226 1.00 0.00 ? 10 TYR A CE1 16 ATOM 6372 C CE2 . TYR A 1 10 ? -5.468 5.863 -10.056 1.00 0.00 ? 10 TYR A CE2 16 ATOM 6373 C CZ . TYR A 1 10 ? -4.422 6.508 -10.636 1.00 0.00 ? 10 TYR A CZ 16 ATOM 6374 O OH . TYR A 1 10 ? -4.411 7.868 -10.625 1.00 0.00 ? 10 TYR A OH 16 ATOM 6375 N N . ASP A 1 11 ? -6.255 -0.019 -10.752 1.00 0.00 ? 11 ASP A N 16 ATOM 6376 C CA . ASP A 1 11 ? -6.751 -1.338 -10.403 1.00 0.00 ? 11 ASP A CA 16 ATOM 6377 C C . ASP A 1 11 ? -5.565 -2.269 -10.136 1.00 0.00 ? 11 ASP A C 16 ATOM 6378 O O . ASP A 1 11 ? -5.270 -3.149 -10.944 1.00 0.00 ? 11 ASP A O 16 ATOM 6379 C CB . ASP A 1 11 ? -7.576 -1.936 -11.543 1.00 0.00 ? 11 ASP A CB 16 ATOM 6380 C CG . ASP A 1 11 ? -8.210 -3.295 -11.238 1.00 0.00 ? 11 ASP A CG 16 ATOM 6381 O OD1 . ASP A 1 11 ? -9.322 -3.244 -10.585 1.00 0.00 ? 11 ASP A OD1 16 ATOM 6382 O OD2 . ASP A 1 11 ? -7.670 -4.349 -11.606 1.00 0.00 ? 11 ASP A OD2 16 ATOM 6383 N N . GLY A 1 12 ? -4.919 -2.044 -9.002 1.00 0.00 ? 12 GLY A N 16 ATOM 6384 C CA . GLY A 1 12 ? -3.775 -2.852 -8.621 1.00 0.00 ? 12 GLY A CA 16 ATOM 6385 C C . GLY A 1 12 ? -2.634 -1.976 -8.097 1.00 0.00 ? 12 GLY A C 16 ATOM 6386 O O . GLY A 1 12 ? -1.468 -2.222 -8.398 1.00 0.00 ? 12 GLY A O 16 ATOM 6387 N N . TYR A 1 13 ? -3.013 -0.971 -7.321 1.00 0.00 ? 13 TYR A N 16 ATOM 6388 C CA . TYR A 1 13 ? -2.038 -0.055 -6.753 1.00 0.00 ? 13 TYR A CA 16 ATOM 6389 C C . TYR A 1 13 ? -1.743 -0.406 -5.294 1.00 0.00 ? 13 TYR A C 16 ATOM 6390 O O . TYR A 1 13 ? -0.970 0.283 -4.629 1.00 0.00 ? 13 TYR A O 16 ATOM 6391 C CB . TYR A 1 13 ? -2.678 1.334 -6.811 1.00 0.00 ? 13 TYR A CB 16 ATOM 6392 C CG . TYR A 1 13 ? -1.687 2.464 -7.099 1.00 0.00 ? 13 TYR A CG 16 ATOM 6393 C CD1 . TYR A 1 13 ? -1.195 2.642 -8.376 1.00 0.00 ? 13 TYR A CD1 16 ATOM 6394 C CD2 . TYR A 1 13 ? -1.285 3.304 -6.080 1.00 0.00 ? 13 TYR A CD2 16 ATOM 6395 C CE1 . TYR A 1 13 ? -0.263 3.705 -8.645 1.00 0.00 ? 13 TYR A CE1 16 ATOM 6396 C CE2 . TYR A 1 13 ? -0.353 4.368 -6.351 1.00 0.00 ? 13 TYR A CE2 16 ATOM 6397 C CZ . TYR A 1 13 ? 0.112 4.515 -7.620 1.00 0.00 ? 13 TYR A CZ 16 ATOM 6398 O OH . TYR A 1 13 ? 0.993 5.520 -7.876 1.00 0.00 ? 13 TYR A OH 16 ATOM 6399 N N . CYS A 1 14 ? -2.373 -1.479 -4.836 1.00 0.00 ? 14 CYS A N 16 ATOM 6400 C CA . CYS A 1 14 ? -2.186 -1.930 -3.468 1.00 0.00 ? 14 CYS A CA 16 ATOM 6401 C C . CYS A 1 14 ? -2.080 -3.456 -3.475 1.00 0.00 ? 14 CYS A C 16 ATOM 6402 O O . CYS A 1 14 ? -3.044 -4.148 -3.800 1.00 0.00 ? 14 CYS A O 16 ATOM 6403 C CB . CYS A 1 14 ? -3.310 -1.441 -2.553 1.00 0.00 ? 14 CYS A CB 16 ATOM 6404 S SG . CYS A 1 14 ? -4.245 0.000 -3.188 1.00 0.00 ? 14 CYS A SG 16 ATOM 6405 N N . LEU A 1 15 ? -0.899 -3.938 -3.116 1.00 0.00 ? 15 LEU A N 16 ATOM 6406 C CA . LEU A 1 15 ? -0.654 -5.369 -3.076 1.00 0.00 ? 15 LEU A CA 16 ATOM 6407 C C . LEU A 1 15 ? -0.495 -5.815 -1.621 1.00 0.00 ? 15 LEU A C 16 ATOM 6408 O O . LEU A 1 15 ? -0.597 -5.003 -0.705 1.00 0.00 ? 15 LEU A O 16 ATOM 6409 C CB . LEU A 1 15 ? 0.537 -5.732 -3.964 1.00 0.00 ? 15 LEU A CB 16 ATOM 6410 C CG . LEU A 1 15 ? 0.662 -4.950 -5.275 1.00 0.00 ? 15 LEU A CG 16 ATOM 6411 C CD1 . LEU A 1 15 ? 1.554 -3.721 -5.097 1.00 0.00 ? 15 LEU A CD1 16 ATOM 6412 C CD2 . LEU A 1 15 ? 1.149 -5.854 -6.409 1.00 0.00 ? 15 LEU A CD2 16 ATOM 6413 N N . ASN A 1 16 ? -0.249 -7.106 -1.457 1.00 0.00 ? 16 ASN A N 16 ATOM 6414 C CA . ASN A 1 16 ? -0.076 -7.671 -0.130 1.00 0.00 ? 