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6296 lines
444 KiB
Plaintext
6296 lines
444 KiB
Plaintext
data_4BDF
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#
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_entry.id 4BDF
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#
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_audit_conform.dict_name mmcif_pdbx.dic
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_audit_conform.dict_version 5.279
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_audit_conform.dict_location http://mmcif.pdb.org/dictionaries/ascii/mmcif_pdbx.dic
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#
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loop_
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_database_2.database_id
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_database_2.database_code
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PDB 4BDF
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PDBE EBI-54368
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WWPDB D_1290054368
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#
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loop_
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_pdbx_database_related.db_name
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_pdbx_database_related.db_id
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_pdbx_database_related.content_type
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_pdbx_database_related.details
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PDB 1GXC unspecified 'FHA DOMAIN FROM HUMAN CHK2 KINASE IN COMPLEX WITH A SYNTHETIC PHOSPHOPEPTIDE'
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PDB 2CN5 unspecified 'CRYSTAL STRUCTURE OF HUMAN CHK2 IN COMPLEX WITH ADP'
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PDB 2CN8 unspecified 'CRYSTAL STRUCTURE OF HUMAN CHK2 IN COMPLEX WITH DEBROMOHYMENIALDISINE'
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PDB 2W0J unspecified 'CRYSTAL STRUCTURE OF CHK2 IN COMPLEX WITH NSC 109555 , A SPECIFIC INHIBITOR'
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PDB 2W7X unspecified
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'CELLULAR INHIBITION OF CHECKPOINT KINASE 2 AND POTENTIATION OF CYTOTOXIC DRUGS BY NOVEL CHK2 INHIBITOR PV1019'
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PDB 2WTC unspecified 'CRYSTAL STRUCTURE OF CHK2 IN COMPLEX WITH AN INHIBITOR'
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PDB 2WTD unspecified 'CRYSTAL STRUCTURE OF CHK2 IN COMPLEX WITH AN INHIBITOR'
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PDB 2WTI unspecified 'CRYSTAL STRUCTURE OF CHK2 IN COMPLEX WITH AN INHIBITOR'
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PDB 2WTJ unspecified 'CRYSTAL STRUCTURE OF CHK2 IN COMPLEX WITH AN INHIBITOR'
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PDB 2XBJ unspecified 'CRYSTAL STRUCTURE OF CHK2 IN COMPLEX WITH AN INHIBITOR'
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PDB 2XK9 unspecified 'STRUCTURAL ANALYSIS OF CHECKPOINT KINASE 2 (CHK2) IN COMPLEX WITH INHIBITOR PV1533'
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PDB 2XM8 unspecified 'CO-CRYSTAL STRUCTURE OF A SMALL MOLECULE INHIBITOR BOUND TO THE KINASE DOMAIN OF CHK2'
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PDB 2XM9 unspecified 'STRUCTURE OF A SMALL MOLECULE INHIBITOR WITH THE KINASE DOMAIN OF CHK2'
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PDB 2YCF unspecified 'CRYSTAL STRUCTURE OF CHECKPOINT KINASE 2 IN COMPLEX WITH INHIBITOR PV1531'
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PDB 2YCQ unspecified 'CRYSTAL STRUCTURE OF CHECKPOINT KINASE 2 IN COMPLEX WITH INHIBITOR PV1115'
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PDB 2YCR unspecified 'CRYSTAL STRUCTURE OF CHECKPOINT KINASE 2 IN COMPLEX WITH INHIBITOR PV976'
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PDB 2YCS unspecified 'CRYSTAL STRUCTURE OF CHECKPOINT KINASE 2 IN COMPLEX WITH PV788'
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PDB 2YIQ unspecified 'STRUCTURAL ANALYSIS OF CHECKPOINT KINASE 2 IN COMPLEX WITH INHIBITOR PV1322'
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PDB 2YIR unspecified 'STRUCTURAL ANALYSIS OF CHECKPOINT KINASE 2 IN COMPLEX WITH INHIBITOR PV1352'
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PDB 2YIT unspecified 'STRUCTURAL ANALYSIS OF CHECKPOINT KINASE 2 IN COMPLEX WITH PV1162, A NOVEL INHIBITOR'
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PDB 4A9R unspecified 'CRYSTAL STRUCTURE OF HUMAN CHK2 IN COMPLEX WITH BENZIMIDAZOLE CARBOXAMIDE INHIBITOR'
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PDB 4A9S unspecified 'CRYSTAL STRUCTURE OF HUMAN CHK2 IN COMPLEX WITH BENZIMIDAZOLE CARBOXAMIDE INHIBITOR'
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PDB 4A9T unspecified 'CRYSTAL STRUCTURE OF HUMAN CHK2 IN COMPLEX WITH BENZIMIDAZOLE CARBOXAMIDE INHIBITOR'
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PDB 4A9U unspecified 'CRYSTAL STRUCTURE OF HUMAN CHK2 IN COMPLEX WITH BENZIMIDAZOLE CARBOXAMIDE INHIBITOR'
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PDB 4BDA unspecified 'FRAGMENT-BASED SCREENING IDENTIFIES A NEW AREA FOR INHIBITOR BINDING TO CHECKPOINT KINASE 2 (CHK2)'
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PDB 4BDB unspecified 'FRAGMENT-BASED SCREENING IDENTIFIES A NEW AREA FOR INHIBITOR BINDING TO CHECKPOINT KINASE 2 (CHK2)'
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PDB 4BDC unspecified 'FRAGMENT-BASED SCREENING IDENTIFIES A NEW AREA FOR INHIBITOR BINDING TO CHECKPOINT KINASE 2 (CHK2)'
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PDB 4BDD unspecified 'FRAGMENT-BASED SCREENING IDENTIFIES A NEW AREA FOR INHIBITOR BINDING TO CHECKPOINT KINASE 2 (CHK2)'
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PDB 4BDE unspecified 'FRAGMENT-BASED SCREENING IDENTIFIES A NEW AREA FOR INHIBITOR BINDING TO CHECKPOINT KINASE 2 (CHK2)'
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PDB 4BDG unspecified 'FRAGMENT-BASED SCREENING IDENTIFIES A NEW AREA FOR INHIBITOR BINDING TO CHECKPOINT KINASE 2 (CHK2)'
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PDB 4BDH unspecified 'FRAGMENT-BASED SCREENING IDENTIFIES A NEW AREA FOR INHIBITOR BINDING TO CHECKPOINT KINASE 2 (CHK2)'
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PDB 4BDI unspecified 'FRAGMENT-BASED SCREENING IDENTIFIES A NEW AREA FOR INHIBITOR BINDING TO CHECKPOINT KINASE 2 (CHK2)'
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PDB 4BDJ unspecified 'FRAGMENT-BASED SCREENING IDENTIFIES A NEW AREA FOR INHIBITOR BINDING TO CHECKPOINT KINASE 2 (CHK2)'
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PDB 4BDK unspecified 'FRAGMENT-BASED SCREENING IDENTIFIES A NEW AREA FOR INHIBITOR BINDING TO CHECKPOINT KINASE 2 (CHK2)'
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#
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_pdbx_database_status.status_code REL
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_pdbx_database_status.entry_id 4BDF
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_pdbx_database_status.deposit_site PDBE
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_pdbx_database_status.process_site PDBE
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_pdbx_database_status.SG_entry .
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_pdbx_database_status.recvd_initial_deposition_date 2012-10-05
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_pdbx_database_status.pdb_format_compatible Y
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_pdbx_database_status.status_code_sf ?
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_pdbx_database_status.status_code_mr ?
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_pdbx_database_status.status_code_cs ?
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_pdbx_database_status.methods_development_category ?
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#
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loop_
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_audit_author.name
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_audit_author.pdbx_ordinal
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'Silva-Santisteban, M.C.' 1
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'Westwood, I.M.' 2
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'Boxall, K.' 3
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'Brown, N.' 4
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'Peacock, S.' 5
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'McAndrew, C.' 6
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'Barrie, E.' 7
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'Richards, M.' 8
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'Mirza, A.' 9
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'Oliver, A.W.' 10
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'Burke, R.' 11
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'Hoelder, S.' 12
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'Jones, K.' 13
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'Aherne, G.W.' 14
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'Blagg, J.' 15
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'Collins, I.' 16
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'Garrett, M.D.' 17
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'van Montfort, R.L.M.' 18
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#
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_citation.id primary
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_citation.title
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'Fragment-Based Screening Maps Inhibitor Interactions in the ATP-Binding Site of Checkpoint Kinase 2.'
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_citation.journal_abbrev 'Plos One'
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_citation.journal_volume 8
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_citation.page_first 65689
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_citation.page_last ?
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_citation.year 2013
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_citation.journal_id_ASTM ?
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_citation.country US
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_citation.journal_id_ISSN 1932-6203
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_citation.journal_id_CSD ?
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_citation.book_publisher ?
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_citation.pdbx_database_id_PubMed 23776527
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_citation.pdbx_database_id_DOI 10.1371/JOURNAL.PONE.0065689
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#
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loop_
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_citation_author.citation_id
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_citation_author.name
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_citation_author.ordinal
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primary 'Silva-Santisteban, M.C.' 1
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primary 'Westwood, I.M.' 2
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primary 'Boxall, K.' 3
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primary 'Brown, N.' 4
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primary 'Peacock, S.' 5
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primary 'Mcandrew, C.' 6
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primary 'Barrie, E.' 7
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primary 'Richards, M.' 8
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primary 'Mirza, A.' 9
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primary 'Oliver, A.W.' 10
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primary 'Burke, R.' 11
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primary 'Hoelder, S.' 12
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primary 'Jones, K.' 13
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primary 'Aherne, G.W.' 14
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primary 'Blagg, J.' 15
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primary 'Collins, I.' 16
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primary 'Garrett, M.D.' 17
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primary 'Van Montfort, R.L.' 18
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#
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_cell.entry_id 4BDF
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_cell.length_a 90.950
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_cell.length_b 90.950
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_cell.length_c 93.030
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_cell.angle_alpha 90.00
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_cell.angle_beta 90.00
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_cell.angle_gamma 120.00
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_cell.Z_PDB 6
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_cell.pdbx_unique_axis ?
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#
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_symmetry.entry_id 4BDF
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_symmetry.space_group_name_H-M 'P 32 2 1'
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_symmetry.pdbx_full_space_group_name_H-M ?
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_symmetry.cell_setting ?
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_symmetry.Int_Tables_number 154
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#
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loop_
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_entity.id
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_entity.type
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_entity.src_method
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_entity.pdbx_description
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_entity.formula_weight
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_entity.pdbx_number_of_molecules
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_entity.pdbx_ec
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_entity.pdbx_mutation
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_entity.pdbx_fragment
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_entity.details
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1 polymer man 'SERINE/THREONINE-PROTEIN KINASE CHK2' 37111.844 1 2.7.11.1 ? 'KINASE DOMAIN, RESIDUES 210-531' ?
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2 non-polymer syn 5-METHYL-3-PHENYL-1H-PYRAZOLE 158.200 1 ? ? ? ?
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3 non-polymer syn 'NITRATE ION' 62.005 1 ? ? ? ?
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4 non-polymer syn 1,2-ETHANEDIOL 62.068 2 ? ? ? ?
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5 water nat water 18.015 50 ? ? ? ?
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#
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_entity_name_com.entity_id 1
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_entity_name_com.name 'CHK2 CHECKPOINT HOMOLOG, CDS1 HOMOLOG, HUCDS1, HCDS1, CHECKPOINT KINASE 2'
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#
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_entity_poly.entity_id 1
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_entity_poly.type 'polypeptide(L)'
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_entity_poly.nstd_linkage no
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_entity_poly.nstd_monomer no
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_entity_poly.pdbx_seq_one_letter_code
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;GPLGSHMSVYPKALRDEYIMSKTLGSGACGEVKLAFERKTCKKVAIKIISKRKFAIGSAREADPALNVETEIEILKKLNH
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PCIIKIKNFFDAEDYYIVLELMEGGELFDKVVGNKRLKEATCKLYFYQMLLAVQYLHENGIIHRDLKPENVLLSSQEEDC
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LIKITDFGHSKILGETSLMRTLCGTPTYLAPEVLVSVGTAGYNRAVDCWSLGVILFICLSGYPPFSEHRTQVSLKDQITS
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GKYNFIPEVWAEVSEKALDLVKKLLVVDPKARFTTEEALRHPWLQDEDMKRKFQDLLSEENESTALPQVLAQPSTSRKRP
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REGEAEGAE
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;
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_entity_poly.pdbx_seq_one_letter_code_can
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;GPLGSHMSVYPKALRDEYIMSKTLGSGACGEVKLAFERKTCKKVAIKIISKRKFAIGSAREADPALNVETEIEILKKLNH
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PCIIKIKNFFDAEDYYIVLELMEGGELFDKVVGNKRLKEATCKLYFYQMLLAVQYLHENGIIHRDLKPENVLLSSQEEDC
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LIKITDFGHSKILGETSLMRTLCGTPTYLAPEVLVSVGTAGYNRAVDCWSLGVILFICLSGYPPFSEHRTQVSLKDQITS
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GKYNFIPEVWAEVSEKALDLVKKLLVVDPKARFTTEEALRHPWLQDEDMKRKFQDLLSEENESTALPQVLAQPSTSRKRP
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REGEAEGAE
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;
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_entity_poly.pdbx_strand_id A
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_entity_poly.pdbx_target_identifier ?