16 ASN A CA 16 ATOM 6415 C C . ASN A 1 16 ? -1.151 -7.110 0.803 1.00 0.00 ? 16 ASN A C 16 ATOM 6416 O O . ASN A 1 16 ? -0.835 -6.444 1.790 1.00 0.00 ? 16 ASN A O 16 ATOM 6417 C CB . ASN A 1 16 ? 1.292 -7.305 0.450 1.00 0.00 ? 16 ASN A CB 16 ATOM 6418 C CG . ASN A 1 16 ? 2.422 -7.887 -0.401 1.00 0.00 ? 16 ASN A CG 16 ATOM 6419 O OD1 . ASN A 1 16 ? 2.531 -9.087 -0.597 1.00 0.00 ? 16 ASN A OD1 16 ATOM 6420 N ND2 . ASN A 1 16 ? 3.253 -6.975 -0.894 1.00 0.00 ? 16 ASN A ND2 16 ATOM 6421 N N . GLY A 1 17 ? -2.397 -7.397 0.460 1.00 0.00 ? 17 GLY A N 16 ATOM 6422 C CA . GLY A 1 17 ? -3.519 -6.929 1.255 1.00 0.00 ? 17 GLY A CA 16 ATOM 6423 C C . GLY A 1 17 ? -3.360 -5.450 1.610 1.00 0.00 ? 17 GLY A C 16 ATOM 6424 O O . GLY A 1 17 ? -3.638 -5.045 2.739 1.00 0.00 ? 17 GLY A O 16 ATOM 6425 N N . GLY A 1 18 ? -2.910 -4.682 0.629 1.00 0.00 ? 18 GLY A N 16 ATOM 6426 C CA . GLY A 1 18 ? -2.710 -3.256 0.825 1.00 0.00 ? 18 GLY A CA 16 ATOM 6427 C C . GLY A 1 18 ? -3.990 -2.477 0.529 1.00 0.00 ? 18 GLY A C 16 ATOM 6428 O O . GLY A 1 18 ? -4.728 -2.814 -0.396 1.00 0.00 ? 18 GLY A O 16 ATOM 6429 N N . VAL A 1 19 ? -4.218 -1.448 1.332 1.00 0.00 ? 19 VAL A N 16 ATOM 6430 C CA . VAL A 1 19 ? -5.400 -0.616 1.169 1.00 0.00 ? 19 VAL A CA 16 ATOM 6431 C C . VAL A 1 19 ? -5.159 0.385 0.036 1.00 0.00 ? 19 VAL A C 16 ATOM 6432 O O . VAL A 1 19 ? -4.037 0.519 -0.450 1.00 0.00 ? 19 VAL A O 16 ATOM 6433 C CB . VAL A 1 19 ? -5.756 0.055 2.495 1.00 0.00 ? 19 VAL A CB 16 ATOM 6434 C CG1 . VAL A 1 19 ? -5.568 1.572 2.411 1.00 0.00 ? 19 VAL A CG1 16 ATOM 6435 C CG2 . VAL A 1 19 ? -7.183 -0.296 2.923 1.00 0.00 ? 19 VAL A CG2 16 ATOM 6436 N N . CYS A 1 20 ? -6.231 1.062 -0.350 1.00 0.00 ? 20 CYS A N 16 ATOM 6437 C CA . CYS A 1 20 ? -6.150 2.046 -1.415 1.00 0.00 ? 20 CYS A CA 16 ATOM 6438 C C . CYS A 1 20 ? -6.418 3.429 -0.814 1.00 0.00 ? 20 CYS A C 16 ATOM 6439 O O . CYS A 1 20 ? -7.306 3.583 0.024 1.00 0.00 ? 20 CYS A O 16 ATOM 6440 C CB . CYS A 1 20 ? -7.115 1.725 -2.558 1.00 0.00 ? 20 CYS A CB 16 ATOM 6441 S SG . CYS A 1 20 ? -6.454 2.041 -4.234 1.00 0.00 ? 20 CYS A SG 16 ATOM 6442 N N . MET A 1 21 ? -5.634 4.396 -1.264 1.00 0.00 ? 21 MET A N 16 ATOM 6443 C CA . MET A 1 21 ? -5.776 5.760 -0.780 1.00 0.00 ? 21 MET A CA 16 ATOM 6444 C C . MET A 1 21 ? -5.258 6.764 -1.812 1.00 0.00 ? 21 MET A C 16 ATOM 6445 O O . MET A 1 21 ? -4.165 6.598 -2.351 1.00 0.00 ? 21 MET A O 16 ATOM 6446 C CB . MET A 1 21 ? -4.995 5.921 0.527 1.00 0.00 ? 21 MET A CB 16 ATOM 6447 C CG . MET A 1 21 ? -5.942 5.971 1.727 1.00 0.00 ? 21 MET A CG 16 ATOM 6448 S SD . MET A 1 21 ? -5.138 6.771 3.106 1.00 0.00 ? 21 MET A SD 16 ATOM 6449 C CE . MET A 1 21 ? -6.437 7.880 3.622 1.00 0.00 ? 21 MET A CE 16 ATOM 6450 N N . HIS A 1 22 ? -6.067 7.783 -2.055 1.00 0.00 ? 22 HIS A N 16 ATOM 6451 C CA . HIS A 1 22 ? -5.704 8.816 -3.012 1.00 0.00 ? 22 HIS A CA 16 ATOM 6452 C C . HIS A 1 22 ? -5.066 9.996 -2.278 1.00 0.00 ? 22 HIS A C 16 ATOM 6453 O O . HIS A 1 22 ? -5.360 10.238 -1.108 1.00 0.00 ? 22 HIS A O 16 ATOM 6454 C CB . HIS A 1 22 ? -6.915 9.226 -3.854 1.00 0.00 ? 22 HIS A CB 16 ATOM 6455 C CG . HIS A 1 22 ? -6.589 10.192 -4.967 1.00 0.00 ? 22 HIS A CG 16 ATOM 6456 N ND1 . HIS A 1 22 ? -7.373 11.295 -5.256 1.00 0.00 ? 22 HIS A ND1 16 ATOM 6457 C CD2 . HIS A 1 22 ? -5.558 10.208 -5.860 1.00 0.00 ? 22 HIS A CD2 16 ATOM 6458 C CE1 . HIS A 1 22 ? -6.829 11.940 -6.277 1.00 0.00 ? 22 HIS A CE1 16 ATOM 6459 N NE2 . HIS A 1 22 ? -5.705 11.264 -6.651 1.00 0.00 ? 22 HIS A NE2 16 ATOM 6460 N N . ILE A 1 23 ? -4.203 10.701 -2.994 1.00 0.00 ? 23 ILE A N 16 ATOM 6461 C CA . ILE A 1 23 ? -3.520 11.850 -2.426 1.00 0.00 ? 23 ILE A CA 16 ATOM 6462 C C . ILE A 1 23 ? -3.963 13.118 -3.161 1.00 0.00 ? 23 ILE A C 16 ATOM 6463 O O . ILE A 1 23 ? -4.618 13.038 -4.200 1.00 0.00 ? 23 ILE A O 16 ATOM 6464 C CB . ILE A 1 23 ? -2.006 11.632 -2.436 1.00 0.00 ? 23 ILE A CB 16 ATOM 6465 C CG1 . ILE A 1 23 ? -1.665 10.160 -2.670 1.00 0.00 ? 23 ILE A CG1 16 ATOM 6466 C CG2 . ILE A 1 23 ? -1.366 12.171 -1.154 1.00 0.00 ? 23 ILE A CG2 16 ATOM 6467 C CD1 . ILE A 1 23 ? -0.170 9.903 -2.468 1.00 0.00 ? 23 ILE A CD1 16 ATOM 6468 N N . GLU A 1 24 ? -3.589 14.254 -2.594 1.00 0.00 ? 24 GLU A N 16 ATOM 6469 C CA . GLU A 1 24 ? -3.939 15.535 -3.182 1.00 0.00 ? 24 GLU A CA 16 ATOM 6470 C C . GLU A 1 24 ? -2.677 16.352 -3.467 1.00 0.00 ? 24 GLU A C 16 ATOM 6471 O O . GLU A 1 24 ? -1.563 15.880 -3.240 1.00 0.00 ? 24 GLU A O 16 ATOM 6472 C CB . GLU A 1 24 ? -4.900 16.308 -2.278 1.00 0.00 ? 24 GLU A CB 16 ATOM 6473 C CG . GLU A 1 24 ? -6.331 15.787 -2.426 1.00 0.00 ? 24 GLU A CG 16 ATOM 6474 C CD . GLU A 1 24 ? -7.207 16.792 -3.178 1.00 0.00 ? 24 GLU A CD 16 ATOM 6475 O OE1 . GLU A 1 24 ? -7.271 16.755 -4.415 1.00 0.00 ? 24 GLU A OE1 16 ATOM 6476 O OE2 . GLU A 1 24 ? -7.836 17.635 -2.430 1.00 0.00 ? 24 GLU A OE2 16 ATOM 6477 N N . SER A 1 25 ? -2.894 17.564 -3.958 1.00 0.00 ? 25 SER A N 16 ATOM 6478 C CA . SER A 1 25 ? -1.787 18.450 -4.277 1.00 0.00 ? 25 SER A CA 16 ATOM 6479 C C . SER A 1 25 ? -1.317 18.208 -5.711 1.00 0.00 ? 25 SER A C 16 ATOM 6480 O O . SER A 1 25 ? -0.820 19.120 -6.368 1.00 0.00 ? 25 SER A O 16 ATOM 6481 C CB . SER A 1 25 ? -0.626 18.255 -3.299 1.00 0.00 ? 25 SER A CB 16 ATOM 6482 O OG . SER A 1 25 ? 0.204 19.412 -3.218 1.00 0.00 ? 25 SER A OG 16 ATOM 6483 N N . LEU A 1 26 ? -1.491 16.972 -6.157 1.00 0.00 ? 26 LEU A N 16 ATOM 6484 C CA . LEU A 1 26 ? -1.092 16.598 -7.502 1.00 0.00 ? 26 LEU A CA 16 ATOM 6485 C C . LEU A 1 26 ? -1.985 15.459 -7.997 1.00 0.00 ? 26 LEU A C 16 ATOM 6486 O O . LEU A 1 26 ? -1.641 14.763 -8.951 1.00 0.00 ? 26 LEU A O 16 ATOM 6487 C CB . LEU A 1 26 ? 0.402 16.270 -7.547 1.00 0.00 ? 26 LEU A CB 16 ATOM 6488 C CG . LEU A 1 26 ? 1.268 17.199 -8.399 1.00 0.00 ? 26 LEU A CG 16 ATOM 6489 C CD1 . LEU A 1 26 ? 2.735 17.130 -7.971 1.00 0.00 ? 26 LEU A CD1 16 ATOM 6490 C CD2 . LEU A 1 26 ? 1.091 16.899 -9.890 1.00 0.00 ? 26 LEU A CD2 16 ATOM 6491 N N . ASP A 1 27 ? -3.117 15.303 -7.326 1.00 0.00 ? 27 ASP A N 16 ATOM 6492 C CA . ASP A 1 27 ? -4.064 14.260 -7.685 1.00 0.00 ? 27 ASP A CA 16 ATOM 6493 C C . ASP A 1 27 ? -3.328 12.922 -7.783 1.00 0.00 ? 27 ASP A C 16 ATOM 6494 O O . ASP A 1 27 ? -3.622 12.112 -8.661 1.00 0.00 ? 27 ASP A O 16 ATOM 6495 C CB . ASP A 1 27 ? -4.707 14.547 -9.043 1.00 0.00 ? 27 ASP A CB 16 ATOM 6496 C CG . ASP A 1 27 ? -5.824 15.592 -9.021 1.00 0.00 ? 27 ASP A CG 16 ATOM 6497 O OD1 . ASP A 1 27 ? -5.427 16.817 -9.089 1.00 0.00 ? 27 ASP A OD1 16 ATOM 6498 O OD2 . ASP A 1 27 ? -7.016 15.253 -8.944 1.00 0.00 ? 27 ASP A OD2 16 ATOM 6499 N N . SER A 1 28 ? -2.386 12.734 -6.871 1.00 0.00 ? 28 SER A N 16 ATOM 6500 C CA . SER A 1 28 ? -1.606 11.507 -6.845 1.00 0.00 ? 28 SER A CA 16 ATOM 6501 C C . SER A 1 28 ? -2.349 10.433 -6.050 1.00 0.00 ? 