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#
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loop_
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_entity_poly_seq.entity_id
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_entity_poly_seq.num
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_entity_poly_seq.mon_id
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_entity_poly_seq.hetero
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1 1 GLY n
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1 2 PRO n
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1 3 LEU n
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1 4 GLY n
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1 5 SER n
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1 6 HIS n
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1 7 MET n
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1 8 SER n
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1 9 VAL n
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1 10 TYR n
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1 11 PRO n
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1 12 LYS n
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1 13 ALA n
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1 14 LEU n
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1 15 ARG n
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1 16 ASP n
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1 17 GLU n
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1 18 TYR n
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1 19 ILE n
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1 20 MET n
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1 21 SER n
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1 22 LYS n
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1 23 THR n
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1 24 LEU n
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1 25 GLY n
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1 26 SER n
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1 27 GLY n
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1 28 ALA n
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1 29 CYS n
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1 30 GLY n
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1 31 GLU n
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1 32 VAL n
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1 33 LYS n
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1 34 LEU n
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1 35 ALA n
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1 36 PHE n
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1 37 GLU n
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1 38 ARG n
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1 39 LYS n
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1 40 THR n
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1 41 CYS n
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1 42 LYS n
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1 43 LYS n
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1 44 VAL n
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1 45 ALA n
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1 46 ILE n
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1 47 LYS n
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1 48 ILE n
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1 49 ILE n
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1 50 SER n
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1 51 LYS n
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1 52 ARG n
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1 53 LYS n
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1 54 PHE n
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1 55 ALA n
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1 56 ILE n
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1 57 GLY n
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1 58 SER n
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1 59 ALA n
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1 60 ARG n
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1 61 GLU n
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1 62 ALA n
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1 63 ASP n
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1 64 PRO n
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1 65 ALA n
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1 66 LEU n
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1 67 ASN n
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1 68 VAL n
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1 69 GLU n
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1 70 THR n
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1 71 GLU n
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1 72 ILE n
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1 73 GLU n
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1 74 ILE n
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1 75 LEU n
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1 76 LYS n
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1 77 LYS n
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1 78 LEU n
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1 79 ASN n
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1 80 HIS n
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1 81 PRO n
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1 82 CYS n
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1 83 ILE n
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1 84 ILE n
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1 85 LYS n
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1 86 ILE n
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1 87 LYS n
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1 88 ASN n
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1 89 PHE n
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1 90 PHE n
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1 91 ASP n
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1 92 ALA n
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1 93 GLU n
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1 94 ASP n
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1 95 TYR n
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1 96 TYR n
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1 97 ILE n
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1 98 VAL n
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1 99 LEU n
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1 100 GLU n
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1 101 LEU n
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1 102 MET n
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1 103 GLU n
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1 104 GLY n
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1 105 GLY n
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1 106 GLU n
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1 107 LEU n
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1 108 PHE n
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1 109 ASP n
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1 110 LYS n
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1 111 VAL n
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1 112 VAL n
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1 113 GLY n
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1 114 ASN n
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1 115 LYS n
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1 116 ARG n
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1 117 LEU n
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1 118 LYS n
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1 119 GLU n
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1 120 ALA n
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1 121 THR n
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1 122 CYS n
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1 123 LYS n
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1 124 LEU n
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1 125 TYR n
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1 126 PHE n
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1 127 TYR n
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1 128 GLN n
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1 129 MET n
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1 130 LEU n
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1 131 LEU n
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1 132 ALA n
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1 133 VAL n
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1 134 GLN n
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1 135 TYR n
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1 136 LEU n
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1 137 HIS n
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1 138 GLU n
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1 139 ASN n
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1 140 GLY n
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1 141 ILE n
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1 142 ILE n
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1 143 HIS n
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1 144 ARG n
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1 145 ASP n
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1 146 LEU n
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1 147 LYS n
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1 148 PRO n
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1 149 GLU n
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1 150 ASN n
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1 151 VAL n
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1 152 LEU n
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1 153 LEU n
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1 154 SER n
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1 155 SER n
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1 156 GLN n
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1 157 GLU n
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1 158 GLU n
|
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1 159 ASP n
|
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1 160 CYS n
|
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1 161 LEU n
|
|
1 162 ILE n
|
|
1 163 LYS n
|
|
1 164 ILE n
|
|
1 165 THR n
|
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1 166 ASP n
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1 167 PHE n
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1 168 GLY n
|
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1 169 HIS n
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1 170 SER n
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1 171 LYS n
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1 172 ILE n
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1 173 LEU n
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1 174 GLY n
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1 175 GLU n
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1 176 THR n
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1 177 SER n
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1 178 LEU n
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1 179 MET n
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1 180 ARG n
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1 181 THR n
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1 182 LEU n
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1 183 CYS n
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1 184 GLY n
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1 185 THR n
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1 186 PRO n
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1 187 THR n
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1 188 TYR n
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1 189 LEU n
|
|
1 190 ALA n
|
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1 191 PRO n
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1 192 GLU n
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1 193 VAL n
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1 194 LEU n
|
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1 195 VAL n
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1 196 SER n
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1 197 VAL n
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1 198 GLY n
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1 199 THR n
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1 200 ALA n
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1 201 GLY n
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1 202 TYR n
|
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1 203 ASN n
|
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1 204 ARG n
|
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1 205 ALA n
|
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1 206 VAL n
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1 207 ASP n
|
|
1 208 CYS n
|
|
1 209 TRP n
|
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1 210 SER n
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1 211 LEU n
|
|
1 212 GLY n
|
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1 213 VAL n
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1 214 ILE n
|
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1 215 LEU n
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1 216 PHE n
|
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1 217 ILE n
|
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1 218 CYS n
|
|
1 219 LEU n
|
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1 220 SER n
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|
1 221 GLY n
|
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1 222 TYR n
|
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1 223 PRO n
|
|
1 224 PRO n
|
|
1 225 PHE n
|
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1 226 SER n
|
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1 227 GLU n
|
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1 228 HIS n
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1 229 ARG n
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1 230 THR n
|
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1 231 GLN n
|
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1 232 VAL n
|
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1 233 SER n
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1 234 LEU n
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1 235 LYS n
|
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1 236 ASP n
|
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1 237 GLN n
|
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1 238 ILE n
|
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1 239 THR n
|
|
1 240 SER n
|
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1 241 GLY n
|
|
1 242 LYS n
|
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1 243 TYR n
|
|
1 244 ASN n
|
|
1 245 PHE n
|
|
1 246 ILE n
|
|
1 247 PRO n
|
|
1 248 GLU n
|
|
1 249 VAL n
|
|
1 250 TRP n
|
|
1 251 ALA n
|
|
1 252 GLU n
|
|
1 253 VAL n
|
|
1 254 SER n
|
|
1 255 GLU n
|
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1 256 LYS n
|
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1 257 ALA n
|
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1 258 LEU n
|
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1 259 ASP n
|
|
1 260 LEU n
|
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1 261 VAL n
|
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1 262 LYS n
|
|
1 263 LYS n
|
|
1 264 LEU n
|
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1 265 LEU n
|
|
1 266 VAL n
|
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1 267 VAL n
|
|
1 268 ASP n
|
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1 269 PRO n
|
|
1 270 LYS n
|
|
1 271 ALA n
|
|
1 272 ARG n
|
|
1 273 PHE n
|
|
1 274 THR n
|
|
1 275 THR n
|
|
1 276 GLU n
|
|
1 277 GLU n
|
|
1 278 ALA n
|
|
1 279 LEU n
|
|
1 280 ARG n
|
|
1 281 HIS n
|
|
1 282 PRO n
|
|
1 283 TRP n
|
|
1 284 LEU n
|
|
1 285 GLN n
|
|
1 286 ASP n
|
|
1 287 GLU n
|
|
1 288 ASP n
|
|
1 289 MET n
|
|
1 290 LYS n
|
|
1 291 ARG n
|
|
1 292 LYS n
|
|
1 293 PHE n
|
|
1 294 GLN n
|
|
1 295 ASP n
|
|
1 296 LEU n
|
|
1 297 LEU n
|
|
1 298 SER n
|
|
1 299 GLU n
|
|
1 300 GLU n
|
|
1 301 ASN n
|
|
1 302 GLU n
|
|
1 303 SER n
|
|
1 304 THR n
|
|
1 305 ALA n
|
|
1 306 LEU n
|
|
1 307 PRO n
|
|
1 308 GLN n
|
|
1 309 VAL n
|
|
1 310 LEU n
|
|
1 311 ALA n
|
|
1 312 GLN n
|
|
1 313 PRO n
|
|
1 314 SER n
|
|
1 315 THR n
|
|
1 316 SER n
|
|
1 317 ARG n
|
|
1 318 LYS n
|
|
1 319 ARG n
|
|
1 320 PRO n
|
|
1 321 ARG n
|
|
1 322 GLU n
|
|
1 323 GLY n
|
|
1 324 GLU n
|
|
1 325 ALA n
|
|
1 326 GLU n
|
|
1 327 GLY n
|
|
1 328 ALA n
|
|
1 329 GLU 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 HUMAN
|
|
_entity_src_gen.gene_src_genus ?
|
|
_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 'HOMO SAPIENS'
|
|
_entity_src_gen.pdbx_gene_src_ncbi_taxonomy_id 9606
|
|
_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 'ESCHERICHIA COLI'
|
|
_entity_src_gen.pdbx_host_org_ncbi_taxonomy_id 469008
|
|
_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 'BL21(DE3)'
|
|
_entity_src_gen.pdbx_host_org_variant 'ROSETTA2 PLYSS'
|
|
_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 PLASMID
|
|
_entity_src_gen.pdbx_host_org_vector ?
|
|
_entity_src_gen.host_org_details ?
|
|
_entity_src_gen.expression_system_id ?
|
|
_entity_src_gen.plasmid_name PTHREE-E
|
|
_entity_src_gen.plasmid_details ?
|
|
_entity_src_gen.pdbx_description ?
|
|
#
|
|
_struct_ref.id 1
|
|
_struct_ref.db_name UNP
|
|
_struct_ref.db_code CHK2_HUMAN
|
|
_struct_ref.entity_id 1
|
|
_struct_ref.pdbx_seq_one_letter_code ?
|
|
_struct_ref.pdbx_align_begin ?
|
|
_struct_ref.pdbx_db_accession O96017
|
|
_struct_ref.pdbx_db_isoform ?
|
|
#
|
|
_struct_ref_seq.align_id 1
|
|
_struct_ref_seq.ref_id 1
|
|
_struct_ref_seq.pdbx_PDB_id_code 4BDF
|
|
_struct_ref_seq.pdbx_strand_id A
|
|
_struct_ref_seq.seq_align_beg 8
|
|
_struct_ref_seq.pdbx_seq_align_beg_ins_code ?
|
|
_struct_ref_seq.seq_align_end 329
|
|
_struct_ref_seq.pdbx_seq_align_end_ins_code ?
|
|
_struct_ref_seq.pdbx_db_accession O96017
|
|
_struct_ref_seq.db_align_beg 210
|
|
_struct_ref_seq.pdbx_db_align_beg_ins_code ?
|
|
_struct_ref_seq.db_align_end 531
|
|
_struct_ref_seq.pdbx_db_align_end_ins_code ?
|
|
_struct_ref_seq.pdbx_auth_seq_align_beg 210
|
|
_struct_ref_seq.pdbx_auth_seq_align_end 531
|
|
#
|
|
loop_
|
|
_struct_ref_seq_dif.align_id
|
|
_struct_ref_seq_dif.pdbx_pdb_id_code
|
|
_struct_ref_seq_dif.mon_id
|
|
_struct_ref_seq_dif.pdbx_pdb_strand_id
|
|
_struct_ref_seq_dif.seq_num
|
|
_struct_ref_seq_dif.pdbx_pdb_ins_code
|
|
_struct_ref_seq_dif.pdbx_seq_db_name
|
|
_struct_ref_seq_dif.pdbx_seq_db_accession_code
|
|
_struct_ref_seq_dif.db_mon_id
|
|
_struct_ref_seq_dif.pdbx_seq_db_seq_num
|
|
_struct_ref_seq_dif.details
|
|
_struct_ref_seq_dif.pdbx_auth_seq_num
|
|
_struct_ref_seq_dif.pdbx_ordinal
|
|
1 4BDF GLY A 1 ? UNP O96017 ? ? 'expression tag' 203 1
|
|
1 4BDF PRO A 2 ? UNP O96017 ? ? 'expression tag' 204 2
|
|
1 4BDF LEU A 3 ? UNP O96017 ? ? 'expression tag' 205 3
|
|
1 4BDF GLY A 4 ? UNP O96017 ? ? 'expression tag' 206 4
|
|
1 4BDF SER A 5 ? UNP O96017 ? ? 'expression tag' 207 5
|
|
1 4BDF HIS A 6 ? UNP O96017 ? ? 'expression tag' 208 6
|
|
1 4BDF MET A 7 ? UNP O96017 ? ? 'expression tag' 209 7
|
|
#
|
|
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
|
|
ALA 'L-peptide linking' y ALANINE ? 'C3 H7 N O2' 89.093
|
|
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
|
|
EDO non-polymer . 1,2-ETHANEDIOL 'ETHYLENE GLYCOL' 'C2 H6 O2' 62.068
|
|
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
|
|
H3R non-polymer . 5-METHYL-3-PHENYL-1H-PYRAZOLE ? 'C10 H10 N2' 158.200
|
|
HIS 'L-peptide linking' y HISTIDINE ? 'C6 H10 N3 O2 1' 156.162
|
|
HOH non-polymer . WATER ? 'H2 O' 18.015
|
|
ILE 'L-peptide linking' y ISOLEUCINE ? 'C6 H13 N O2' 131.173
|
|
LEU 'L-peptide linking' y LEUCINE ? 'C6 H13 N O2' 131.173
|
|
LYS 'L-peptide linking' y LYSINE ? 'C6 H15 N2 O2 1' 147.195
|
|
MET 'L-peptide linking' y METHIONINE ? 'C5 H11 N O2 S' 149.211
|
|
NO3 non-polymer . 'NITRATE ION' ? 'N O3 -1' 62.005
|
|
PHE 'L-peptide linking' y PHENYLALANINE ? 'C9 H11 N O2' 165.189
|
|
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
|
|
#
|
|
_exptl.entry_id 4BDF
|
|
_exptl.method 'X-RAY DIFFRACTION'
|
|
_exptl.crystals_number 1
|
|
#
|
|
_exptl_crystal.id 1
|
|
_exptl_crystal.density_meas ?
|
|
_exptl_crystal.density_Matthews 2.99
|
|
_exptl_crystal.density_percent_sol 58.92
|
|
_exptl_crystal.description NONE
|
|
#
|
|
_exptl_crystal_grow.crystal_id 1
|
|
_exptl_crystal_grow.method ?
|
|
_exptl_crystal_grow.temp ?
|
|
_exptl_crystal_grow.temp_details ?
|
|
_exptl_crystal_grow.pH ?
|
|
_exptl_crystal_grow.pdbx_pH_range ?
|
|
_exptl_crystal_grow.pdbx_details
|
|
'0.1 M HEPES 7.5, 0.2 M MG(NO3)2, 10% (V/V) ETHYLENE GLYCOL, 1 MM TCEP AND 8-14% (W/V) PEG 3350'
|
|
#
|
|
_diffrn.id 1
|
|
_diffrn.ambient_temp 100
|
|
_diffrn.ambient_temp_details ?
|
|
_diffrn.crystal_id 1
|
|
#
|
|
_diffrn_detector.diffrn_id 1
|
|
_diffrn_detector.detector CCD
|
|
_diffrn_detector.type 'ADSC CCD'
|
|
_diffrn_detector.pdbx_collection_date 2008-12-17
|
|
_diffrn_detector.details ?
|
|
#
|
|
_diffrn_radiation.diffrn_id 1
|
|
_diffrn_radiation.wavelength_id 1
|
|
_diffrn_radiation.pdbx_monochromatic_or_laue_m_l M
|
|
_diffrn_radiation.monochromator ?
|
|
_diffrn_radiation.pdbx_diffrn_protocol 'SINGLE WAVELENGTH'
|
|
_diffrn_radiation.pdbx_scattering_type x-ray
|
|
#
|
|
_diffrn_radiation_wavelength.id 1
|
|
_diffrn_radiation_wavelength.wavelength 0.97280
|
|
_diffrn_radiation_wavelength.wt 1.0
|
|
#
|
|
_diffrn_source.diffrn_id 1
|
|
_diffrn_source.source SYNCHROTRON
|
|
_diffrn_source.type 'DIAMOND BEAMLINE I04'
|
|
_diffrn_source.pdbx_synchrotron_site Diamond
|
|
_diffrn_source.pdbx_synchrotron_beamline I04
|
|
_diffrn_source.pdbx_wavelength 0.97280
|
|
_diffrn_source.pdbx_wavelength_list ?
|
|
#
|
|
_reflns.pdbx_diffrn_id 1
|
|
_reflns.pdbx_ordinal 1
|
|
_reflns.entry_id 4BDF
|
|
_reflns.observed_criterion_sigma_I 1.5
|
|
_reflns.observed_criterion_sigma_F ?
|
|
_reflns.d_resolution_low 78.81
|
|
_reflns.d_resolution_high 2.70
|
|
_reflns.number_obs 12578
|
|
_reflns.number_all ?
|
|
_reflns.percent_possible_obs 99.8
|
|
_reflns.pdbx_Rmerge_I_obs 0.10
|
|
_reflns.pdbx_Rsym_value ?
|
|
_reflns.pdbx_netI_over_sigmaI 8.70
|
|
_reflns.B_iso_Wilson_estimate 85.71
|
|
_reflns.pdbx_redundancy 3.5
|
|
#
|
|
_reflns_shell.pdbx_diffrn_id 1
|
|
_reflns_shell.pdbx_ordinal 1
|
|
_reflns_shell.d_res_high 2.70
|
|
_reflns_shell.d_res_low 2.85
|
|
_reflns_shell.percent_possible_all 99.9
|
|
_reflns_shell.Rmerge_I_obs 0.47
|
|
_reflns_shell.pdbx_Rsym_value ?
|
|
_reflns_shell.meanI_over_sigI_obs 3.00
|
|
_reflns_shell.pdbx_redundancy 3.6
|
|
#
|
|
_refine.pdbx_refine_id 'X-RAY DIFFRACTION'
|
|
_refine.entry_id 4BDF
|
|
_refine.pdbx_diffrn_id 1
|
|
_refine.pdbx_TLS_residual_ADP_flag ?
|
|
_refine.ls_number_reflns_obs 12518
|
|
_refine.ls_number_reflns_all ?
|
|
_refine.pdbx_ls_sigma_I ?
|
|
_refine.pdbx_ls_sigma_F 0.0
|
|
_refine.pdbx_data_cutoff_high_absF ?
|
|
_refine.pdbx_data_cutoff_low_absF ?
|
|
_refine.pdbx_data_cutoff_high_rms_absF ?
|
|
_refine.ls_d_res_low 22.19
|
|
_refine.ls_d_res_high 2.70
|
|
_refine.ls_percent_reflns_obs 99.50
|
|
_refine.ls_R_factor_obs 0.1835
|
|
_refine.ls_R_factor_all ?
|
|
_refine.ls_R_factor_R_work 0.1810
|
|
_refine.ls_R_factor_R_free 0.2334
|
|
_refine.ls_R_factor_R_free_error ?
|
|
_refine.ls_R_factor_R_free_error_details ?
|
|
_refine.ls_percent_reflns_R_free 4.86
|
|
_refine.ls_number_reflns_R_free 608
|
|
_refine.ls_number_parameters ?
|
|
_refine.ls_number_restraints ?
|
|
_refine.occupancy_min ?
|
|
_refine.occupancy_max ?
|
|
_refine.correlation_coeff_Fo_to_Fc 0.9516
|
|
_refine.correlation_coeff_Fo_to_Fc_free 0.9329
|
|
_refine.B_iso_mean 71.95
|
|
_refine.aniso_B[1][1] 0.9153
|
|
_refine.aniso_B[2][2] 0.9153
|
|
_refine.aniso_B[3][3] -1.8306
|
|
_refine.aniso_B[1][2] 0.0000
|
|
_refine.aniso_B[1][3] 0.0000
|
|
_refine.aniso_B[2][3] 0.0000
|
|
_refine.solvent_model_details ?
|
|
_refine.solvent_model_param_ksol ?
|
|
_refine.solvent_model_param_bsol ?
|
|
_refine.pdbx_solvent_vdw_probe_radii ?
|
|
_refine.pdbx_solvent_ion_probe_radii ?
|
|
_refine.pdbx_solvent_shrinkage_radii ?
|
|
_refine.pdbx_ls_cross_valid_method THROUGHOUT
|
|
_refine.details
|
|
'IDEAL-DIST CONTACT TERM CONTACT SETUP. ALL ATOMS HAVE CCP4 ATOM TYPE FROM LIBRARY'
|
|
_refine.pdbx_starting_model 'PDB ENTRY 2WTJ'
|
|
_refine.pdbx_method_to_determine_struct 'MOLECULAR REPLACEMENT'
|
|
_refine.pdbx_isotropic_thermal_model ?
|
|
_refine.pdbx_stereochemistry_target_values ?
|
|
_refine.pdbx_stereochem_target_val_spec_case ?
|
|
_refine.pdbx_R_Free_selection_details RANDOM
|
|
_refine.pdbx_overall_ESU_R ?
|
|
_refine.pdbx_overall_ESU_R_Free ?
|
|
_refine.overall_SU_ML ?
|
|
_refine.pdbx_overall_phase_error ?
|
|
_refine.overall_SU_B ?