28 SER A C 16 ATOM 6502 O O . SER A 1 28 ? -3.169 10.747 -5.187 1.00 0.00 ? 28 SER A O 16 ATOM 6503 C CB . SER A 1 28 ? -0.221 11.749 -6.242 1.00 0.00 ? 28 SER A CB 16 ATOM 6504 O OG . SER A 1 28 ? 0.342 10.555 -5.704 1.00 0.00 ? 28 SER A OG 16 ATOM 6505 N N . TYR A 1 29 ? -2.038 9.185 -6.369 1.00 0.00 ? 29 TYR A N 16 ATOM 6506 C CA . TYR A 1 29 ? -2.666 8.060 -5.695 1.00 0.00 ? 29 TYR A CA 16 ATOM 6507 C C . TYR A 1 29 ? -1.634 7.233 -4.928 1.00 0.00 ? 29 TYR A C 16 ATOM 6508 O O . TYR A 1 29 ? -0.471 7.163 -5.324 1.00 0.00 ? 29 TYR A O 16 ATOM 6509 C CB . TYR A 1 29 ? -3.277 7.196 -6.799 1.00 0.00 ? 29 TYR A CB 16 ATOM 6510 C CG . TYR A 1 29 ? -4.690 7.616 -7.210 1.00 0.00 ? 29 TYR A CG 16 ATOM 6511 C CD1 . TYR A 1 29 ? -5.785 7.073 -6.568 1.00 0.00 ? 29 TYR A CD1 16 ATOM 6512 C CD2 . TYR A 1 29 ? -4.869 8.537 -8.222 1.00 0.00 ? 29 TYR A CD2 16 ATOM 6513 C CE1 . TYR A 1 29 ? -7.115 7.471 -6.955 1.00 0.00 ? 29 TYR A CE1 16 ATOM 6514 C CE2 . TYR A 1 29 ? -6.197 8.934 -8.609 1.00 0.00 ? 29 TYR A CE2 16 ATOM 6515 C CZ . TYR A 1 29 ? -7.255 8.381 -7.956 1.00 0.00 ? 29 TYR A CZ 16 ATOM 6516 O OH . TYR A 1 29 ? -8.510 8.755 -8.323 1.00 0.00 ? 29 TYR A OH 16 ATOM 6517 N N . THR A 1 30 ? -2.094 6.627 -3.844 1.00 0.00 ? 30 THR A N 16 ATOM 6518 C CA . THR A 1 30 ? -1.224 5.807 -3.018 1.00 0.00 ? 30 THR A CA 16 ATOM 6519 C C . THR A 1 30 ? -1.960 4.548 -2.555 1.00 0.00 ? 30 THR A C 16 ATOM 6520 O O . THR A 1 30 ? -3.079 4.282 -2.991 1.00 0.00 ? 30 THR A O 16 ATOM 6521 C CB . THR A 1 30 ? -0.716 6.672 -1.864 1.00 0.00 ? 30 THR A CB 16 ATOM 6522 O OG1 . THR A 1 30 ? 0.126 5.797 -1.117 1.00 0.00 ? 30 THR A OG1 16 ATOM 6523 C CG2 . THR A 1 30 ? -1.826 7.047 -0.879 1.00 0.00 ? 30 THR A CG2 16 ATOM 6524 N N . CYS A 1 31 ? -1.301 3.805 -1.678 1.00 0.00 ? 31 CYS A N 16 ATOM 6525 C CA . CYS A 1 31 ? -1.879 2.579 -1.153 1.00 0.00 ? 31 CYS A CA 16 ATOM 6526 C C . CYS A 1 31 ? -1.182 2.250 0.170 1.00 0.00 ? 31 CYS A C 16 ATOM 6527 O O . CYS A 1 31 ? 0.017 2.479 0.318 1.00 0.00 ? 31 CYS A O 16 ATOM 6528 C CB . CYS A 1 31 ? -1.773 1.429 -2.154 1.00 0.00 ? 31 CYS A CB 16 ATOM 6529 S SG . CYS A 1 31 ? -3.206 1.259 -3.281 1.00 0.00 ? 31 CYS A SG 16 ATOM 6530 N N . ASN A 1 32 ? -1.964 1.716 1.098 1.00 0.00 ? 32 ASN A N 16 ATOM 6531 C CA . ASN A 1 32 ? -1.438 1.352 2.401 1.00 0.00 ? 32 ASN A CA 16 ATOM 6532 C C . ASN A 1 32 ? -1.046 -0.127 2.395 1.00 0.00 ? 32 ASN A C 16 ATOM 6533 O O . ASN A 1 32 ? -1.655 -0.931 1.691 1.00 0.00 ? 32 ASN A O 16 ATOM 6534 C CB . ASN A 1 32 ? -2.487 1.559 3.496 1.00 0.00 ? 32 ASN A CB 16 ATOM 6535 C CG . ASN A 1 32 ? -2.816 3.042 3.667 1.00 0.00 ? 32 ASN A CG 16 ATOM 6536 O OD1 . ASN A 1 32 ? -2.118 3.919 3.185 1.00 0.00 ? 32 ASN A OD1 16 ATOM 6537 N ND2 . ASN A 1 32 ? -3.913 3.274 4.382 1.00 0.00 ? 32 ASN A ND2 16 ATOM 6538 N N . CYS A 1 33 ? -0.030 -0.442 3.185 1.00 0.00 ? 33 CYS A N 16 ATOM 6539 C CA . CYS A 1 33 ? 0.448 -1.809 3.278 1.00 0.00 ? 33 CYS A CA 16 ATOM 6540 C C . CYS A 1 33 ? 0.296 -2.274 4.728 1.00 0.00 ? 33 CYS A C 16 ATOM 6541 O O . CYS A 1 33 ? -0.487 -1.704 5.487 1.00 0.00 ? 33 CYS A O 16 ATOM 6542 C CB . CYS A 1 33 ? 1.894 -1.936 2.788 1.00 0.00 ? 33 CYS A CB 16 ATOM 6543 S SG . CYS A 1 33 ? 2.241 -3.444 1.812 1.00 0.00 ? 33 CYS A SG 16 ATOM 6544 N N . VAL A 1 34 ? 1.055 -3.305 5.069 1.00 0.00 ? 34 VAL A N 16 ATOM 6545 C CA . VAL A 1 34 ? 1.014 -3.853 6.414 1.00 0.00 ? 