|
|
_refine.overall_SU_R_Cruickshank_DPI 0.393
|
|
_refine.pdbx_overall_SU_R_free_Cruickshank_DPI 0.267
|
|
_refine.pdbx_overall_SU_R_Blow_DPI 0.399
|
|
_refine.pdbx_overall_SU_R_free_Blow_DPI 0.265
|
|
#
|
|
_refine_analyze.pdbx_refine_id 'X-RAY DIFFRACTION'
|
|
_refine_analyze.entry_id 4BDF
|
|
_refine_analyze.Luzzati_coordinate_error_obs 0.365
|
|
_refine_analyze.Luzzati_sigma_a_obs ?
|
|
_refine_analyze.Luzzati_d_res_low_obs ?
|
|
_refine_analyze.Luzzati_coordinate_error_free ?
|
|
_refine_analyze.Luzzati_sigma_a_free ?
|
|
_refine_analyze.Luzzati_d_res_low_free ?
|
|
_refine_analyze.number_disordered_residues ?
|
|
_refine_analyze.occupancy_sum_hydrogen ?
|
|
_refine_analyze.occupancy_sum_non_hydrogen ?
|
|
#
|
|
_refine_hist.pdbx_refine_id 'X-RAY DIFFRACTION'
|
|
_refine_hist.cycle_id LAST
|
|
_refine_hist.pdbx_number_atoms_protein 2184
|
|
_refine_hist.pdbx_number_atoms_nucleic_acid 0
|
|
_refine_hist.pdbx_number_atoms_ligand 24
|
|
_refine_hist.number_atoms_solvent 50
|
|
_refine_hist.number_atoms_total 2258
|
|
_refine_hist.d_res_high 2.70
|
|
_refine_hist.d_res_low 22.19
|
|
#
|
|
loop_
|
|
_refine_ls_restr.type
|
|
_refine_ls_restr.dev_ideal
|
|
_refine_ls_restr.dev_ideal_target
|
|
_refine_ls_restr.weight
|
|
_refine_ls_restr.number
|
|
_refine_ls_restr.pdbx_refine_id
|
|
_refine_ls_restr.pdbx_restraint_function
|
|
t_bond_d 0.010 ? 2.00 2249 'X-RAY DIFFRACTION' HARMONIC
|
|
t_angle_deg 1.16 ? 2.00 3047 'X-RAY DIFFRACTION' HARMONIC
|
|
t_dihedral_angle_d ? ? 2.00 757 'X-RAY DIFFRACTION' SINUSOIDAL
|
|
t_incorr_chiral_ct ? ? ? ? 'X-RAY DIFFRACTION' ?
|
|
t_pseud_angle ? ? ? ? 'X-RAY DIFFRACTION' ?
|
|
t_trig_c_planes ? ? 2.00 48 'X-RAY DIFFRACTION' HARMONIC
|
|
t_gen_planes ? ? 5.00 336 'X-RAY DIFFRACTION' HARMONIC
|
|
t_it ? ? 20.00 2249 'X-RAY DIFFRACTION' HARMONIC
|
|
t_nbd ? ? ? ? 'X-RAY DIFFRACTION' ?
|
|
t_omega_torsion 2.42 ? ? ? 'X-RAY DIFFRACTION' ?
|
|
t_other_torsion 18.81 ? ? ? 'X-RAY DIFFRACTION' ?
|
|
t_improper_torsion ? ? ? ? 'X-RAY DIFFRACTION' ?
|
|
t_chiral_improper_torsion ? ? 5.00 302 'X-RAY DIFFRACTION' SEMIHARMONIC
|
|
t_sum_occupancies ? ? ? ? 'X-RAY DIFFRACTION' ?
|
|
t_utility_distance ? ? ? ? 'X-RAY DIFFRACTION' ?
|
|
t_utility_angle ? ? ? ? 'X-RAY DIFFRACTION' ?
|
|
t_utility_torsion ? ? ? ? 'X-RAY DIFFRACTION' ?
|
|
t_ideal_dist_contact ? ? 4.00 2633 'X-RAY DIFFRACTION' SEMIHARMONIC
|
|
#
|
|
_refine_ls_shell.pdbx_refine_id 'X-RAY DIFFRACTION'
|
|
_refine_ls_shell.pdbx_total_number_of_bins_used 6
|
|
_refine_ls_shell.d_res_high 2.70
|
|
_refine_ls_shell.d_res_low 2.96
|
|
_refine_ls_shell.number_reflns_R_work 2794
|
|
_refine_ls_shell.R_factor_R_work 0.2118
|
|
_refine_ls_shell.percent_reflns_obs 99.50
|
|
_refine_ls_shell.R_factor_R_free 0.2642
|
|
_refine_ls_shell.R_factor_R_free_error ?
|
|
_refine_ls_shell.percent_reflns_R_free 5.03
|
|
_refine_ls_shell.number_reflns_R_free 148
|
|
_refine_ls_shell.number_reflns_all 2942
|
|
_refine_ls_shell.R_factor_all 0.2144
|
|
#
|
|
_struct.entry_id 4BDF
|
|
_struct.title
|
|
'Fragment-based screening identifies a new area for inhibitor binding to checkpoint kinase 2 (CHK2)'
|
|
_struct.pdbx_descriptor 'SERINE/THREONINE-PROTEIN KINASE CHK2 (E.C.2.7.11.1)'
|
|
_struct.pdbx_model_details ?
|
|
_struct.pdbx_CASP_flag ?
|
|
_struct.pdbx_model_type_details ?
|
|
#
|
|
_struct_keywords.entry_id 4BDF
|
|
_struct_keywords.pdbx_keywords TRANSFERASE
|
|
_struct_keywords.text 'TRANSFERASE, INHIBITOR'
|
|
#
|
|
loop_
|
|
_struct_asym.id
|
|
_struct_asym.pdbx_blank_PDB_chainid_flag
|
|
_struct_asym.pdbx_modified
|
|
_struct_asym.entity_id
|
|
_struct_asym.details
|
|
A N N 1 ?
|
|
B N N 2 ?
|
|
C N N 3 ?
|
|
D N N 4 ?
|
|
E N N 4 ?
|
|
F N N 5 ?
|
|
#
|
|
_struct_biol.id 1
|
|
#
|
|
loop_
|
|
_struct_conf.conf_type_id
|
|
_struct_conf.id
|
|
_struct_conf.pdbx_PDB_helix_id
|
|
_struct_conf.beg_label_comp_id
|
|
_struct_conf.beg_label_asym_id
|
|
_struct_conf.beg_label_seq_id
|
|
_struct_conf.pdbx_beg_PDB_ins_code
|
|
_struct_conf.end_label_comp_id
|
|
_struct_conf.end_label_asym_id
|
|
_struct_conf.end_label_seq_id
|
|
_struct_conf.pdbx_end_PDB_ins_code
|
|
_struct_conf.beg_auth_comp_id
|
|
_struct_conf.beg_auth_asym_id
|
|
_struct_conf.beg_auth_seq_id
|
|
_struct_conf.end_auth_comp_id
|
|
_struct_conf.end_auth_asym_id
|
|
_struct_conf.end_auth_seq_id
|
|
_struct_conf.pdbx_PDB_helix_class
|
|
_struct_conf.details
|
|
_struct_conf.pdbx_PDB_helix_length
|
|
HELX_P HELX_P1 1 PRO A 11 ? GLU A 17 ? PRO A 213 GLU A 219 1 ? 7
|
|
HELX_P HELX_P2 2 ASN A 67 ? LEU A 78 ? ASN A 269 LEU A 280 1 ? 12
|
|
HELX_P HELX_P3 3 LEU A 107 ? VAL A 112 ? LEU A 309 VAL A 314 1 ? 6
|
|
HELX_P HELX_P4 4 LYS A 118 ? ASN A 139 ? LYS A 320 ASN A 341 1 ? 22
|
|
HELX_P HELX_P5 5 LYS A 147 ? GLU A 149 ? LYS A 349 GLU A 351 5 ? 3
|
|
HELX_P HELX_P6 6 THR A 176 ? CYS A 183 ? THR A 378 CYS A 385 1 ? 8
|
|
HELX_P HELX_P7 7 ALA A 190 ? VAL A 197 ? ALA A 392 VAL A 399 1 ? 8
|
|
HELX_P HELX_P8 8 ARG A 204 ? GLY A 221 ? ARG A 406 GLY A 423 1 ? 18
|
|
HELX_P HELX_P9 9 SER A 233 ? GLY A 241 ? SER A 435 GLY A 443 1 ? 9
|
|
HELX_P HELX_P10 10 ILE A 246 ? ALA A 251 ? ILE A 448 ALA A 453 1 ? 6
|
|
HELX_P HELX_P11 11 SER A 254 ? LEU A 265 ? SER A 456 LEU A 467 1 ? 12
|
|
HELX_P HELX_P12 12 THR A 274 ? HIS A 281 ? THR A 476 HIS A 483 1 ? 8
|
|
HELX_P HELX_P13 13 PRO A 282 ? GLN A 285 ? PRO A 484 GLN A 487 5 ? 4
|
|
HELX_P HELX_P14 14 ASP A 286 ? GLU A 302 ? ASP A 488 GLU A 504 1 ? 17
|
|
#
|
|
_struct_conf_type.id HELX_P
|
|
_struct_conf_type.criteria ?
|
|
_struct_conf_type.reference ?
|
|
#
|
|
loop_
|
|
_struct_sheet.id
|
|
_struct_sheet.type
|
|
_struct_sheet.number_strands
|
|
_struct_sheet.details
|
|
AA ? 5 ?
|
|
AB ? 3 ?
|
|
AC ? 2 ?
|
|
#
|
|
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
|
|
AA 1 2 ? anti-parallel
|
|
AA 2 3 ? anti-parallel
|
|
AA 3 4 ? anti-parallel
|
|
AA 4 5 ? anti-parallel
|
|
AB 1 2 ? anti-parallel
|
|
AB 2 3 ? anti-parallel
|
|
AC 1 2 ? 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
|
|
AA 1 TYR A 18 ? THR A 23 ? TYR A 220 THR A 225
|
|
AA 2 GLU A 31 ? GLU A 37 ? GLU A 233 GLU A 239
|
|
AA 3 LYS A 42 ? SER A 50 ? LYS A 244 SER A 252
|
|
AA 4 ASP A 94 ? LEU A 99 ? ASP A 296 LEU A 301
|
|
AA 5 ILE A 86 ? ASP A 91 ? ILE A 288 ASP A 293
|
|
AB 1 GLY A 105 ? GLU A 106 ? GLY A 307 GLU A 308
|
|
AB 2 VAL A 151 ? LEU A 153 ? VAL A 353 LEU A 355
|
|
AB 3 ILE A 162 ? ILE A 164 ? ILE A 364 ILE A 366
|
|
AC 1 ILE A 141 ? ILE A 142 ? ILE A 343 ILE A 344
|
|
AC 2 LYS A 171 ? ILE A 172 ? LYS A 373 ILE A 374
|
|
#
|
|
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
|
|
AA 1 2 N SER A 21 ? N SER A 223 O LEU A 34 ? O LEU A 236
|
|
AA 2 3 N GLU A 37 ? N GLU A 239 O LYS A 42 ? O LYS A 244
|
|
AA 3 4 N ILE A 49 ? N ILE A 251 O TYR A 95 ? O TYR A 297
|
|
AA 4 5 O VAL A 98 ? O VAL A 300 N LYS A 87 ? N LYS A 289
|
|
AB 1 2 O GLY A 105 ? O GLY A 307 N LEU A 153 ? N LEU A 355
|
|
AB 2 3 N LEU A 152 ? N LEU A 354 O LYS A 163 ? O LYS A 365
|
|
AC 1 2 N ILE A 142 ? N ILE A 344 O LYS A 171 ? O LYS A 373
|
|
#
|
|
loop_
|
|
_struct_site.id
|
|
_struct_site.pdbx_evidence_code
|
|
_struct_site.pdbx_auth_asym_id
|
|
_struct_site.pdbx_auth_comp_id
|
|
_struct_site.pdbx_auth_seq_id
|
|
_struct_site.pdbx_auth_ins_code
|
|
_struct_site.pdbx_num_residues
|
|
_struct_site.details
|
|
AC1 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE H3R A 1513'
|
|
AC2 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE NO3 A 1514'
|
|
AC3 Software ? ? ? ? 4 'BINDING SITE FOR RESIDUE EDO A 1515'
|
|
AC4 Software ? ? ? ? 5 'BINDING SITE FOR RESIDUE EDO A 1516'
|
|
#
|
|
loop_
|
|
_struct_site_gen.id
|
|
_struct_site_gen.site_id
|
|
_struct_site_gen.pdbx_num_res
|
|
_struct_site_gen.label_comp_id
|
|
_struct_site_gen.label_asym_id
|
|
_struct_site_gen.label_seq_id
|
|
_struct_site_gen.pdbx_auth_ins_code
|
|
_struct_site_gen.auth_comp_id
|
|
_struct_site_gen.auth_asym_id
|
|
_struct_site_gen.auth_seq_id
|
|
_struct_site_gen.label_atom_id
|
|
_struct_site_gen.label_alt_id
|
|
_struct_site_gen.symmetry
|
|
_struct_site_gen.details
|
|
1 AC1 4 GLU A 100 ? GLU A 302 . ? 1_555 ?
|
|
2 AC1 4 MET A 102 ? MET A 304 . ? 1_555 ?
|
|
3 AC1 4 GLY A 105 ? GLY A 307 . ? 1_555 ?
|
|
4 AC1 4 LEU A 152 ? LEU A 354 . ? 1_555 ?
|
|
5 AC2 4 LEU A 173 ? LEU A 375 . ? 1_555 ?
|
|
6 AC2 4 GLY A 201 ? GLY A 403 . ? 1_555 ?
|
|
7 AC2 4 ASN A 203 ? ASN A 405 . ? 1_555 ?
|
|
8 AC2 4 ARG A 204 ? ARG A 406 . ? 1_555 ?
|
|
9 AC3 4 GLU A 17 ? GLU A 219 . ? 1_555 ?
|
|
10 AC3 4 ASN A 88 ? ASN A 290 . ? 1_555 ?
|
|
11 AC3 4 PHE A 89 ? PHE A 291 . ? 1_555 ?
|
|
12 AC3 4 PHE A 90 ? PHE A 292 . ? 1_555 ?
|
|
13 AC4 5 LYS A 263 ? LYS A 465 . ? 1_555 ?
|
|
14 AC4 5 PHE A 273 ? PHE A 475 . ? 1_555 ?
|
|
15 AC4 5 GLU A 277 ? GLU A 479 . ? 1_555 ?
|
|
16 AC4 5 HIS A 281 ? HIS A 483 . ? 1_555 ?
|
|
17 AC4 5 PRO A 282 ? PRO A 484 . ? 1_555 ?
|
|
#
|
|
_database_PDB_matrix.entry_id 4BDF
|
|
_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
|
|
#
|
|
_atom_sites.entry_id 4BDF
|
|
_atom_sites.fract_transf_matrix[1][1] 0.010995
|
|
_atom_sites.fract_transf_matrix[1][2] 0.006348
|
|
_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] 0.012696
|
|
_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] 0.010749
|
|
_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 . MET A 1 7 ? -58.514 36.415 20.842 1.00 73.14 ? 209 MET A N 1
|
|
ATOM 2 C CA . MET A 1 7 ? -57.230 36.531 20.138 1.00 72.71 ? 209 MET A CA 1
|
|
ATOM 3 C C . MET A 1 7 ? -56.343 37.723 20.691 1.00 76.61 ? 209 MET A C 1
|
|
ATOM 4 O O . MET A 1 7 ? -56.258 37.852 21.921 1.00 77.94 ? 209 MET A O 1
|
|
ATOM 5 C CB . MET A 1 7 ? -57.454 36.547 18.612 1.00 74.74 ? 209 MET A CB 1
|
|
ATOM 6 N N . SER A 1 8 ? -55.658 38.545 19.822 1.00 113.31 ? 210 SER A N 1
|
|
ATOM 7 C CA . SER A 1 8 ? -54.807 39.708 20.214 1.00 109.59 ? 210 SER A CA 1
|
|
ATOM 8 C C . SER A 1 8 ? -54.424 40.623 19.019 1.00 104.25 ? 210 SER A C 1
|
|
ATOM 9 O O . SER A 1 8 ? -54.695 40.249 17.869 1.00 104.37 ? 210 SER A O 1
|
|
ATOM 10 C CB . SER A 1 8 ? -53.551 39.261 20.962 1.00 115.31 ? 210 SER A CB 1
|
|
ATOM 11 O OG . SER A 1 8 ? -53.223 40.192 21.983 1.00 125.09 ? 210 SER A OG 1
|
|
ATOM 12 N N . VAL A 1 9 ? -53.806 41.819 19.281 1.00 92.72 ? 211 VAL A N 1
|
|
ATOM 13 C CA . VAL A 1 9 ? -53.416 42.775 18.208 1.00 86.25 ? 211 VAL A CA 1
|
|
ATOM 14 C C . VAL A 1 9 ? -51.908 43.098 18.116 1.00 84.50 ? 211 VAL A C 1
|
|
ATOM 15 O O . VAL A 1 9 ? -51.186 42.927 19.106 1.00 85.66 ? 211 VAL A O 1
|
|
ATOM 16 C CB . VAL A 1 9 ? -54.275 44.086 18.136 1.00 87.09 ? 211 VAL A CB 1
|
|
ATOM 17 C CG1 . VAL A 1 9 ? -55.736 43.801 17.823 1.00 87.21 ? 211 VAL A CG1 1
|
|
ATOM 18 C CG2 . VAL A 1 9 ? -54.126 44.951 19.385 1.00 87.47 ? 211 VAL A CG2 1
|
|
ATOM 19 N N . TYR A 1 10 ? -51.462 43.606 16.923 1.00 74.66 ? 212 TYR A N 1
|
|
ATOM 20 C CA . TYR A 1 10 ? -50.100 44.090 16.654 1.00 71.48 ? 212 TYR A CA 1
|
|
ATOM 21 C C . TYR A 1 10 ? -49.971 45.520 17.192 1.00 73.06 ? 212 TYR A C 1
|
|
ATOM 22 O O . TYR A 1 10 ? -50.977 46.255 17.218 1.00 71.85 ? 212 TYR A O 1
|
|
ATOM 23 C CB . TYR A 1 10 ? -49.768 44.110 15.150 1.00 69.78 ? 212 TYR A CB 1
|
|
ATOM 24 C CG . TYR A 1 10 ? -49.693 42.746 14.520 1.00 72.36 ? 212 TYR A CG 1
|
|
ATOM 25 C CD1 . TYR A 1 10 ? -48.710 41.834 14.898 1.00 75.62 ? 212 TYR A CD1 1
|
|
ATOM 26 C CD2 . TYR A 1 10 ? -50.597 42.362 13.539 1.00 73.21 ? 212 TYR A CD2 1
|
|
ATOM 27 C CE1 . TYR A 1 10 ? -48.661 40.555 14.346 1.00 77.51 ? 212 TYR A CE1 1
|
|
ATOM 28 C CE2 . TYR A 1 10 ? -50.550 41.091 12.969 1.00 75.34 ? 212 TYR A CE2 1
|
|
ATOM 29 C CZ . TYR A 1 10 ? -49.569 40.196 13.362 1.00 85.25 ? 212 TYR A CZ 1
|
|
ATOM 30 O OH . TYR A 1 10 ? -49.512 38.958 12.766 1.00 89.35 ? 212 TYR A OH 1
|
|
ATOM 31 N N . PRO A 1 11 ? -48.749 45.967 17.586 1.00 68.15 ? 213 PRO A N 1
|
|
ATOM 32 C CA . PRO A 1 11 ? -48.624 47.334 18.116 1.00 66.83 ? 213 PRO A CA 1
|
|
ATOM 33 C C . PRO A 1 11 ? -48.848 48.374 17.035 1.00 65.57 ? 213 PRO A C 1
|
|
ATOM 34 O O . PRO A 1 11 ? -48.540 48.148 15.848 1.00 62.54 ? 213 PRO A O 1
|
|
ATOM 35 C CB . PRO A 1 11 ? -47.207 47.377 18.710 1.00 69.79 ? 213 PRO A CB 1
|
|
ATOM 36 C CG . PRO A 1 11 ? -46.732 45.965 18.711 1.00 75.18 ? 213 PRO A CG 1
|
|
ATOM 37 C CD . PRO A 1 11 ? -47.448 45.266 17.615 1.00 69.55 ? 213 PRO A CD 1
|
|
ATOM 38 N N . LYS A 1 12 ? -49.429 49.503 17.456 1.00 60.06 ? 214 LYS A N 1
|
|
ATOM 39 C CA . LYS A 1 12 ? -49.745 50.639 16.600 1.00 57.12 ? 214 LYS A CA 1
|
|
ATOM 40 C C . LYS A 1 12 ? -48.524 51.079 15.762 1.00 58.15 ? 214 LYS A C 1
|
|
ATOM 41 O O . LYS A 1 12 ? -48.691 51.310 14.568 1.00 55.13 ? 214 LYS A O 1
|
|
ATOM 42 C CB . LYS A 1 12 ? -50.272 51.778 17.471 1.00 59.59 ? 214 LYS A CB 1
|
|
ATOM 43 C CG . LYS A 1 12 ? -51.180 52.743 16.760 1.00 53.87 ? 214 LYS A CG 1
|
|
ATOM 44 C CD . LYS A 1 12 ? -51.165 54.080 17.489 1.00 47.87 ? 214 LYS A CD 1
|
|
ATOM 45 C CE . LYS A 1 12 ? -52.192 55.023 16.934 1.00 49.02 ? 214 LYS A CE 1
|
|
ATOM 46 N NZ . LYS A 1 12 ? -52.067 56.348 17.573 1.00 64.71 ? 214 LYS A NZ 1
|
|
ATOM 47 N N . ALA A 1 13 ? -47.300 51.137 16.377 1.00 55.49 ? 215 ALA A N 1
|
|
ATOM 48 C CA . ALA A 1 13 ? -46.028 51.500 15.717 1.00 54.76 ? 215 ALA A CA 1
|
|
ATOM 49 C C . ALA A 1 13 ? -45.602 50.514 14.608 1.00 59.21 ? 215 ALA A C 1
|
|
ATOM 50 O O . ALA A 1 13 ? -45.065 50.942 13.581 1.00 58.51 ? 215 ALA A O 1
|
|
ATOM 51 C CB . ALA A 1 13 ? -44.918 51.649 16.741 1.00 56.89 ? 215 ALA A CB 1
|
|
ATOM 52 N N . LEU A 1 14 ? -45.827 49.200 14.816 1.00 55.73 ? 216 LEU A N 1
|
|
ATOM 53 C CA . LEU A 1 14 ? -45.540 48.190 13.803 1.00 54.86 ? 216 LEU A CA 1
|
|
ATOM 54 C C . LEU A 1 14 ? -46.494 48.415 12.650 1.00 57.59 ? 216 LEU A C 1
|
|
ATOM 55 O O . LEU A 1 14 ? -46.057 48.612 11.518 1.00 56.09 ? 216 LEU A O 1
|
|
ATOM 56 C CB . LEU A 1 14 ? -45.735 46.777 14.391 1.00 56.49 ? 216 LEU A CB 1
|
|
ATOM 57 C CG . LEU A 1 14 ? -45.574 45.601 13.432 1.00 59.57 ? 216 LEU A CG 1
|
|
ATOM 58 C CD1 . LEU A 1 14 ? -44.170 45.525 12.935 1.00 59.10 ? 216 LEU A CD1 1
|
|
ATOM 59 C CD2 . LEU A 1 14 ? -46.007 44.293 14.085 1.00 61.37 ? 216 LEU A CD2 1
|
|
ATOM 60 N N . ARG A 1 15 ? -47.808 48.444 12.975 1.00 55.27 ? 217 ARG A N 1
|
|
ATOM 61 C CA . ARG A 1 15 ? -48.960 48.688 12.100 1.00 53.80 ? 217 ARG A CA 1
|
|
ATOM 62 C C . ARG A 1 15 ? -48.791 49.948 11.263 1.00 57.61 ? 217 ARG A C 1
|
|
ATOM 63 O O . ARG A 1 15 ? -49.042 49.906 10.060 1.00 59.48 ? 217 ARG A O 1
|
|
ATOM 64 C CB . ARG A 1 15 ? -50.251 48.778 12.937 1.00 52.05 ? 217 ARG A CB 1
|
|
ATOM 65 C CG . ARG A 1 15 ? -50.858 47.425 13.291 1.00 47.56 ? 217 ARG A CG 1
|
|
ATOM 66 C CD . ARG A 1 15 ? -52.104 47.602 14.101 1.00 46.67 ? 217 ARG A CD 1
|
|
ATOM 67 N NE . ARG A 1 15 ? -53.216 48.181 13.342 1.00 41.56 ? 217 ARG A NE 1
|
|
ATOM 68 C CZ . ARG A 1 15 ? -53.959 49.195 13.760 1.00 62.60 ? 217 ARG A CZ 1
|
|
ATOM 69 N NH1 . ARG A 1 15 ? -53.681 49.800 14.902 1.00 58.64 ? 217 ARG A NH1 1
|
|
ATOM 70 N NH2 . ARG A 1 15 ? -54.989 49.617 13.035 1.00 60.43 ? 217 ARG A NH2 1
|
|
ATOM 71 N N . ASP A 1 16 ? -48.319 51.043 11.871 1.00 52.59 ? 218 ASP A N 1
|
|
ATOM 72 C CA . ASP A 1 16 ? -48.052 52.299 11.172 1.00 52.41 ? 218 ASP A CA 1
|
|
ATOM 73 C C . ASP A 1 16 ? -47.153 52.114 9.960 1.00 55.69 ? 218 ASP A C 1
|
|
ATOM 74 O O . ASP A 1 16 ? -47.387 52.748 8.942 1.00 56.51 ? 218 ASP A O 1
|
|
ATOM 75 C CB . ASP A 1 16 ? -47.390 53.322 12.115 1.00 55.62 ? 218 ASP A CB 1
|
|
ATOM 76 C CG . ASP A 1 16 ? -47.379 54.715 11.525 1.00 68.06 ? 218 ASP A CG 1
|
|
ATOM 77 O OD1 . ASP A 1 16 ? -48.440 55.378 11.557 1.00 69.68 ? 218 ASP A OD1 1
|
|
ATOM 78 O OD2 . ASP A 1 16 ? -46.347 55.095 10.914 1.00 75.10 ? 218 ASP A OD2 1
|
|
ATOM 79 N N . GLU A 1 17 ? -46.123 51.269 10.084 1.00 51.95 ? 219 GLU A N 1
|
|
ATOM 80 C CA . GLU A 1 17 ? -45.115 51.009 9.070 1.00 51.50 ? 219 GLU A CA 1
|
|
ATOM 81 C C . GLU A 1 17 ? -45.252 49.770 8.183 1.00 54.73 ? 219 GLU A C 1
|
|
ATOM 82 O O . GLU A 1 17 ? -44.737 49.795 7.067 1.00 54.06 ? 219 GLU A O 1
|
|
ATOM 83 C CB . GLU A 1 17 ? -43.765 50.968 9.737 1.00 53.62 ? 219 GLU A CB 1
|
|
ATOM 84 C CG . GLU A 1 17 ? -43.057 52.290 9.691 1.00 60.97 ? 219 GLU A CG 1
|
|
ATOM 85 C CD . GLU A 1 17 ? -41.675 52.119 10.254 1.00 70.45 ? 219 GLU A CD 1
|
|
ATOM 86 O OE1 . GLU A 1 17 ? -40.782 51.691 9.486 1.00 51.69 ? 219 GLU A OE1 1
|
|
ATOM 87 O OE2 . GLU A 1 17 ? -41.516 52.304 11.484 1.00 71.38 ? 219 GLU A OE2 1
|
|
ATOM 88 N N . TYR A 1 18 ? -45.868 48.688 8.680 1.00 51.65 ? 220 TYR A N 1
|
|
ATOM 89 C CA . TYR A 1 18 ? -46.013 47.444 7.928 1.00 51.68 ? 220 TYR A CA 1
|
|
ATOM 90 C C . TYR A 1 18 ? -47.454 46.940 7.902 1.00 59.31 ? 220 TYR A C 1
|
|
ATOM 91 O O . TYR A 1 18 ? -48.195 47.114 8.885 1.00 58.73 ? 220 TYR A O 1
|
|
ATOM 92 C CB . TYR A 1 18 ? -45.098 46.349 8.526 1.00 53.02 ? 220 TYR A CB 1
|
|
ATOM 93 C CG . TYR A 1 18 ? -43.642 46.765 8.638 1.00 54.86 ? 220 TYR A CG 1
|
|
ATOM 94 C CD1 . TYR A 1 18 ? -42.760 46.576 7.582 1.00 55.75 ? 220 TYR A CD1 1
|
|
ATOM 95 C CD2 . TYR A 1 18 ? -43.156 47.385 9.790 1.00 56.25 ? 220 TYR A CD2 1
|
|
ATOM 96 C CE1 . TYR A 1 18 ? -41.442 47.021 7.649 1.00 56.02 ? 220 TYR A CE1 1
|
|
ATOM 97 C CE2 . TYR A 1 18 ? -41.840 47.839 9.868 1.00 57.02 ? 220 TYR A CE2 1
|
|
ATOM 98 C CZ . TYR A 1 18 ? -40.978 47.638 8.800 1.00 63.01 ? 220 TYR A CZ 1
|
|
ATOM 99 O OH . TYR A 1 18 ? -39.658 48.039 8.867 1.00 61.74 ? 220 TYR A OH 1
|
|
ATOM 100 N N . ILE A 1 19 ? -47.837 46.289 6.769 1.00 58.01 ? 221 ILE A N 1
|
|
ATOM 101 C CA . ILE A 1 19 ? -49.123 45.615 6.582 1.00 59.04 ? 221 ILE A CA 1
|
|
ATOM 102 C C . ILE A 1 19 ? -48.854 44.137 6.819 1.00 68.87 ? 221 ILE A C 1
|
|
ATOM 103 O O . ILE A 1 19 ? -48.359 43.460 5.921 1.00 69.40 ? 221 ILE A O 1
|
|
ATOM 104 C CB . ILE A 1 19 ? -49.802 45.834 5.207 1.00 61.60 ? 221 ILE A CB 1
|
|
ATOM 105 C CG1 . ILE A 1 19 ? -49.770 47.291 4.753 1.00 60.49 ? 221 ILE A CG1 1
|
|
ATOM 106 C CG2 . ILE A 1 19 ? -51.238 45.288 5.247 1.00 63.53 ? 221 ILE A CG2 1
|
|