34 VAL A CA 16 ATOM 6546 C C . VAL A 1 34 ? 2.386 -4.430 6.768 1.00 0.00 ? 34 VAL A C 16 ATOM 6547 O O . VAL A 1 34 ? 3.188 -4.723 5.883 1.00 0.00 ? 34 VAL A O 16 ATOM 6548 C CB . VAL A 1 34 ? -0.114 -4.881 6.525 1.00 0.00 ? 34 VAL A CB 16 ATOM 6549 C CG1 . VAL A 1 34 ? -1.322 -4.464 5.682 1.00 0.00 ? 34 VAL A CG1 16 ATOM 6550 C CG2 . VAL A 1 34 ? 0.374 -6.276 6.130 1.00 0.00 ? 34 VAL A CG2 16 ATOM 6551 N N . ILE A 1 35 ? 2.614 -4.576 8.065 1.00 0.00 ? 35 ILE A N 16 ATOM 6552 C CA . ILE A 1 35 ? 3.874 -5.113 8.548 1.00 0.00 ? 35 ILE A CA 16 ATOM 6553 C C . ILE A 1 35 ? 4.385 -6.168 7.563 1.00 0.00 ? 35 ILE A C 16 ATOM 6554 O O . ILE A 1 35 ? 3.607 -6.975 7.056 1.00 0.00 ? 35 ILE A O 16 ATOM 6555 C CB . ILE A 1 35 ? 3.725 -5.628 9.979 1.00 0.00 ? 35 ILE A CB 16 ATOM 6556 C CG1 . ILE A 1 35 ? 4.546 -4.786 10.957 1.00 0.00 ? 35 ILE A CG1 16 ATOM 6557 C CG2 . ILE A 1 35 ? 4.081 -7.114 10.066 1.00 0.00 ? 35 ILE A CG2 16 ATOM 6558 C CD1 . ILE A 1 35 ? 4.996 -5.617 12.157 1.00 0.00 ? 35 ILE A CD1 16 ATOM 6559 N N . GLY A 1 36 ? 5.687 -6.126 7.324 1.00 0.00 ? 36 GLY A N 16 ATOM 6560 C CA . GLY A 1 36 ? 6.309 -7.069 6.409 1.00 0.00 ? 36 GLY A CA 16 ATOM 6561 C C . GLY A 1 36 ? 6.237 -6.562 4.967 1.00 0.00 ? 36 GLY A C 16 ATOM 6562 O O . GLY A 1 36 ? 7.144 -6.808 4.173 1.00 0.00 ? 36 GLY A O 16 ATOM 6563 N N . TYR A 1 37 ? 5.150 -5.866 4.672 1.00 0.00 ? 37 TYR A N 16 ATOM 6564 C CA . TYR A 1 37 ? 4.947 -5.323 3.340 1.00 0.00 ? 37 TYR A CA 16 ATOM 6565 C C . TYR A 1 37 ? 4.749 -3.807 3.389 1.00 0.00 ? 37 TYR A C 16 ATOM 6566 O O . TYR A 1 37 ? 4.109 -3.290 4.303 1.00 0.00 ? 37 TYR A O 16 ATOM 6567 C CB . TYR A 1 37 ? 3.668 -5.975 2.809 1.00 0.00 ? 37 TYR A CB 16 ATOM 6568 C CG . TYR A 1 37 ? 3.683 -7.505 2.858 1.00 0.00 ? 37 TYR A CG 16 ATOM 6569 C CD1 . TYR A 1 37 ? 3.244 -8.163 3.989 1.00 0.00 ? 37 TYR A CD1 16 ATOM 6570 C CD2 . TYR A 1 37 ? 4.134 -8.224 1.772 1.00 0.00 ? 37 TYR A CD2 16 ATOM 6571 C CE1 . TYR A 1 37 ? 3.257 -9.601 4.035 1.00 0.00 ? 37 TYR A CE1 16 ATOM 6572 C CE2 . TYR A 1 37 ? 4.149 -9.665 1.818 1.00 0.00 ? 37 TYR A CE2 16 ATOM 6573 C CZ . TYR A 1 37 ? 3.709 -10.281 2.948 1.00 0.00 ? 37 TYR A CZ 16 ATOM 6574 O OH . TYR A 1 37 ? 3.721 -11.640 2.991 1.00 0.00 ? 37 TYR A OH 16 ATOM 6575 N N . SER A 1 38 ? 5.310 -3.136 2.394 1.00 0.00 ? 38 SER A N 16 ATOM 6576 C CA . SER A 1 38 ? 5.203 -1.688 2.312 1.00 0.00 ? 38 SER A CA 16 ATOM 6577 C C . SER A 1 38 ? 5.454 -1.227 0.875 1.00 0.00 ? 38 SER A C 16 ATOM 6578 O O . SER A 1 38 ? 5.675 -2.045 -0.015 1.00 0.00 ? 38 SER A O 16 ATOM 6579 C CB . SER A 1 38 ? 6.187 -1.010 3.268 1.00 0.00 ? 38 SER A CB 16 ATOM 6580 O OG . SER A 1 38 ? 7.534 -1.131 2.822 1.00 0.00 ? 38 SER A OG 16 ATOM 6581 N N . GLY A 1 39 ? 5.410 0.085 0.694 1.00 0.00 ? 39 GLY A N 16 ATOM 6582 C CA . GLY A 1 39 ? 5.631 0.666 -0.619 1.00 0.00 ? 39 GLY A CA 16 ATOM 6583 C C . GLY A 1 39 ? 4.362 1.347 -1.136 1.00 0.00 ? 39 GLY A C 16 ATOM 6584 O O . GLY A 1 39 ? 3.262 1.047 -0.678 1.00 0.00 ? 39 GLY A O 16 ATOM 6585 N N . ASP A 1 40 ? 4.559 2.254 -2.084 1.00 0.00 ? 40 ASP A N 16 ATOM 6586 C CA . ASP A 1 40 ? 3.444 2.980 -2.667 1.00 0.00 ? 40 ASP A CA 16 ATOM 6587 C C . ASP A 1 40 ? 2.236 2.048 -2.779 1.00 0.00 ? 40 ASP A C 16 ATOM 6588 O O . ASP A 1 40 ? 1.094 2.488 -2.656 1.00 0.00 ? 40 ASP A O 16 ATOM 6589 C CB . ASP A 1 40 ? 3.787 3.480 -4.072 1.00 0.00 ? 40 ASP A CB 16 ATOM 6590 C CG . ASP A 1 40 ? 