ATOM 107 C CD1 . ILE A 1 19 ? -50.594 47.536 3.507 1.00 60.65 ? 221 ILE A CD1 1
|
|
ATOM 108 N N . MET A 1 20 ? -49.146 43.652 8.036 1.00 70.63 ? 222 MET A N 1
|
|
ATOM 109 C CA . MET A 1 20 ? -48.907 42.267 8.462 1.00 73.59 ? 222 MET A CA 1
|
|
ATOM 110 C C . MET A 1 20 ? -49.726 41.221 7.693 1.00 80.16 ? 222 MET A C 1
|
|
ATOM 111 O O . MET A 1 20 ? -50.939 41.394 7.495 1.00 79.83 ? 222 MET A O 1
|
|
ATOM 112 C CB . MET A 1 20 ? -49.108 42.123 9.968 1.00 77.77 ? 222 MET A CB 1
|
|
ATOM 113 C CG . MET A 1 20 ? -48.118 42.907 10.800 1.00 82.21 ? 222 MET A CG 1
|
|
ATOM 114 S SD . MET A 1 20 ? -46.427 42.263 10.728 1.00 88.13 ? 222 MET A SD 1
|
|
ATOM 115 C CE . MET A 1 20 ? -46.661 40.554 11.254 1.00 86.95 ? 222 MET A CE 1
|
|
ATOM 116 N N . SER A 1 21 ? -49.040 40.140 7.253 1.00 78.22 ? 223 SER A N 1
|
|
ATOM 117 C CA . SER A 1 21 ? -49.597 39.047 6.449 1.00 80.21 ? 223 SER A CA 1
|
|
ATOM 118 C C . SER A 1 21 ? -49.360 37.631 7.068 1.00 89.76 ? 223 SER A C 1
|
|
ATOM 119 O O . SER A 1 21 ? -49.019 37.515 8.251 1.00 90.78 ? 223 SER A O 1
|
|
ATOM 120 C CB . SER A 1 21 ? -49.069 39.136 5.016 1.00 81.04 ? 223 SER A CB 1
|
|
ATOM 121 O OG . SER A 1 21 ? -49.829 38.345 4.119 1.00 87.18 ? 223 SER A OG 1
|
|
ATOM 122 N N . LYS A 1 22 ? -49.571 36.572 6.255 1.00 89.35 ? 224 LYS A N 1
|
|
ATOM 123 C CA . LYS A 1 22 ? -49.478 35.144 6.578 1.00 91.85 ? 224 LYS A CA 1
|
|
ATOM 124 C C . LYS A 1 22 ? -48.180 34.675 7.246 1.00 96.37 ? 224 LYS A C 1
|
|
ATOM 125 O O . LYS A 1 22 ? -47.097 35.154 6.913 1.00 94.09 ? 224 LYS A O 1
|
|
ATOM 126 C CB . LYS A 1 22 ? -49.756 34.309 5.315 1.00 95.89 ? 224 LYS A CB 1
|
|
ATOM 127 N N . THR A 1 23 ? -48.304 33.690 8.156 1.00 95.62 ? 225 THR A N 1
|
|
ATOM 128 C CA . THR A 1 23 ? -47.195 33.053 8.880 1.00 95.75 ? 225 THR A CA 1
|
|
ATOM 129 C C . THR A 1 23 ? -46.237 32.274 7.943 1.00 98.60 ? 225 THR A C 1
|
|
ATOM 130 O O . THR A 1 23 ? -46.689 31.508 7.090 1.00 99.49 ? 225 THR A O 1
|
|
ATOM 131 C CB . THR A 1 23 ? -47.732 32.195 10.054 1.00 106.92 ? 225 THR A CB 1
|
|
ATOM 132 O OG1 . THR A 1 23 ? -46.658 31.450 10.632 1.00 105.72 ? 225 THR A OG1 1
|
|
ATOM 133 C CG2 . THR A 1 23 ? -48.865 31.242 9.641 1.00 108.81 ? 225 THR A CG2 1
|
|
ATOM 134 N N . LEU A 1 24 ? -44.918 32.477 8.113 1.00 93.09 ? 226 LEU A N 1
|
|
ATOM 135 C CA . LEU A 1 24 ? -43.877 31.808 7.317 1.00 92.37 ? 226 LEU A CA 1
|
|
ATOM 136 C C . LEU A 1 24 ? -43.283 30.596 8.052 1.00 99.66 ? 226 LEU A C 1
|
|
ATOM 137 O O . LEU A 1 24 ? -42.957 29.588 7.414 1.00 100.39 ? 226 LEU A O 1
|
|
ATOM 138 C CB . LEU A 1 24 ? -42.749 32.787 6.930 1.00 88.94 ? 226 LEU A CB 1
|
|
ATOM 139 C CG . LEU A 1 24 ? -43.130 34.054 6.160 1.00 90.75 ? 226 LEU A CG 1
|
|
ATOM 140 C CD1 . LEU A 1 24 ? -42.080 35.113 6.340 1.00 88.30 ? 226 LEU A CD1 1
|
|
ATOM 141 C CD2 . LEU A 1 24 ? -43.368 33.771 4.690 1.00 91.52 ? 226 LEU A CD2 1
|
|
ATOM 142 N N . GLY A 1 25 ? -43.140 30.723 9.375 1.00 97.51 ? 227 GLY A N 1
|
|
ATOM 143 C CA . GLY A 1 25 ? -42.602 29.692 10.259 1.00 129.87 ? 227 GLY A CA 1
|
|
ATOM 144 C C . GLY A 1 25 ? -42.248 30.217 11.636 1.00 143.53 ? 227 GLY A C 1
|
|
ATOM 145 O O . GLY A 1 25 ? -43.015 30.063 12.587 1.00 99.84 ? 227 GLY A O 1
|
|
ATOM 146 N N . GLY A 1 30 ? -39.872 30.778 18.181 1.00 112.70 ? 232 GLY A N 1
|
|
ATOM 147 C CA . GLY A 1 30 ? -40.087 32.055 17.515 1.00 108.90 ? 232 GLY A CA 1
|
|
ATOM 148 C C . GLY A 1 30 ? -41.001 31.971 16.304 1.00 110.86 ? 232 GLY A C 1
|
|
ATOM 149 O O . GLY A 1 30 ? -40.796 31.114 15.435 1.00 111.17 ? 232 GLY A O 1
|
|
ATOM 150 N N . GLU A 1 31 ? -42.027 32.871 16.243 1.00 104.09 ? 233 GLU A N 1
|
|
ATOM 151 C CA . GLU A 1 31 ? -43.008 32.976 15.148 1.00 100.82 ? 233 GLU A CA 1
|
|
ATOM 152 C C . GLU A 1 31 ? -42.534 34.008 14.118 1.00 97.07 ? 233 GLU A C 1
|
|
ATOM 153 O O . GLU A 1 31 ? -42.142 35.113 14.502 1.00 95.21 ? 233 GLU A O 1
|
|
ATOM 154 C CB . GLU A 1 31 ? -44.403 33.336 15.686 1.00 103.26 ? 233 GLU A CB 1
|
|
ATOM 155 N N . VAL A 1 32 ? -42.536 33.635 12.818 1.00 88.95 ? 234 VAL A N 1
|
|
ATOM 156 C CA . VAL A 1 32 ? -42.082 34.498 11.713 1.00 83.71 ? 234 VAL A CA 1
|
|
ATOM 157 C C . VAL A 1 32 ? -43.238 34.747 10.739 1.00 83.84 ? 234 VAL A C 1
|
|
ATOM 158 O O . VAL A 1 32 ? -43.806 33.803 10.195 1.00 84.98 ? 234 VAL A O 1
|
|
ATOM 159 C CB . VAL A 1 32 ? -40.792 33.937 11.024 1.00 85.73 ? 234 VAL A CB 1
|
|
ATOM 160 C CG1 . VAL A 1 32 ? -40.485 34.647 9.716 1.00 82.96 ? 234 VAL A CG1 1
|
|
ATOM 161 C CG2 . VAL A 1 32 ? -39.588 34.026 11.953 1.00 85.38 ? 234 VAL A CG2 1
|
|
ATOM 162 N N . LYS A 1 33 ? -43.601 36.012 10.543 1.00 76.29 ? 235 LYS A N 1
|
|
ATOM 163 C CA . LYS A 1 33 ? -44.693 36.351 9.637 1.00 74.70 ? 235 LYS A CA 1
|
|
ATOM 164 C C . LYS A 1 33 ? -44.211 37.206 8.487 1.00 73.01 ? 235 LYS A C 1
|
|
ATOM 165 O O . LYS A 1 33 ? -43.252 37.959 8.630 1.00 70.97 ? 235 LYS A O 1
|
|
ATOM 166 C CB . LYS A 1 33 ? -45.852 37.060 10.380 1.00 77.68 ? 235 LYS A CB 1
|
|
ATOM 167 C CG . LYS A 1 33 ? -46.619 36.155 11.338 1.00 94.52 ? 235 LYS A CG 1
|
|
ATOM 168 C CD . LYS A 1 33 ? -48.118 36.355 11.234 1.00 102.95 ? 235 LYS A CD 1
|
|
ATOM 169 N N . LEU A 1 34 ? -44.883 37.082 7.346 1.00 68.19 ? 236 LEU A N 1
|
|
ATOM 170 C CA . LEU A 1 34 ? -44.670 37.895 6.153 1.00 66.00 ? 236 LEU A CA 1
|
|
ATOM 171 C C . LEU A 1 34 ? -45.355 39.255 6.420 1.00 67.98 ? 236 LEU A C 1
|
|
ATOM 172 O O . LEU A 1 34 ? -46.367 39.305 7.111 1.00 68.31 ? 236 LEU A O 1
|
|
ATOM 173 C CB . LEU A 1 34 ? -45.330 37.191 4.942 1.00 67.06 ? 236 LEU A CB 1
|
|
ATOM 174 C CG . LEU A 1 34 ? -45.456 37.945 3.608 1.00 70.25 ? 236 LEU A CG 1
|
|
ATOM 175 C CD1 . LEU A 1 34 ? -44.124 38.017 2.887 1.00 69.80 ? 236 LEU A CD1 1
|
|
ATOM 176 C CD2 . LEU A 1 34 ? -46.469 37.285 2.721 1.00 72.70 ? 236 LEU A CD2 1
|
|
ATOM 177 N N . ALA A 1 35 ? -44.786 40.344 5.904 1.00 62.43 ? 237 ALA A N 1
|
|
ATOM 178 C CA . ALA A 1 35 ? -45.333 41.688 6.045 1.00 61.32 ? 237 ALA A CA 1
|
|
ATOM 179 C C . ALA A 1 35 ? -44.864 42.510 4.857 1.00 64.35 ? 237 ALA A C 1
|
|
ATOM 180 O O . ALA A 1 35 ? -43.919 42.104 4.168 1.00 65.36 ? 237 ALA A O 1
|
|
ATOM 181 C CB . ALA A 1 35 ? -44.857 42.321 7.354 1.00 61.58 ? 237 ALA A CB 1
|
|
ATOM 182 N N . PHE A 1 36 ? -45.513 43.656 4.615 1.00 59.05 ? 238 PHE A N 1
|
|
ATOM 183 C CA . PHE A 1 36 ? -45.141 44.562 3.541 1.00 58.54 ? 238 PHE A CA 1
|
|
ATOM 184 C C . PHE A 1 36 ? -44.831 45.961 4.066 1.00 62.07 ? 238 PHE A C 1
|
|
ATOM 185 O O . PHE A 1 36 ? -45.699 46.613 4.652 1.00 61.50 ? 238 PHE A O 1
|
|
ATOM 186 C CB . PHE A 1 36 ? -46.231 44.641 2.472 1.00 61.53 ? 238 PHE A CB 1
|
|
ATOM 187 C CG . PHE A 1 36 ? -46.705 43.308 1.960 1.00 65.06 ? 238 PHE A CG 1
|
|
ATOM 188 C CD1 . PHE A 1 36 ? -46.061 42.684 0.899 1.00 68.89 ? 238 PHE A CD1 1
|
|
ATOM 189 C CD2 . PHE A 1 36 ? -47.809 42.680 2.528 1.00 68.57 ? 238 PHE A CD2 1
|
|
ATOM 190 C CE1 . PHE A 1 36 ? -46.515 41.454 0.415 1.00 71.55 ? 238 PHE A CE1 1
|
|
ATOM 191 C CE2 . PHE A 1 36 ? -48.243 41.440 2.059 1.00 73.12 ? 238 PHE A CE2 1
|
|
ATOM 192 C CZ . PHE A 1 36 ? -47.592 40.835 1.006 1.00 71.62 ? 238 PHE A CZ 1
|
|
ATOM 193 N N . GLU A 1 37 ? -43.596 46.434 3.838 1.00 57.77 ? 239 GLU A N 1
|
|
ATOM 194 C CA . GLU A 1 37 ? -43.221 47.779 4.227 1.00 56.59 ? 239 GLU A CA 1
|
|
ATOM 195 C C . GLU A 1 37 ? -44.102 48.704 3.392 1.00 58.50 ? 239 GLU A C 1
|
|
ATOM 196 O O . GLU A 1 37 ? -44.127 48.568 2.168 1.00 59.17 ? 239 GLU A O 1
|
|
ATOM 197 C CB . GLU A 1 37 ? -41.726 48.011 3.962 1.00 58.01 ? 239 GLU A CB 1
|
|
ATOM 198 C CG . GLU A 1 37 ? -41.152 49.205 4.712 1.00 69.47 ? 239 GLU A CG 1
|
|
ATOM 199 C CD . GLU A 1 37 ? -39.748 49.616 4.314 1.00 96.21 ? 239 GLU A CD 1
|
|
ATOM 200 O OE1 . GLU A 1 37 ? -39.010 48.779 3.741 1.00 98.14 ? 239 GLU A OE1 1
|
|
ATOM 201 O OE2 . GLU A 1 37 ? -39.383 50.782 4.588 1.00 90.88 ? 239 GLU A OE2 1
|
|
ATOM 202 N N . ARG A 1 38 ? -44.898 49.564 4.058 1.00 53.42 ? 240 ARG A N 1
|
|
ATOM 203 C CA . ARG A 1 38 ? -45.854 50.503 3.427 1.00 52.87 ? 240 ARG A CA 1
|
|
ATOM 204 C C . ARG A 1 38 ? -45.173 51.514 2.492 1.00 59.91 ? 240 ARG A C 1
|
|
ATOM 205 O O . ARG A 1 38 ? -45.779 51.917 1.493 1.00 62.98 ? 240 ARG A O 1
|
|
ATOM 206 C CB . ARG A 1 38 ? -46.659 51.277 4.489 1.00 48.87 ? 240 ARG A CB 1
|
|
ATOM 207 C CG . ARG A 1 38 ? -47.540 50.440 5.394 1.00 49.52 ? 240 ARG A CG 1
|
|
ATOM 208 C CD . ARG A 1 38 ? -48.368 51.319 6.314 1.00 50.51 ? 240 ARG A CD 1
|
|
ATOM 209 N NE . ARG A 1 38 ? -49.110 50.527 7.304 1.00 55.11 ? 240 ARG A NE 1
|
|
ATOM 210 C CZ . ARG A 1 38 ? -50.323 50.018 7.108 1.00 61.18 ? 240 ARG A CZ 1
|
|
ATOM 211 N NH1 . ARG A 1 38 ? -50.952 50.211 5.961 1.00 47.72 ? 240 ARG A NH1 1
|
|
ATOM 212 N NH2 . ARG A 1 38 ? -50.910 49.303 8.055 1.00 45.91 ? 240 ARG A NH2 1
|
|
ATOM 213 N N . LYS A 1 39 ? -43.939 51.958 2.850 1.00 53.87 ? 241 LYS A N 1
|
|
ATOM 214 C CA . LYS A 1 39 ? -43.154 52.944 2.121 1.00 53.67 ? 241 LYS A CA 1
|
|
ATOM 215 C C . LYS A 1 39 ? -42.724 52.418 0.747 1.00 58.03 ? 241 LYS A C 1
|
|
ATOM 216 O O . LYS A 1 39 ? -42.780 53.137 -0.254 1.00 57.98 ? 241 LYS A O 1
|
|
ATOM 217 C CB . LYS A 1 39 ? -41.917 53.300 2.967 1.00 56.44 ? 241 LYS A CB 1
|
|
ATOM 218 C CG . LYS A 1 39 ? -41.126 54.521 2.485 1.00 69.87 ? 241 LYS A CG 1
|
|
ATOM 219 N N . THR A 1 40 ? -42.288 51.157 0.719 1.00 54.89 ? 242 THR A N 1
|
|
ATOM 220 C CA . THR A 1 40 ? -41.690 50.504 -0.428 1.00 55.08 ? 242 THR A CA 1
|
|
ATOM 221 C C . THR A 1 40 ? -42.573 49.495 -1.131 1.00 61.18 ? 242 THR A C 1
|
|
ATOM 222 O O . THR A 1 40 ? -42.294 49.170 -2.288 1.00 62.42 ? 242 THR A O 1
|
|
ATOM 223 C CB . THR A 1 40 ? -40.374 49.852 0.026 1.00 61.55 ? 242 THR A CB 1
|
|
ATOM 224 O OG1 . THR A 1 40 ? -40.647 48.748 0.904 1.00 62.02 ? 242 THR A OG1 1
|
|
ATOM 225 C CG2 . THR A 1 40 ? -39.442 50.834 0.701 1.00 55.10 ? 242 THR A CG2 1
|
|
ATOM 226 N N . CYS A 1 41 ? -43.611 48.969 -0.432 1.00 58.52 ? 243 CYS A N 1
|
|
ATOM 227 C CA . CYS A 1 41 ? -44.541 47.933 -0.912 1.00 58.99 ? 243 CYS A CA 1
|
|
ATOM 228 C C . CYS A 1 41 ? -43.795 46.621 -1.101 1.00 68.82 ? 243 CYS A C 1
|
|
ATOM 229 O O . CYS A 1 41 ? -44.246 45.735 -1.835 1.00 72.74 ? 243 CYS A O 1
|
|
ATOM 230 C CB . CYS A 1 41 ? -45.266 48.364 -2.181 1.00 59.55 ? 243 CYS A CB 1
|
|
ATOM 231 S SG . CYS A 1 41 ? -46.553 49.587 -1.894 1.00 63.30 ? 243 CYS A SG 1
|
|
ATOM 232 N N . LYS A 1 42 ? -42.638 46.516 -0.447 1.00 63.91 ? 244 LYS A N 1
|
|
ATOM 233 C CA . LYS A 1 42 ? -41.764 45.370 -0.544 1.00 63.40 ? 244 LYS A CA 1
|
|
ATOM 234 C C . LYS A 1 42 ? -41.984 44.433 0.611 1.00 64.16 ? 244 LYS A C 1
|
|
ATOM 235 O O . LYS A 1 42 ? -42.333 44.865 1.714 1.00 62.47 ? 244 LYS A O 1
|
|
ATOM 236 C CB . LYS A 1 42 ? -40.291 45.812 -0.653 1.00 66.68 ? 244 LYS A CB 1
|
|
ATOM 237 C CG . LYS A 1 42 ? -39.984 46.626 -1.918 1.00 79.80 ? 244 LYS A CG 1
|
|
ATOM 238 C CD . LYS A 1 42 ? -39.448 45.794 -3.089 1.00 81.72 ? 244 LYS A CD 1
|
|
ATOM 239 C CE . LYS A 1 42 ? -38.553 46.607 -4.004 1.00 81.55 ? 244 LYS A CE 1
|
|
ATOM 240 N NZ . LYS A 1 42 ? -37.490 47.361 -3.259 1.00 77.22 ? 244 LYS A NZ 1
|
|
ATOM 241 N N . LYS A 1 43 ? -41.799 43.138 0.334 1.00 60.37 ? 245 LYS A N 1
|
|
ATOM 242 C CA . LYS A 1 43 ? -41.978 42.046 1.274 1.00 59.89 ? 245 LYS A CA 1
|
|
ATOM 243 C C . LYS A 1 43 ? -40.854 42.031 2.297 1.00 65.48 ? 245 LYS A C 1
|
|
ATOM 244 O O . LYS A 1 43 ? -39.674 42.237 1.947 1.00 65.46 ? 245 LYS A O 1
|
|
ATOM 245 C CB . LYS A 1 43 ? -42.049 40.710 0.511 1.00 62.16 ? 245 LYS A CB 1
|
|
ATOM 246 C CG . LYS A 1 43 ? -43.450 40.358 0.006 1.00 66.63 ? 245 LYS A CG 1
|
|
ATOM 247 C CD . LYS A 1 43 ? -43.478 39.277 -1.057 1.00 69.42 ? 245 LYS A CD 1
|
|
ATOM 248 N N . VAL A 1 44 ? -41.227 41.802 3.577 1.00 61.42 ? 246 VAL A N 1
|
|
ATOM 249 C CA . VAL A 1 44 ? -40.283 41.665 4.710 1.00 59.98 ? 246 VAL A CA 1
|
|
ATOM 250 C C . VAL A 1 44 ? -40.701 40.462 5.553 1.00 62.25 ? 246 VAL A C 1
|
|
ATOM 251 O O . VAL A 1 44 ? -41.806 39.948 5.384 1.00 63.42 ? 246 VAL A O 1
|
|
ATOM 252 C CB . VAL A 1 44 ? -40.122 42.964 5.577 1.00 63.69 ? 246 VAL A CB 1
|
|
ATOM 253 C CG1 . VAL A 1 44 ? -39.510 44.116 4.775 1.00 62.76 ? 246 VAL A CG1 1
|
|
ATOM 254 C CG2 . VAL A 1 44 ? -41.438 43.388 6.251 1.00 63.81 ? 246 VAL A CG2 1
|
|
ATOM 255 N N . ALA A 1 45 ? -39.831 40.001 6.437 1.00 58.42 ? 247 ALA A N 1
|
|
ATOM 256 C CA . ALA A 1 45 ? -40.161 38.920 7.377 1.00 59.35 ? 247 ALA A CA 1
|
|
ATOM 257 C C . ALA A 1 45 ? -40.091 39.529 8.779 1.00 64.06 ? 247 ALA A C 1
|
|
ATOM 258 O O . ALA A 1 45 ? -39.115 40.233 9.090 1.00 63.28 ? 247 ALA A O 1
|
|
ATOM 259 C CB . ALA A 1 45 ? -39.178 37.772 7.246 1.00 60.04 ? 247 ALA A CB 1
|
|
ATOM 260 N N . ILE A 1 46 ? -41.150 39.352 9.586 1.00 61.05 ? 248 ILE A N 1
|
|
ATOM 261 C CA . ILE A 1 46 ? -41.154 39.891 10.939 1.00 62.11 ? 248 ILE A CA 1
|
|
ATOM 262 C C . ILE A 1 46 ? -41.174 38.767 11.949 1.00 69.96 ? 248 ILE A C 1
|
|
ATOM 263 O O . ILE A 1 46 ? -42.155 38.011 11.999 1.00 72.49 ? 248 ILE A O 1
|
|
ATOM 264 C CB . ILE A 1 46 ? -42.239 40.981 11.198 1.00 65.24 ? 248 ILE A CB 1
|
|
ATOM 265 C CG1 . ILE A 1 46 ? -42.082 42.152 10.196 1.00 63.29 ? 248 ILE A CG1 1
|
|
ATOM 266 C CG2 . ILE A 1 46 ? -42.191 41.476 12.685 1.00 66.71 ? 248 ILE A CG2 1
|
|
ATOM 267 C CD1 . ILE A 1 46 ? -43.046 43.215 10.342 1.00 66.62 ? 248 ILE A CD1 1
|
|
ATOM 268 N N . LYS A 1 47 ? -40.072 38.643 12.732 1.00 66.30 ? 249 LYS A N 1
|
|
ATOM 269 C CA . LYS A 1 47 ? -39.897 37.640 13.789 1.00 67.50 ? 249 LYS A CA 1
|
|
ATOM 270 C C . LYS A 1 47 ? -40.412 38.217 15.106 1.00 73.40 ? 249 LYS A C 1
|
|
ATOM 271 O O . LYS A 1 47 ? -39.933 39.250 15.578 1.00 72.08 ? 249 LYS A O 1
|
|
ATOM 272 C CB . LYS A 1 47 ? -38.423 37.188 13.909 1.00 69.17 ? 249 LYS A CB 1
|
|
ATOM 273 C CG . LYS A 1 47 ? -38.167 36.019 14.881 1.00 79.21 ? 249 LYS A CG 1
|
|
ATOM 274 N N . ILE A 1 48 ? -41.425 37.554 15.663 1.00 73.26 ? 250 ILE A N 1
|
|
ATOM 275 C CA . ILE A 1 48 ? -42.074 37.870 16.937 1.00 75.22 ? 250 ILE A CA 1
|
|
ATOM 276 C C . ILE A 1 48 ? -41.437 36.972 18.035 1.00 83.63 ? 250 ILE A C 1
|
|
ATOM 277 O O . ILE A 1 48 ? -41.303 35.760 17.843 1.00 83.80 ? 250 ILE A O 1
|
|
ATOM 278 C CB . ILE A 1 48 ? -43.629 37.679 16.845 1.00 78.06 ? 250 ILE A CB 1
|
|
ATOM 279 C CG1 . ILE A 1 48 ? -44.224 38.442 15.641 1.00 75.47 ? 250 ILE A CG1 1
|
|
ATOM 280 C CG2 . ILE A 1 48 ? -44.338 38.071 18.151 1.00 79.02 ? 250 ILE A CG2 1
|
|
ATOM 281 C CD1 . ILE A 1 48 ? -44.557 37.602 14.454 1.00 79.21 ? 250 ILE A CD1 1
|
|
ATOM 282 N N . ILE A 1 49 ? -41.014 37.591 19.154 1.00 82.69 ? 251 ILE A N 1
|
|
ATOM 283 C CA . ILE A 1 49 ? -40.435 36.934 20.333 1.00 85.76 ? 251 ILE A CA 1
|
|
ATOM 284 C C . ILE A 1 49 ? -41.268 37.404 21.513 1.00 91.90 ? 251 ILE A C 1
|
|
ATOM 285 O O . ILE A 1 49 ? -41.316 38.606 21.777 1.00 90.80 ? 251 ILE A O 1
|
|
ATOM 286 C CB . ILE A 1 49 ? -38.910 37.253 20.543 1.00 88.17 ? 251 ILE A CB 1
|
|
ATOM 287 C CG1 . ILE A 1 49 ? -38.046 36.798 19.365 1.00 85.83 ? 251 ILE A CG1 1
|
|
ATOM 288 C CG2 . ILE A 1 49 ? -38.384 36.657 21.832 1.00 91.62 ? 251 ILE A CG2 1
|
|
ATOM 289 C CD1 . ILE A 1 49 ? -37.548 37.914 18.573 1.00 89.18 ? 251 ILE A CD1 1
|
|
ATOM 290 N N . SER A 1 50 ? -41.936 36.469 22.206 1.00 91.80 ? 252 SER A N 1
|
|
ATOM 291 C CA . SER A 1 50 ? -42.756 36.789 23.379 1.00 94.07 ? 252 SER A CA 1
|
|
ATOM 292 C C . SER A 1 50 ? -41.866 37.130 24.571 1.00 98.41 ? 252 SER A C 1
|
|
ATOM 293 O O . SER A 1 50 ? -40.780 36.557 24.723 1.00 98.14 ? 252 SER A O 1
|
|
ATOM 294 C CB . SER A 1 50 ? -43.686 35.631 23.724 1.00 100.96 ? 252 SER A CB 1
|
|
ATOM 295 N N . LYS A 1 51 ? -42.323 38.075 25.400 1.00 95.85 ? 253 LYS A N 1
|
|
ATOM 296 C CA . LYS A 1 51 ? -41.591 38.523 26.586 1.00 110.48 ? 253 LYS A CA 1
|
|
ATOM 297 C C . LYS A 1 51 ? -41.877 37.651 27.809 1.00 138.55 ? 253 LYS A C 1
|
|
ATOM 298 O O . LYS A 1 51 ? -41.255 36.600 27.978 1.00 102.56 ? 253 LYS A O 1
|
|
ATOM 299 C CB . LYS A 1 51 ? -41.879 39.999 26.872 1.00 111.56 ? 253 LYS A CB 1
|
|
ATOM 300 C CG . LYS A 1 51 ? -41.354 40.928 25.786 1.00 111.96 ? 253 LYS A CG 1
|
|
ATOM 301 C CD . LYS A 1 51 ? -41.708 42.352 26.097 1.00 119.31 ? 253 LYS A CD 1
|
|
ATOM 302 C CE . LYS A 1 51 ? -40.648 43.304 25.631 1.00 125.03 ? 253 LYS A CE 1
|
|
ATOM 303 N NZ . LYS A 1 51 ? -40.993 44.706 25.982 1.00 131.69 ? 253 LYS A NZ 1
|
|
ATOM 304 N N . ASN A 1 67 ? -31.211 39.534 26.284 1.00 110.13 ? 269 ASN A N 1
|
|
ATOM 305 C CA . ASN A 1 67 ? -30.808 38.538 25.288 1.00 107.23 ? 269 ASN A CA 1
|
|
ATOM 306 C C . ASN A 1 67 ? -31.285 38.894 23.859 1.00 108.13 ? 269 ASN A C 1
|
|
ATOM 307 O O . ASN A 1 67 ? -30.620 38.535 22.875 1.00 105.64 ? 269 ASN A O 1
|
|
ATOM 308 C CB . ASN A 1 67 ? -31.305 37.148 25.693 1.00 108.70 ? 269 ASN A CB 1
|
|
ATOM 309 C CG . ASN A 1 67 ? -30.515 36.008 25.094 1.00 131.13 ? 269 ASN A CG 1
|
|
ATOM 310 O OD1 . ASN A 1 67 ? -29.359 35.750 25.462 1.00 123.63 ? 269 ASN A OD1 1
|
|
ATOM 311 N ND2 . ASN A 1 67 ? -31.139 35.275 24.183 1.00 123.99 ? 269 ASN A ND2 1
|
|
ATOM 312 N N . VAL A 1 68 ? -32.452 39.571 23.749 1.00 103.57 ? 270 VAL A N 1
|
|
ATOM 313 C CA . VAL A 1 68 ? -33.008 39.999 22.460 1.00 98.82 ? 270 VAL A CA 1
|
|
ATOM 314 C C . VAL A 1 68 ? -32.282 41.286 22.074 1.00 102.55 ? 270 VAL A C 1
|
|
ATOM 315 O O . VAL A 1 68 ? -31.925 41.453 20.906 1.00 99.60 ? 270 VAL A O 1
|
|
ATOM 316 C CB . VAL A 1 68 ? -34.559 40.117 22.452 1.00 101.52 ? 270 VAL A CB 1
|
|
ATOM 317 C CG1 . VAL A 1 68 ? -35.082 40.550 21.088 1.00 97.40 ? 270 VAL A CG1 1
|
|
ATOM 318 C CG2 . VAL A 1 68 ? -35.206 38.797 22.854 1.00 102.96 ? 270 VAL A CG2 1
|
|
ATOM 319 N N . GLU A 1 69 ? -31.973 42.141 23.076 1.00 101.71 ? 271 GLU A N 1
|
|
ATOM 320 C CA . GLU A 1 69 ? -31.216 43.381 22.883 1.00 101.19 ? 271 GLU A CA 1
|
|
ATOM 321 C C . GLU A 1 69 ? -29.797 43.055 22.365 1.00 102.35 ? 271 GLU A C 1
|
|
ATOM 322 O O . GLU A 1 69 ? -29.346 43.688 21.400 1.00 100.30 ? 271 GLU A O 1
|
|
ATOM 323 C CB . GLU A 1 69 ? -31.161 44.196 24.186 1.00 106.69 ? 271 GLU A CB 1
|
|
ATOM 324 N N . THR A 1 70 ? -29.133 42.028 22.968 1.00 97.43 ? 272 THR A N 1
|
|
ATOM 325 C CA . THR A 1 70 ? -27.803 41.542 22.571 1.00 94.88 ? 272 THR A CA 1
|
|
ATOM 326 C C . THR A 1 70 ? -27.822 40.989 21.140 1.00 90.63 ? 272 THR A C 1
|
|
ATOM 327 O O . THR A 1 70 ? -26.856 41.178 20.394 1.00 89.05 ? 272 THR A O 1
|
|
ATOM 328 C CB . THR A 1 70 ? -27.287 40.487 23.565 1.00 104.82 ? 272 THR A CB 1
|
|
ATOM 329 N N . GLU A 1 71 ? -28.925 40.308 20.764 1.00 81.88 ? 273 GLU A N 1
|
|
ATOM 330 C CA . GLU A 1 71 ? -29.120 39.746 19.432 1.00 76.21 ? 273 GLU A CA 1
|
|
ATOM 331 C C . GLU A 1 71 ? -29.214 40.883 18.405 1.00 75.17 ? 273 GLU A C 1
|
|
ATOM 332 O O . GLU A 1 71 ? -28.626 40.763 17.335 1.00 72.44 ? 273 GLU A O 1
|
|
ATOM 333 C CB . GLU A 1 71 ? -30.368 38.843 19.405 1.00 77.36 ? 273 GLU A CB 1
|
|
ATOM 334 C CG . GLU A 1 71 ? -30.574 38.119 18.085 1.00 85.05 ? 273 GLU A CG 1
|
|
ATOM 335 C CD . GLU A 1 71 ? -31.841 37.306 17.888 1.00 112.50 ? 273 GLU A CD 1
|
|
ATOM 336 O OE1 . GLU A 1 71 ? -32.457 36.890 18.899 1.00 108.51 ? 273 GLU A OE1 1
|
|
ATOM 337 O OE2 . GLU A 1 71 ? -32.195 37.053 16.710 1.00 100.64 ? 273 GLU A OE2 1
|
|
ATOM 338 N N . ILE A 1 72 ? -29.938 41.987 18.737 1.00 71.20 ? 274 ILE A N 1
|
|
ATOM 339 C CA . ILE A 1 72 ? -30.113 43.171 17.882 1.00 68.58 ? 274 ILE A CA 1
|
|
ATOM 340 C C . ILE A 1 72 ? -28.798 43.899 17.714 1.00 71.42 ? 274 ILE A C 1
|
|
ATOM 341 O O . ILE A 1 72 ? -28.444 44.268 16.604 1.00 67.52 ? 274 ILE A O 1
|
|
ATOM 342 C CB . ILE A 1 72 ? -31.286 44.077 18.386 1.00 73.03 ? 274 ILE A CB 1
|
|
ATOM 343 C CG1 . ILE A 1 72 ? -32.620 43.556 17.864 1.00 72.43 ? 274 ILE A CG1 1
|
|
ATOM 344 C CG2 . ILE A 1 72 ? -31.148 45.545 17.981 1.00 72.78 ? 274 ILE A CG2 1
|
|
ATOM 345 C CD1 . ILE A 1 72 ? -33.291 42.761 18.772 1.00 83.76 ? 274 ILE A CD1 1
|
|
ATOM 346 N N . GLU A 1 73 ? -28.064 44.062 18.818 1.00 74.05 ? 275 GLU A N 1
|
|
ATOM 347 C CA . GLU A 1 73 ? -26.746 44.692 18.894 1.00 75.82 ? 275 GLU A CA 1
|
|
ATOM 348 C C . GLU A 1 73 ? -25.741 43.962 17.994 1.00 79.11 ? 275 GLU A C 1
|
|
ATOM 349 O O . GLU A 1 73 ? -25.012 44.629 17.256 1.00 78.27 ? 275 GLU A O 1
|
|
ATOM 350 C CB . GLU A 1 73 ? -26.261 44.766 20.355 1.00 80.87 ? 275 GLU A CB 1
|
|
ATOM 351 N N . ILE A 1 74 ? -25.746 42.602 18.001 1.00 75.90 ? 276 ILE A N 1
|
|
ATOM 352 C CA . ILE A 1 74 ? -24.873 41.811 17.130 1.00 74.42 ? 276 ILE A CA 1
|
|
ATOM 353 C C . ILE A 1 74 ? -25.288 42.017 15.658 1.00 77.99 ? 276 ILE A C 1
|
|
ATOM 354 O O . ILE A 1 74 ? -24.498 42.533 14.872 1.00 77.70 ? 276 ILE A O 1
|
|
ATOM 355 C CB . ILE A 1 74 ? -24.810 40.317 17.542 1.00 77.58 ? 276 ILE A CB 1
|
|
ATOM 356 N N . LEU A 1 75 ? -26.548 41.720 15.325 1.00 74.88 ? 277 LEU A N 1
|
|
ATOM 357 C CA . LEU A 1 75 ? -27.114 41.832 13.985 1.00 73.83 ? 277 LEU A CA 1
|
|