2.696 4.311 -4.748 1.00 0.00 ? 40 ASP A CG 16 ATOM 6591 O OD1 . ASP A 1 40 ? 2.530 5.493 -4.261 1.00 0.00 ? 40 ASP A OD1 16 ATOM 6592 O OD2 . ASP A 1 40 ? 2.036 3.851 -5.693 1.00 0.00 ? 40 ASP A OD2 16 ATOM 6593 N N . ARG A 1 41 ? 2.529 0.776 -3.008 1.00 0.00 ? 41 ARG A N 16 ATOM 6594 C CA . ARG A 1 41 ? 1.481 -0.222 -3.138 1.00 0.00 ? 41 ARG A CA 16 ATOM 6595 C C . ARG A 1 41 ? 1.681 -1.337 -2.110 1.00 0.00 ? 41 ARG A C 16 ATOM 6596 O O . ARG A 1 41 ? 0.744 -1.715 -1.409 1.00 0.00 ? 41 ARG A O 16 ATOM 6597 C CB . ARG A 1 41 ? 1.467 -0.828 -4.542 1.00 0.00 ? 41 ARG A CB 16 ATOM 6598 C CG . ARG A 1 41 ? 1.605 0.260 -5.611 1.00 0.00 ? 41 ARG A CG 16 ATOM 6599 C CD . ARG A 1 41 ? 1.356 -0.309 -7.008 1.00 0.00 ? 41 ARG A CD 16 ATOM 6600 N NE . ARG A 1 41 ? 2.613 -0.862 -7.561 1.00 0.00 ? 41 ARG A NE 16 ATOM 6601 C CZ . ARG A 1 41 ? 3.428 -0.192 -8.403 1.00 0.00 ? 41 ARG A CZ 16 ATOM 6602 N NH1 . ARG A 1 41 ? 3.212 -0.228 -9.737 1.00 0.00 ? 41 ARG A NH1 16 ATOM 6603 N NH2 . ARG A 1 41 ? 4.438 0.496 -7.906 1.00 0.00 ? 41 ARG A NH2 16 ATOM 6604 N N . CYS A 1 42 ? 2.907 -1.833 -2.054 1.00 0.00 ? 42 CYS A N 16 ATOM 6605 C CA . CYS A 1 42 ? 3.243 -2.899 -1.125 1.00 0.00 ? 42 CYS A CA 16 ATOM 6606 C C . CYS A 1 42 ? 4.420 -3.688 -1.703 1.00 0.00 ? 42 CYS A C 16 ATOM 6607 O O . CYS A 1 42 ? 4.467 -4.912 -1.588 1.00 0.00 ? 42 CYS A O 16 ATOM 6608 C CB . CYS A 1 42 ? 2.039 -3.798 -0.837 1.00 0.00 ? 42 CYS A CB 16 ATOM 6609 S SG . CYS A 1 42 ? 1.143 -3.408 0.711 1.00 0.00 ? 42 CYS A SG 16 ATOM 6610 N N . GLN A 1 43 ? 5.341 -2.955 -2.310 1.00 0.00 ? 43 GLN A N 16 ATOM 6611 C CA . GLN A 1 43 ? 6.515 -3.572 -2.905 1.00 0.00 ? 43 GLN A CA 16 ATOM 6612 C C . GLN A 1 43 ? 7.227 -4.456 -1.880 1.00 0.00 ? 43 GLN A C 16 ATOM 6613 O O . GLN A 1 43 ? 7.449 -5.641 -2.126 1.00 0.00 ? 43 GLN A O 16 ATOM 6614 C CB . GLN A 1 43 ? 7.464 -2.513 -3.468 1.00 0.00 ? 43 GLN A CB 16 ATOM 6615 C CG . GLN A 1 43 ? 8.837 -2.596 -2.800 1.00 0.00 ? 43 GLN A CG 16 ATOM 6616 C CD . GLN A 1 43 ? 9.852 -1.701 -3.517 1.00 0.00 ? 43 GLN A CD 16 ATOM 6617 O OE1 . GLN A 1 43 ? 10.209 -1.920 -4.664 1.00 0.00 ? 43 GLN A OE1 16 ATOM 6618 N NE2 . GLN A 1 43 ? 10.293 -0.686 -2.780 1.00 0.00 ? 43 GLN A NE2 16 ATOM 6619 N N . THR A 1 44 ? 7.566 -3.848 -0.754 1.00 0.00 ? 44 THR A N 16 ATOM 6620 C CA . THR A 1 44 ? 8.250 -4.565 0.308 1.00 0.00 ? 44 THR A CA 16 ATOM 6621 C C . THR A 1 44 ? 7.431 -5.784 0.740 1.00 0.00 ? 44 THR A C 16 ATOM 6622 O O . THR A 1 44 ? 6.208 -5.709 0.845 1.00 0.00 ? 44 THR A O 16 ATOM 6623 C CB . THR A 1 44 ? 8.518 -3.580 1.447 1.00 0.00 ? 44 THR A CB 16 ATOM 6624 O OG1 . THR A 1 44 ? 8.744 -2.338 0.785 1.00 0.00 ? 44 THR A OG1 16 ATOM 6625 C CG2 . THR A 1 44 ? 9.838 -3.864 2.167 1.00 0.00 ? 44 THR A CG2 16 ATOM 6626 N N . ARG A 1 45 ? 8.139 -6.878 0.979 1.00 0.00 ? 45 ARG A N 16 ATOM 6627 C CA . ARG A 1 45 ? 7.493 -8.111 1.397 1.00 0.00 ? 45 ARG A CA 16 ATOM 6628 C C . ARG A 1 45 ? 8.029 -8.554 2.759 1.00 0.00 ? 45 ARG A C 16 ATOM 6629 O O . ARG A 1 45 ? 9.196 -8.326 3.076 1.00 0.00 ? 45 ARG A O 16 ATOM 6630 C CB . ARG A 1 45 ? 7.726 -9.227 0.376 1.00 0.00 ? 45 ARG A CB 16 ATOM 6631 C CG . ARG A 1 45 ? 6.615 -9.248 -0.677 1.00 0.00 ? 45 ARG A CG 16 ATOM 6632 C CD . ARG A 1 45 ? 6.668 -10.533 -1.503 1.00 0.00 ? 45 ARG A CD 16 ATOM 6633 N NE . ARG A 1 45 ? 5.572 -10.542 -2.497 1.00 0.00 ? 45 ARG A NE 16 ATOM 6634 C CZ . ARG A 1 45 ? 