ATOM 358 C C . LEU A 1 75 ? -27.043 43.210 13.329 1.00 77.39 ? 277 LEU A C 1
|
|
ATOM 359 O O . LEU A 1 75 ? -26.964 43.282 12.096 1.00 75.74 ? 277 LEU A O 1
|
|
ATOM 360 C CB . LEU A 1 75 ? -28.539 41.258 13.942 1.00 74.42 ? 277 LEU A CB 1
|
|
ATOM 361 C CG . LEU A 1 75 ? -28.658 39.712 13.873 1.00 80.79 ? 277 LEU A CG 1
|
|
ATOM 362 C CD1 . LEU A 1 75 ? -29.954 39.211 14.500 1.00 82.33 ? 277 LEU A CD1 1
|
|
ATOM 363 C CD2 . LEU A 1 75 ? -28.510 39.192 12.446 1.00 81.60 ? 277 LEU A CD2 1
|
|
ATOM 364 N N . LYS A 1 76 ? -27.063 44.294 14.138 1.00 75.05 ? 278 LYS A N 1
|
|
ATOM 365 C CA . LYS A 1 76 ? -26.953 45.678 13.656 1.00 74.74 ? 278 LYS A CA 1
|
|
ATOM 366 C C . LYS A 1 76 ? -25.536 45.957 13.136 1.00 80.80 ? 278 LYS A C 1
|
|
ATOM 367 O O . LYS A 1 76 ? -25.377 46.668 12.139 1.00 81.42 ? 278 LYS A O 1
|
|
ATOM 368 C CB . LYS A 1 76 ? -27.303 46.688 14.770 1.00 78.18 ? 278 LYS A CB 1
|
|
ATOM 369 C CG . LYS A 1 76 ? -28.782 47.060 14.836 1.00 83.13 ? 278 LYS A CG 1
|
|
ATOM 370 N N . LYS A 1 77 ? -24.515 45.387 13.809 1.00 77.45 ? 279 LYS A N 1
|
|
ATOM 371 C CA . LYS A 1 77 ? -23.107 45.590 13.498 1.00 77.59 ? 279 LYS A CA 1
|
|
ATOM 372 C C . LYS A 1 77 ? -22.542 44.649 12.430 1.00 80.79 ? 279 LYS A C 1
|
|
ATOM 373 O O . LYS A 1 77 ? -21.483 44.948 11.859 1.00 81.83 ? 279 LYS A O 1
|
|
ATOM 374 C CB . LYS A 1 77 ? -22.270 45.523 14.786 1.00 82.40 ? 279 LYS A CB 1
|
|
ATOM 375 N N . LEU A 1 78 ? -23.193 43.499 12.189 1.00 74.71 ? 280 LEU A N 1
|
|
ATOM 376 C CA . LEU A 1 78 ? -22.690 42.560 11.185 1.00 72.37 ? 280 LEU A CA 1
|
|
ATOM 377 C C . LEU A 1 78 ? -23.092 43.026 9.789 1.00 74.09 ? 280 LEU A C 1
|
|
ATOM 378 O O . LEU A 1 78 ? -24.118 43.692 9.618 1.00 74.19 ? 280 LEU A O 1
|
|
ATOM 379 C CB . LEU A 1 78 ? -23.148 41.114 11.440 1.00 71.77 ? 280 LEU A CB 1
|
|
ATOM 380 C CG . LEU A 1 78 ? -22.800 40.463 12.788 1.00 78.20 ? 280 LEU A CG 1
|
|
ATOM 381 C CD1 . LEU A 1 78 ? -23.577 39.187 12.964 1.00 78.19 ? 280 LEU A CD1 1
|
|
ATOM 382 C CD2 . LEU A 1 78 ? -21.310 40.159 12.917 1.00 81.11 ? 280 LEU A CD2 1
|
|
ATOM 383 N N . ASN A 1 79 ? -22.253 42.723 8.799 1.00 67.79 ? 281 ASN A N 1
|
|
ATOM 384 C CA . ASN A 1 79 ? -22.491 43.131 7.425 1.00 65.45 ? 281 ASN A CA 1
|
|
ATOM 385 C C . ASN A 1 79 ? -21.828 42.160 6.445 1.00 64.68 ? 281 ASN A C 1
|
|
ATOM 386 O O . ASN A 1 79 ? -20.664 42.329 6.057 1.00 63.50 ? 281 ASN A O 1
|
|
ATOM 387 C CB . ASN A 1 79 ? -22.053 44.588 7.204 1.00 66.23 ? 281 ASN A CB 1
|
|
ATOM 388 C CG . ASN A 1 79 ? -22.419 45.128 5.850 1.00 89.95 ? 281 ASN A CG 1
|
|
ATOM 389 O OD1 . ASN A 1 79 ? -23.412 44.729 5.241 1.00 86.80 ? 281 ASN A OD1 1
|
|
ATOM 390 N ND2 . ASN A 1 79 ? -21.624 46.059 5.348 1.00 83.70 ? 281 ASN A ND2 1
|
|
ATOM 391 N N . HIS A 1 80 ? -22.580 41.120 6.066 1.00 58.36 ? 282 HIS A N 1
|
|
ATOM 392 C CA . HIS A 1 80 ? -22.109 40.109 5.137 1.00 56.78 ? 282 HIS A CA 1
|
|
ATOM 393 C C . HIS A 1 80 ? -23.271 39.593 4.313 1.00 60.46 ? 282 HIS A C 1
|
|
ATOM 394 O O . HIS A 1 80 ? -24.387 39.507 4.825 1.00 58.13 ? 282 HIS A O 1
|
|
ATOM 395 C CB . HIS A 1 80 ? -21.439 38.987 5.899 1.00 57.76 ? 282 HIS A CB 1
|
|
ATOM 396 C CG . HIS A 1 80 ? -20.607 38.083 5.059 1.00 60.99 ? 282 HIS A CG 1
|
|
ATOM 397 N ND1 . HIS A 1 80 ? -21.141 36.944 4.487 1.00 62.50 ? 282 HIS A ND1 1
|
|
ATOM 398 C CD2 . HIS A 1 80 ? -19.282 38.124 4.798 1.00 63.14 ? 282 HIS A CD2 1
|
|
ATOM 399 C CE1 . HIS A 1 80 ? -20.130 36.334 3.886 1.00 61.58 ? 282 HIS A CE1 1
|
|
ATOM 400 N NE2 . HIS A 1 80 ? -18.991 37.003 4.043 1.00 62.10 ? 282 HIS A NE2 1
|
|
ATOM 401 N N . PRO A 1 81 ? -23.056 39.272 3.016 1.00 59.95 ? 283 PRO A N 1
|
|
ATOM 402 C CA . PRO A 1 81 ? -24.177 38.784 2.187 1.00 60.03 ? 283 PRO A CA 1
|
|
ATOM 403 C C . PRO A 1 81 ? -24.756 37.424 2.606 1.00 64.31 ? 283 PRO A C 1
|
|
ATOM 404 O O . PRO A 1 81 ? -25.840 37.060 2.136 1.00 65.48 ? 283 PRO A O 1
|
|
ATOM 405 C CB . PRO A 1 81 ? -23.569 38.738 0.783 1.00 61.71 ? 283 PRO A CB 1
|
|
ATOM 406 C CG . PRO A 1 81 ? -22.115 38.518 1.017 1.00 65.91 ? 283 PRO A CG 1
|
|
ATOM 407 C CD . PRO A 1 81 ? -21.808 39.350 2.226 1.00 61.55 ? 283 PRO A CD 1
|
|
ATOM 408 N N . CYS A 1 82 ? -24.033 36.665 3.463 1.00 58.83 ? 284 CYS A N 1
|
|
ATOM 409 C CA . CYS A 1 82 ? -24.479 35.356 3.948 1.00 57.52 ? 284 CYS A CA 1
|
|
ATOM 410 C C . CYS A 1 82 ? -24.893 35.389 5.414 1.00 56.81 ? 284 CYS A C 1
|
|
ATOM 411 O O . CYS A 1 82 ? -24.993 34.358 6.061 1.00 56.07 ? 284 CYS A O 1
|
|
ATOM 412 C CB . CYS A 1 82 ? -23.453 34.264 3.651 1.00 57.95 ? 284 CYS A CB 1
|
|
ATOM 413 S SG . CYS A 1 82 ? -22.976 34.162 1.906 1.00 61.86 ? 284 CYS A SG 1
|
|
ATOM 414 N N . ILE A 1 83 ? -25.177 36.582 5.914 1.00 52.63 ? 285 ILE A N 1
|
|
ATOM 415 C CA . ILE A 1 83 ? -25.686 36.819 7.262 1.00 53.84 ? 285 ILE A CA 1
|
|
ATOM 416 C C . ILE A 1 83 ? -26.917 37.712 7.146 1.00 58.97 ? 285 ILE A C 1
|
|
ATOM 417 O O . ILE A 1 83 ? -26.800 38.792 6.578 1.00 60.36 ? 285 ILE A O 1
|
|
ATOM 418 C CB . ILE A 1 83 ? -24.605 37.388 8.239 1.00 57.06 ? 285 ILE A CB 1
|
|
ATOM 419 C CG1 . ILE A 1 83 ? -23.534 36.319 8.541 1.00 56.78 ? 285 ILE A CG1 1
|
|
ATOM 420 C CG2 . ILE A 1 83 ? -25.259 37.871 9.556 1.00 58.85 ? 285 ILE A CG2 1
|
|
ATOM 421 C CD1 . ILE A 1 83 ? -22.284 36.841 8.898 1.00 61.74 ? 285 ILE A CD1 1
|
|
ATOM 422 N N . ILE A 1 84 ? -28.085 37.278 7.673 1.00 55.37 ? 286 ILE A N 1
|
|
ATOM 423 C CA . ILE A 1 84 ? -29.344 38.064 7.668 1.00 55.41 ? 286 ILE A CA 1
|
|
ATOM 424 C C . ILE A 1 84 ? -29.185 39.504 8.268 1.00 61.53 ? 286 ILE A C 1
|
|
ATOM 425 O O . ILE A 1 84 ? -28.401 39.702 9.206 1.00 62.94 ? 286 ILE A O 1
|
|
ATOM 426 C CB . ILE A 1 84 ? -30.503 37.249 8.335 1.00 58.49 ? 286 ILE A CB 1
|
|
ATOM 427 C CG1 . ILE A 1 84 ? -31.876 37.621 7.787 1.00 58.26 ? 286 ILE A CG1 1
|
|
ATOM 428 C CG2 . ILE A 1 84 ? -30.458 37.255 9.865 1.00 59.27 ? 286 ILE A CG2 1
|
|
ATOM 429 C CD1 . ILE A 1 84 ? -32.147 37.041 6.446 1.00 64.04 ? 286 ILE A CD1 1
|
|
ATOM 430 N N . LYS A 1 85 ? -29.894 40.493 7.712 1.00 57.96 ? 287 LYS A N 1
|
|
ATOM 431 C CA . LYS A 1 85 ? -29.822 41.887 8.182 1.00 58.20 ? 287 LYS A CA 1
|
|
ATOM 432 C C . LYS A 1 85 ? -31.103 42.354 8.842 1.00 61.78 ? 287 LYS A C 1
|
|
ATOM 433 O O . LYS A 1 85 ? -32.190 42.079 8.334 1.00 60.52 ? 287 LYS A O 1
|
|
ATOM 434 C CB . LYS A 1 85 ? -29.475 42.833 7.023 1.00 60.35 ? 287 LYS A CB 1
|
|
ATOM 435 C CG . LYS A 1 85 ? -27.984 42.965 6.746 1.00 75.72 ? 287 LYS A CG 1
|
|
ATOM 436 C CD . LYS A 1 85 ? -27.736 43.483 5.336 1.00 78.13 ? 287 LYS A CD 1
|
|
ATOM 437 C CE . LYS A 1 85 ? -26.275 43.542 4.975 1.00 83.63 ? 287 LYS A CE 1
|
|
ATOM 438 N NZ . LYS A 1 85 ? -25.749 42.227 4.520 1.00 91.77 ? 287 LYS A NZ 1
|
|
ATOM 439 N N . ILE A 1 86 ? -30.972 43.076 9.963 1.00 60.71 ? 288 ILE A N 1
|
|
ATOM 440 C CA . ILE A 1 86 ? -32.107 43.666 10.688 1.00 61.89 ? 288 ILE A CA 1
|
|
ATOM 441 C C . ILE A 1 86 ? -32.477 44.896 9.881 1.00 64.53 ? 288 ILE A C 1
|
|
ATOM 442 O O . ILE A 1 86 ? -31.591 45.646 9.463 1.00 63.89 ? 288 ILE A O 1
|
|
ATOM 443 C CB . ILE A 1 86 ? -31.769 44.065 12.173 1.00 67.21 ? 288 ILE A CB 1
|
|
ATOM 444 C CG1 . ILE A 1 86 ? -31.025 42.952 12.905 1.00 70.70 ? 288 ILE A CG1 1
|
|
ATOM 445 C CG2 . ILE A 1 86 ? -33.014 44.497 12.983 1.00 66.63 ? 288 ILE A CG2 1
|
|
ATOM 446 C CD1 . ILE A 1 86 ? -31.912 41.869 13.657 1.00 87.34 ? 288 ILE A CD1 1
|
|
ATOM 447 N N . LYS A 1 87 ? -33.773 45.086 9.645 1.00 60.51 ? 289 LYS A N 1
|
|
ATOM 448 C CA . LYS A 1 87 ? -34.296 46.232 8.910 1.00 59.70 ? 289 LYS A CA 1
|
|
ATOM 449 C C . LYS A 1 87 ? -34.966 47.184 9.892 1.00 64.17 ? 289 LYS A C 1
|
|
ATOM 450 O O . LYS A 1 87 ? -34.933 48.392 9.678 1.00 64.76 ? 289 LYS A O 1
|
|
ATOM 451 C CB . LYS A 1 87 ? -35.285 45.785 7.813 1.00 60.46 ? 289 LYS A CB 1
|
|
ATOM 452 C CG . LYS A 1 87 ? -34.640 45.188 6.577 1.00 58.93 ? 289 LYS A CG 1
|
|
ATOM 453 C CD . LYS A 1 87 ? -35.691 44.841 5.543 1.00 73.42 ? 289 LYS A CD 1
|
|
ATOM 454 C CE . LYS A 1 87 ? -35.419 45.487 4.205 1.00 90.56 ? 289 LYS A CE 1
|
|
ATOM 455 N NZ . LYS A 1 87 ? -35.828 46.920 4.168 1.00 105.26 ? 289 LYS A NZ 1
|
|
ATOM 456 N N . ASN A 1 88 ? -35.571 46.632 10.971 1.00 61.19 ? 290 ASN A N 1
|
|
ATOM 457 C CA . ASN A 1 88 ? -36.279 47.370 12.029 1.00 61.80 ? 290 ASN A CA 1
|
|
ATOM 458 C C . ASN A 1 88 ? -36.477 46.533 13.294 1.00 65.69 ? 290 ASN A C 1
|
|
ATOM 459 O O . ASN A 1 88 ? -36.309 45.313 13.277 1.00 65.36 ? 290 ASN A O 1
|
|
ATOM 460 C CB . ASN A 1 88 ? -37.642 47.889 11.516 1.00 61.93 ? 290 ASN A CB 1
|
|
ATOM 461 C CG . ASN A 1 88 ? -38.010 49.276 11.960 1.00 81.12 ? 290 ASN A CG 1
|
|
ATOM 462 O OD1 . ASN A 1 88 ? -37.472 49.820 12.931 1.00 88.15 ? 290 ASN A OD1 1
|
|
ATOM 463 N ND2 . ASN A 1 88 ? -38.961 49.868 11.269 1.00 65.21 ? 290 ASN A ND2 1
|
|
ATOM 464 N N . PHE A 1 89 ? -36.845 47.197 14.396 1.00 63.42 ? 291 PHE A N 1
|
|
ATOM 465 C CA . PHE A 1 89 ? -37.086 46.550 15.686 1.00 63.65 ? 291 PHE A CA 1
|
|
ATOM 466 C C . PHE A 1 89 ? -38.147 47.307 16.496 1.00 64.99 ? 291 PHE A C 1
|
|
ATOM 467 O O . PHE A 1 89 ? -38.120 48.540 16.565 1.00 62.86 ? 291 PHE A O 1
|
|
ATOM 468 C CB . PHE A 1 89 ? -35.767 46.379 16.474 1.00 67.29 ? 291 PHE A CB 1
|
|
ATOM 469 C CG . PHE A 1 89 ? -35.951 45.912 17.903 1.00 72.56 ? 291 PHE A CG 1
|
|
ATOM 470 C CD1 . PHE A 1 89 ? -36.217 44.573 18.188 1.00 76.55 ? 291 PHE A CD1 1
|
|
ATOM 471 C CD2 . PHE A 1 89 ? -35.900 46.820 18.965 1.00 77.59 ? 291 PHE A CD2 1
|
|
ATOM 472 C CE1 . PHE A 1 89 ? -36.431 44.151 19.511 1.00 80.26 ? 291 PHE A CE1 1
|
|
ATOM 473 C CE2 . PHE A 1 89 ? -36.113 46.396 20.285 1.00 83.00 ? 291 PHE A CE2 1
|
|
ATOM 474 C CZ . PHE A 1 89 ? -36.369 45.065 20.549 1.00 81.61 ? 291 PHE A CZ 1
|
|
ATOM 475 N N . PHE A 1 90 ? -39.062 46.545 17.122 1.00 62.54 ? 292 PHE A N 1
|
|
ATOM 476 C CA . PHE A 1 90 ? -40.139 47.050 17.976 1.00 63.63 ? 292 PHE A CA 1
|
|
ATOM 477 C C . PHE A 1 90 ? -40.150 46.336 19.329 1.00 74.32 ? 292 PHE A C 1
|
|
ATOM 478 O O . PHE A 1 90 ? -40.291 45.107 19.412 1.00 73.54 ? 292 PHE A O 1
|
|
ATOM 479 C CB . PHE A 1 90 ? -41.498 46.929 17.284 1.00 63.13 ? 292 PHE A CB 1
|
|
ATOM 480 C CG . PHE A 1 90 ? -41.580 47.709 15.984 1.00 62.28 ? 292 PHE A CG 1
|
|
ATOM 481 C CD1 . PHE A 1 90 ? -41.921 49.062 15.982 1.00 63.68 ? 292 PHE A CD1 1
|
|
ATOM 482 C CD2 . PHE A 1 90 ? -41.312 47.093 14.762 1.00 61.03 ? 292 PHE A CD2 1
|
|
ATOM 483 C CE1 . PHE A 1 90 ? -41.970 49.784 14.786 1.00 61.98 ? 292 PHE A CE1 1
|
|