4.967 -11.661 -2.949 1.00 0.00 ? 45 ARG A CZ 16 ATOM 6635 N NH1 . ARG A 1 45 ? 3.913 -12.183 -2.287 1.00 0.00 ? 45 ARG A NH1 16 ATOM 6636 N NH2 . ARG A 1 45 ? 5.421 -12.237 -4.046 1.00 0.00 ? 45 ARG A NH2 16 ATOM 6637 N N . ASP A 1 46 ? 7.151 -9.180 3.529 1.00 0.00 ? 46 ASP A N 16 ATOM 6638 C CA . ASP A 1 46 ? 7.520 -9.658 4.851 1.00 0.00 ? 46 ASP A CA 16 ATOM 6639 C C . ASP A 1 46 ? 8.989 -10.084 4.840 1.00 0.00 ? 46 ASP A C 16 ATOM 6640 O O . ASP A 1 46 ? 9.692 -9.927 5.838 1.00 0.00 ? 46 ASP A O 16 ATOM 6641 C CB . ASP A 1 46 ? 6.678 -10.870 5.253 1.00 0.00 ? 46 ASP A CB 16 ATOM 6642 C CG . ASP A 1 46 ? 5.912 -10.716 6.568 1.00 0.00 ? 46 ASP A CG 16 ATOM 6643 O OD1 . ASP A 1 46 ? 6.509 -10.561 7.642 1.00 0.00 ? 46 ASP A OD1 16 ATOM 6644 O OD2 . ASP A 1 46 ? 4.626 -10.762 6.458 1.00 0.00 ? 46 ASP A OD2 16 ATOM 6645 N N . LEU A 1 47 ? 9.409 -10.618 3.703 1.00 0.00 ? 47 LEU A N 16 ATOM 6646 C CA . LEU A 1 47 ? 10.783 -11.069 3.550 1.00 0.00 ? 47 LEU A CA 16 ATOM 6647 C C . LEU A 1 47 ? 11.722 -9.862 3.614 1.00 0.00 ? 47 LEU A C 16 ATOM 6648 O O . LEU A 1 47 ? 12.445 -9.585 2.659 1.00 0.00 ? 47 LEU A O 16 ATOM 6649 C CB . LEU A 1 47 ? 10.935 -11.901 2.275 1.00 0.00 ? 47 LEU A CB 16 ATOM 6650 C CG . LEU A 1 47 ? 10.598 -13.389 2.401 1.00 0.00 ? 47 LEU A CG 16 ATOM 6651 C CD1 . LEU A 1 47 ? 11.619 -14.109 3.284 1.00 0.00 ? 47 LEU A CD1 16 ATOM 6652 C CD2 . LEU A 1 47 ? 9.167 -13.586 2.903 1.00 0.00 ? 47 LEU A CD2 16 ATOM 6653 N N . ARG A 1 48 ? 11.679 -9.178 4.747 1.00 0.00 ? 48 ARG A N 16 ATOM 6654 C CA . ARG A 1 48 ? 12.517 -8.009 4.946 1.00 0.00 ? 48 ARG A CA 16 ATOM 6655 C C . ARG A 1 48 ? 12.019 -7.197 6.144 1.00 0.00 ? 48 ARG A C 16 ATOM 6656 O O . ARG A 1 48 ? 11.294 -6.216 5.976 1.00 0.00 ? 48 ARG A O 16 ATOM 6657 C CB . ARG A 1 48 ? 12.523 -7.116 3.703 1.00 0.00 ? 48 ARG A CB 16 ATOM 6658 C CG . ARG A 1 48 ? 13.857 -7.221 2.962 1.00 0.00 ? 48 ARG A CG 16 ATOM 6659 C CD . ARG A 1 48 ? 13.764 -6.584 1.573 1.00 0.00 ? 48 ARG A CD 16 ATOM 6660 N NE . ARG A 1 48 ? 15.083 -6.640 0.902 1.00 0.00 ? 48 ARG A NE 16 ATOM 6661 C CZ . ARG A 1 48 ? 15.964 -5.617 0.879 1.00 0.00 ? 48 ARG A CZ 16 ATOM 6662 N NH1 . ARG A 1 48 ? 15.892 -4.672 -0.083 1.00 0.00 ? 48 ARG A NH1 16 ATOM 6663 N NH2 . ARG A 1 48 ? 16.896 -5.556 1.812 1.00 0.00 ? 48 ARG A NH2 16 ATOM 6664 N N . TRP A 1 49 ? 12.425 -7.635 7.326 1.00 0.00 ? 49 TRP A N 16 ATOM 6665 C CA . TRP A 1 49 ? 12.029 -6.961 8.552 1.00 0.00 ? 49 TRP A CA 16 ATOM 6666 C C . TRP A 1 49 ? 12.433 -5.491 8.434 1.00 0.00 ? 49 TRP A C 16 ATOM 6667 O O . TRP A 1 49 ? 12.807 -5.031 7.357 1.00 0.00 ? 49 TRP A O 16 ATOM 6668 C CB . TRP A 1 49 ? 12.632 -7.654 9.775 1.00 0.00 ? 49 TRP A CB 16 ATOM 6669 C CG . TRP A 1 49 ? 11.849 -7.419 11.070 1.00 0.00 ? 49 TRP A CG 16 ATOM 6670 C CD1 . TRP A 1 49 ? 10.545 -7.149 11.208 1.00 0.00 ? 49 TRP A CD1 16 ATOM 6671 C CD2 . TRP A 1 49 ? 12.379 -7.447 12.411 1.00 0.00 ? 49 TRP A CD2 16 ATOM 6672 N NE1 . TRP A 1 49 ? 10.195 -7.001 12.534 1.00 0.00 ? 49 TRP A NE1 16 ATOM 6673 C CE2 . TRP A 1 49 ? 11.347 -7.189 13.290 1.00 0.00 ? 49 TRP A CE2 16 ATOM 6674 C CE3 . TRP A 1 49 ? 13.689 -7.684 12.868 1.00 0.00 ? 49 TRP A CE3 16 ATOM 6675 C CZ2 . TRP A 1 49 ? 11.516 -7.141 14.679 1.00 0.00 ? 49 TRP A CZ2 16 ATOM 6676 C CZ3 . TRP A 1 49 ? 13.840 -7.633 14.260 1.00 0.00 ? 49 TRP A CZ3 16 ATOM 6677 C CH2 . TRP A 1 49 ? 12.811 -7.373 15.157 1.00 0.00 ? 49 TRP A CH2 16 ATOM 6678 N N . TRP A 1 50 ? 12.348 -4.795 9.559 1.00 0.00 ? 50 TRP A N 16 ATOM 6679 C CA . TRP A 1 50 ? 12.699 -3.386 9.596 1.00 0.00 ? 50 TRP A CA 16 ATOM 6680 C C . TRP A 1 50 ? 13.019 -3.018 11.046 1.00 0.00 ? 50 TRP A C 16 ATOM 6681 O O . TRP A 1 50 ? 14.163 -2.709 11.374 1.00 0.00 ? 50 TRP A O 16 ATOM 6682 C CB . TRP A 1 50 ? 11.588 -2.527 8.992 1.00 0.00 ? 50 TRP A CB 16 ATOM 6683 C CG . TRP A 1 50 ? 10.442 -3.333 8.380 1.00 0.00 ? 50 TRP A CG 16 ATOM 6684 C CD1 . TRP A 1 50 ? 9.889 -4.462 8.841 1.00 0.00 ? 50 TRP A CD1 16 ATOM 6685 C CD2 . TRP A 1 50 ? 9.723 -3.022 7.167 1.00 0.00 ? 50 TRP A CD2 16 ATOM 6686 N NE1 . TRP A 1 50 ? 8.871 -4.903 8.017 1.00 0.00 ? 50 TRP A NE1 16 ATOM 6687 C CE2 . TRP A 1 50 ? 8.768 -3.998 6.967 1.00 0.00 ? 50 TRP A CE2 16 ATOM 6688 C CE3 . TRP A 1 50 ? 9.876 -1.953 6.267 1.00 0.00 ? 50 TRP A CE3 16 ATOM 6689 C CZ2 . TRP A 1 50 ? 7.892 -4.001 5.874 1.00 0.00 ? 50 TRP A CZ2 16 ATOM 6690 C CZ3 . TRP A 1 50 ? 8.993 -1.971 5.180 1.00 0.00 ? 50 TRP A CZ3 16 ATOM 6691 C CH2 . TRP A 1 50 ? 8.025 -2.946 4.966 1.00 0.00 ? 50 TRP A CH2 16 ATOM 6692 N N . GLU A 1 51 ? 11.987 -3.062 11.876 1.00 0.00 ? 51 GLU A N 16 ATOM 6693 C CA . GLU A 1 51 ? 12.143 -2.734 13.282 1.00 0.00 ? 51 GLU A CA 16 ATOM 6694 C C . GLU A 1 51 ? 11.055 -3.422 14.112 1.00 0.00 ? 51 GLU A C 16 ATOM 6695 O O . GLU A 1 51 ? 11.179 -4.597 14.453 1.00 0.00 ? 51 GLU A O 16 ATOM 6696 C CB . GLU A 1 51 ? 12.122 -1.220 13.500 1.00 0.00 ? 51 GLU A CB 16 ATOM 6697 C CG . GLU A 1 51 ? 11.160 -0.539 12.527 1.00 0.00 ? 51 GLU A CG 16 ATOM 6698 C CD . GLU A 1 51 ? 11.914 0.375 11.559 1.00 0.00 ? 51 GLU A CD 16 ATOM 6699 O OE1 . GLU A 1 51 ? 12.397 1.448 12.087 1.00 0.00 ? 51 GLU A OE1 16 ATOM 6700 O OE2 . GLU A 1 51 ? 12.021 0.060 10.364 1.00 0.00 ? 51 GLU A OE2 16 ATOM 6701 N N . LEU A 1 52 ? 10.012 -2.660 14.409 1.00 0.00 ? 52 LEU A N 16 ATOM 6702 C CA . LEU A 1 52 ? 8.905 -3.181 15.190 1.00 0.00 ? 52 LEU A CA 16 ATOM 6703 C C . LEU A 1 52 ? 7.638 -2.386 14.863 1.00 0.00 ? 52 LEU A C 16 ATOM 6704 O O . LEU A 1 52 ? 7.708 -1.334 14.229 1.00 0.00 ? 52 LEU A O 16 ATOM 6705 C CB . LEU A 1 52 ? 9.256 -3.190 16.680 1.00 0.00 ? 52 LEU A CB 16 ATOM 6706 C CG . LEU A 1 52 ? 8.856 -1.944 17.471 1.00 0.00 ? 52 LEU A CG 16 ATOM 6707 C CD1 . LEU A 1 52 ? 9.400 -0.676 16.811 1.00 0.00 ? 52 LEU A CD1 16 ATOM 6708 C CD2 . LEU A 1 52 ? 7.339 -1.881 17.666 1.00 0.00 ? 52 LEU A CD2 16 ATOM 6709 N N . ARG A 1 53 ? 6.512 -2.920 15.309 1.00 0.00 ? 53 ARG A N 16 ATOM 6710 C CA . ARG A 1 53 ? 5.230 -2.274 15.072 1.00 0.00 ? 53 ARG A CA 16 ATOM 6711 C C . ARG A 1 53 ? 4.266 -2.570 16.221 1.00 0.00 ? 53 ARG A C 16 ATOM 6712 O O . ARG A 1 53 ? 4.549 -2.243 17.374 1.00 0.00 ? 53 ARG A O 16 ATOM 6713 C CB . ARG A 1 53 ? 4.609 -2.750 13.758 1.00 0.00 ? 53 ARG A CB 16 ATOM 6714 C CG . ARG A 1 53 ? 3.662 -1.695 13.185 1.00 0.00 ? 53 ARG A CG 16 ATOM 6715 C CD . ARG A 1 53 ? 4.370 -0.834 12.137 1.00 0.00 ? 53 ARG A CD 16 ATOM 6716 N NE . ARG A 1 53 ? 3.481 0.269 11.705 1.00 0.00 ? 53 ARG A NE 16 ATOM 6717 C CZ . ARG A 1 53 ? 3.499 1.510 12.237 1.00 0.00 ? 53 ARG A CZ 16 ATOM 6718 N NH1 . ARG A 1 53 ? 3.750 1.686 13.551 1.00 0.00 ? 53 ARG A NH1 16 ATOM 6719 N NH2 . ARG A 1 53 ? 3.268 2.545 11.453 1.00 0.00 ? 53 ARG A NH2 16 ATOM 6720 O OXT . ARG A 1 53 ? 3.176 -3.168 15.878 1.00 0.00 ? 53 ARG A OXT 16 #