ATOM 484 C CE2 . PHE A 1 90 ? -41.368 47.822 13.568 1.00 61.51 ? 292 PHE A CE2 1
|
|
ATOM 485 C CZ . PHE A 1 90 ? -41.685 49.165 13.591 1.00 59.07 ? 292 PHE A CZ 1
|
|
ATOM 486 N N . ASP A 1 91 ? -39.953 47.125 20.387 1.00 76.63 ? 293 ASP A N 1
|
|
ATOM 487 C CA . ASP A 1 91 ? -39.961 46.674 21.774 1.00 81.31 ? 293 ASP A CA 1
|
|
ATOM 488 C C . ASP A 1 91 ? -41.348 47.029 22.332 1.00 89.33 ? 293 ASP A C 1
|
|
ATOM 489 O O . ASP A 1 91 ? -41.538 48.131 22.867 1.00 91.86 ? 293 ASP A O 1
|
|
ATOM 490 C CB . ASP A 1 91 ? -38.834 47.387 22.551 1.00 85.80 ? 293 ASP A CB 1
|
|
ATOM 491 C CG . ASP A 1 91 ? -38.603 46.955 23.991 1.00 101.00 ? 293 ASP A CG 1
|
|
ATOM 492 O OD1 . ASP A 1 91 ? -39.329 46.053 24.472 1.00 101.87 ? 293 ASP A OD1 1
|
|
ATOM 493 O OD2 . ASP A 1 91 ? -37.695 47.524 24.640 1.00 108.86 ? 293 ASP A OD2 1
|
|
ATOM 494 N N . ALA A 1 92 ? -42.332 46.113 22.129 1.00 84.84 ? 294 ALA A N 1
|
|
ATOM 495 C CA . ALA A 1 92 ? -43.741 46.242 22.542 1.00 84.86 ? 294 ALA A CA 1
|
|
ATOM 496 C C . ALA A 1 92 ? -44.072 45.220 23.659 1.00 90.95 ? 294 ALA A C 1
|
|
ATOM 497 O O . ALA A 1 92 ? -43.171 44.883 24.428 1.00 92.79 ? 294 ALA A O 1
|
|
ATOM 498 C CB . ALA A 1 92 ? -44.628 46.008 21.338 1.00 82.65 ? 294 ALA A CB 1
|
|
ATOM 499 N N . GLU A 1 93 ? -45.333 44.700 23.740 1.00 86.85 ? 295 GLU A N 1
|
|
ATOM 500 C CA . GLU A 1 93 ? -45.711 43.669 24.727 1.00 89.73 ? 295 GLU A CA 1
|
|
ATOM 501 C C . GLU A 1 93 ? -44.950 42.364 24.394 1.00 93.84 ? 295 GLU A C 1
|
|
ATOM 502 O O . GLU A 1 93 ? -44.858 41.440 25.213 1.00 96.98 ? 295 GLU A O 1
|
|
ATOM 503 C CB . GLU A 1 93 ? -47.235 43.452 24.770 1.00 91.37 ? 295 GLU A CB 1
|
|
ATOM 504 N N . ASP A 1 94 ? -44.379 42.339 23.175 1.00 86.25 ? 296 ASP A N 1
|
|
ATOM 505 C CA . ASP A 1 94 ? -43.528 41.312 22.583 1.00 83.92 ? 296 ASP A CA 1
|
|
ATOM 506 C C . ASP A 1 94 ? -42.477 42.047 21.769 1.00 81.36 ? 296 ASP A C 1
|
|
ATOM 507 O O . ASP A 1 94 ? -42.674 43.214 21.419 1.00 78.46 ? 296 ASP A O 1
|
|
ATOM 508 C CB . ASP A 1 94 ? -44.341 40.396 21.641 1.00 84.63 ? 296 ASP A CB 1
|
|
ATOM 509 C CG . ASP A 1 94 ? -45.448 39.587 22.296 1.00 100.94 ? 296 ASP A CG 1
|
|
ATOM 510 O OD1 . ASP A 1 94 ? -45.214 39.040 23.408 1.00 106.86 ? 296 ASP A OD1 1
|
|
ATOM 511 O OD2 . ASP A 1 94 ? -46.531 39.455 21.677 1.00 104.19 ? 296 ASP A OD2 1
|
|
ATOM 512 N N . TYR A 1 95 ? -41.369 41.378 21.466 1.00 77.33 ? 297 TYR A N 1
|
|
ATOM 513 C CA . TYR A 1 95 ? -40.332 41.938 20.612 1.00 75.10 ? 297 TYR A CA 1
|
|
ATOM 514 C C . TYR A 1 95 ? -40.715 41.649 19.160 1.00 75.30 ? 297 TYR A C 1
|
|
ATOM 515 O O . TYR A 1 95 ? -41.269 40.582 18.886 1.00 74.50 ? 297 TYR A O 1
|
|
ATOM 516 C CB . TYR A 1 95 ? -38.968 41.311 20.925 1.00 77.77 ? 297 TYR A CB 1
|
|
ATOM 517 C CG . TYR A 1 95 ? -38.407 41.709 22.269 1.00 83.68 ? 297 TYR A CG 1
|
|
ATOM 518 C CD1 . TYR A 1 95 ? -37.951 43.003 22.499 1.00 85.79 ? 297 TYR A CD1 1
|
|
ATOM 519 C CD2 . TYR A 1 95 ? -38.299 40.785 23.303 1.00 88.38 ? 297 TYR A CD2 1
|
|
ATOM 520 C CE1 . TYR A 1 95 ? -37.423 43.377 23.732 1.00 90.25 ? 297 TYR A CE1 1
|
|
ATOM 521 C CE2 . TYR A 1 95 ? -37.785 41.150 24.548 1.00 93.00 ? 297 TYR A CE2 1
|
|
ATOM 522 C CZ . TYR A 1 95 ? -37.332 42.445 24.754 1.00 101.23 ? 297 TYR A CZ 1
|
|
ATOM 523 O OH . TYR A 1 95 ? -36.801 42.813 25.970 1.00 105.32 ? 297 TYR A OH 1
|
|
ATOM 524 N N . TYR A 1 96 ? -40.464 42.607 18.244 1.00 69.67 ? 298 TYR A N 1
|
|
ATOM 525 C CA . TYR A 1 96 ? -40.732 42.450 16.812 1.00 67.01 ? 298 TYR A CA 1
|
|
ATOM 526 C C . TYR A 1 96 ? -39.481 42.803 16.055 1.00 70.51 ? 298 TYR A C 1
|
|
ATOM 527 O O . TYR A 1 96 ? -39.006 43.940 16.134 1.00 70.10 ? 298 TYR A O 1
|
|
ATOM 528 C CB . TYR A 1 96 ? -41.930 43.297 16.341 1.00 66.69 ? 298 TYR A CB 1
|
|
ATOM 529 C CG . TYR A 1 96 ? -43.255 42.847 16.925 1.00 69.02 ? 298 TYR A CG 1
|
|
ATOM 530 C CD1 . TYR A 1 96 ? -43.658 43.261 18.194 1.00 71.90 ? 298 TYR A CD1 1
|
|
ATOM 531 C CD2 . TYR A 1 96 ? -44.124 42.038 16.195 1.00 69.29 ? 298 TYR A CD2 1
|
|
ATOM 532 C CE1 . TYR A 1 96 ? -44.867 42.839 18.744 1.00 73.58 ? 298 TYR A CE1 1
|
|
ATOM 533 C CE2 . TYR A 1 96 ? -45.360 41.646 16.717 1.00 71.74 ? 298 TYR A CE2 1
|
|
ATOM 534 C CZ . TYR A 1 96 ? -45.719 42.032 18.003 1.00 80.46 ? 298 TYR A CZ 1
|
|
ATOM 535 O OH . TYR A 1 96 ? -46.914 41.616 18.559 1.00 80.47 ? 298 TYR A OH 1
|
|
ATOM 536 N N . ILE A 1 97 ? -38.909 41.809 15.372 1.00 67.04 ? 299 ILE A N 1
|
|
ATOM 537 C CA . ILE A 1 97 ? -37.688 41.988 14.590 1.00 65.36 ? 299 ILE A CA 1
|
|
ATOM 538 C C . ILE A 1 97 ? -37.959 41.868 13.096 1.00 65.14 ? 299 ILE A C 1
|
|
ATOM 539 O O . ILE A 1 97 ? -38.305 40.791 12.608 1.00 63.90 ? 299 ILE A O 1
|
|
ATOM 540 C CB . ILE A 1 97 ? -36.521 41.086 15.064 1.00 69.57 ? 299 ILE A CB 1
|
|
ATOM 541 C CG1 . ILE A 1 97 ? -36.210 41.305 16.570 1.00 72.86 ? 299 ILE A CG1 1
|
|
ATOM 542 C CG2 . ILE A 1 97 ? -35.285 41.357 14.214 1.00 67.82 ? 299 ILE A CG2 1
|
|
ATOM 543 C CD1 . ILE A 1 97 ? -35.259 40.228 17.197 1.00 85.23 ? 299 ILE A CD1 1
|
|
ATOM 544 N N . VAL A 1 98 ? -37.776 42.989 12.381 1.00 59.87 ? 300 VAL A N 1
|
|
ATOM 545 C CA . VAL A 1 98 ? -37.980 43.115 10.933 1.00 57.15 ? 300 VAL A CA 1
|
|
ATOM 546 C C . VAL A 1 98 ? -36.682 42.726 10.229 1.00 61.41 ? 300 VAL A C 1
|
|
ATOM 547 O O . VAL A 1 98 ? -35.638 43.362 10.416 1.00 60.68 ? 300 VAL A O 1
|
|
ATOM 548 C CB . VAL A 1 98 ? -38.531 44.508 10.532 1.00 58.42 ? 300 VAL A CB 1
|
|
ATOM 549 C CG1 . VAL A 1 98 ? -38.871 44.579 9.042 1.00 56.62 ? 300 VAL A CG1 1
|
|
ATOM 550 C CG2 . VAL A 1 98 ? -39.745 44.870 11.386 1.00 58.33 ? 300 VAL A CG2 1
|
|
ATOM 551 N N . LEU A 1 99 ? -36.754 41.620 9.483 1.00 57.86 ? 301 LEU A N 1
|
|
ATOM 552 C CA . LEU A 1 99 ? -35.621 41.025 8.787 1.00 57.46 ? 301 LEU A CA 1
|
|
ATOM 553 C C . LEU A 1 99 ? -35.875 40.930 7.288 1.00 62.41 ? 301 LEU A C 1
|
|
ATOM 554 O O . LEU A 1 99 ? -37.019 41.069 6.834 1.00 63.83 ? 301 LEU A O 1
|
|
ATOM 555 C CB . LEU A 1 99 ? -35.333 39.615 9.369 1.00 57.94 ? 301 LEU A CB 1
|
|
ATOM 556 C CG . LEU A 1 99 ? -35.065 39.541 10.880 1.00 62.03 ? 301 LEU A CG 1
|
|
ATOM 557 C CD1 . LEU A 1 99 ? -35.733 38.338 11.488 1.00 63.05 ? 301 LEU A CD1 1
|
|
ATOM 558 C CD2 . LEU A 1 99 ? -33.560 39.676 11.215 1.00 59.25 ? 301 LEU A CD2 1
|
|
ATOM 559 N N . GLU A 1 100 ? -34.814 40.693 6.515 1.00 71.12 ? 302 GLU A N 1
|
|
ATOM 560 C CA . GLU A 1 100 ? -35.001 40.555 5.083 1.00 71.26 ? 302 GLU A CA 1
|
|
ATOM 561 C C . GLU A 1 100 ? -35.628 39.201 4.788 1.00 70.24 ? 302 GLU A C 1
|
|
ATOM 562 O O . GLU A 1 100 ? -35.301 38.225 5.464 1.00 68.42 ? 302 GLU A O 1
|
|
ATOM 563 C CB . GLU A 1 100 ? -33.705 40.835 4.291 1.00 72.57 ? 302 GLU A CB 1
|
|
ATOM 564 C CG . GLU A 1 100 ? -32.485 39.982 4.622 1.00 80.55 ? 302 GLU A CG 1
|
|
ATOM 565 C CD . GLU A 1 100 ? -31.133 40.632 4.369 1.00 100.32 ? 302 GLU A CD 1
|
|
ATOM 566 O OE1 . GLU A 1 100 ? -31.077 41.682 3.685 1.00 96.22 ? 302 GLU A OE1 1
|
|
ATOM 567 O OE2 . GLU A 1 100 ? -30.124 40.087 4.871 1.00 91.35 ? 302 GLU A OE2 1
|
|
ATOM 568 N N . LEU A 1 101 ? -36.592 39.168 3.855 1.00 65.37 ? 303 LEU A N 1
|
|
ATOM 569 C CA . LEU A 1 101 ? -37.328 37.973 3.473 1.00 63.89 ? 303 LEU A CA 1
|
|
ATOM 570 C C . LEU A 1 101 ? -36.536 37.087 2.537 1.00 67.05 ? 303 LEU A C 1
|
|
ATOM 571 O O . LEU A 1 101 ? -36.045 37.538 1.497 1.00 67.58 ? 303 LEU A O 1
|
|
ATOM 572 C CB . LEU A 1 101 ? -38.693 38.323 2.860 1.00 66.77 ? 303 LEU A CB 1
|
|
ATOM 573 C CG . LEU A 1 101 ? -39.522 37.126 2.395 1.00 72.01 ? 303 LEU A CG 1
|
|
ATOM 574 C CD1 . LEU A 1 101 ? -40.128 36.388 3.570 1.00 72.28 ? 303 LEU A CD1 1
|
|
ATOM 575 C CD2 . LEU A 1 101 ? -40.586 37.538 1.436 1.00 75.82 ? 303 LEU A CD2 1
|
|
ATOM 576 N N . MET A 1 102 ? -36.476 35.798 2.892 1.00 62.61 ? 304 MET A N 1
|
|
ATOM 577 C CA . MET A 1 102 ? -35.757 34.745 2.178 1.00 60.47 ? 304 MET A CA 1
|
|
ATOM 578 C C . MET A 1 102 ? -36.759 33.762 1.594 1.00 69.29 ? 304 MET A C 1
|
|
ATOM 579 O O . MET A 1 102 ? -37.183 32.824 2.278 1.00 69.59 ? 304 MET A O 1
|
|
ATOM 580 C CB . MET A 1 102 ? -34.759 34.058 3.129 1.00 58.48 ? 304 MET A CB 1
|
|
ATOM 581 C CG . MET A 1 102 ? -33.699 34.984 3.637 1.00 59.14 ? 304 MET A CG 1
|
|
ATOM 582 S SD . MET A 1 102 ? -32.577 35.560 2.333 1.00 62.70 ? 304 MET A SD 1
|
|
ATOM 583 C CE . MET A 1 102 ? -31.516 34.133 2.188 1.00 56.99 ? 304 MET A CE 1
|
|
ATOM 584 N N . GLU A 1 103 ? -37.154 33.992 0.332 1.00 68.69 ? 305 GLU A N 1
|
|
ATOM 585 C CA . GLU A 1 103 ? -38.166 33.194 -0.362 1.00 71.36 ? 305 GLU A CA 1
|
|
ATOM 586 C C . GLU A 1 103 ? -37.949 31.677 -0.513 1.00 75.98 ? 305 GLU A C 1
|
|
ATOM 587 O O . GLU A 1 103 ? -38.915 30.933 -0.656 1.00 77.36 ? 305 GLU A O 1
|
|
ATOM 588 C CB . GLU A 1 103 ? -38.616 33.881 -1.653 1.00 76.01 ? 305 GLU A CB 1
|
|
ATOM 589 C CG . GLU A 1 103 ? -39.621 34.992 -1.386 1.00 91.02 ? 305 GLU A CG 1
|
|
ATOM 590 C CD . GLU A 1 103 ? -39.601 36.121 -2.393 1.00 117.87 ? 305 GLU A CD 1
|
|
ATOM 591 O OE1 . GLU A 1 103 ? -40.274 35.993 -3.441 1.00 119.07 ? 305 GLU A OE1 1
|
|
ATOM 592 O OE2 . GLU A 1 103 ? -38.922 37.140 -2.127 1.00 109.77 ? 305 GLU A OE2 1
|
|
ATOM 593 N N . GLY A 1 104 ? -36.704 31.229 -0.429 1.00 72.17 ? 306 GLY A N 1
|
|
ATOM 594 C CA . GLY A 1 104 ? -36.374 29.809 -0.514 1.00 71.84 ? 306 GLY A CA 1
|
|
ATOM 595 C C . GLY A 1 104 ? -36.694 29.028 0.749 1.00 73.87 ? 306 GLY A C 1
|
|
ATOM 596 O O . GLY A 1 104 ? -36.754 27.792 0.714 1.00 74.27 ? 306 GLY A O 1
|
|
ATOM 597 N N . GLY A 1 105 ? -36.897 29.750 1.856 1.00 66.80 ? 307 GLY A N 1
|
|
ATOM 598 C CA . GLY A 1 105 ? -37.235 29.166 3.145 1.00 64.80 ? 307 GLY A CA 1
|
|
ATOM 599 C C . GLY A 1 105 ? -36.031 28.618 3.858 1.00 65.71 ? 307 GLY A C 1
|
|
ATOM 600 O O . GLY A 1 105 ? -34.913 29.074 3.623 1.00 65.14 ? 307 GLY A O 1
|
|
ATOM 601 N N . GLU A 1 106 ? -36.247 27.642 4.737 1.00 61.45 ? 308 GLU A N 1
|
|
ATOM 602 C CA . GLU A 1 106 ? -35.176 27.024 5.519 1.00 58.69 ? 308 GLU A CA 1
|
|
ATOM 603 C C . GLU A 1 106 ? -34.540 25.898 4.721 1.00 65.37 ? 308 GLU A C 1
|
|
ATOM 604 O O . GLU A 1 106 ? -35.223 25.228 3.933 1.00 68.14 ? 308 GLU A O 1
|
|
ATOM 605 C CB . GLU A 1 106 ? -35.725 26.427 6.826 1.00 59.88 ? 308 GLU A CB 1
|
|
ATOM 606 C CG . GLU A 1 106 ? -36.396 27.391 7.788 1.00 65.31 ? 308 GLU A CG 1
|
|
ATOM 607 C CD . GLU A 1 106 ? -37.143 26.727 8.936 1.00 90.17 ? 308 GLU A CD 1
|
|
ATOM 608 O OE1 . GLU A 1 106 ? -37.102 25.479 9.048 1.00 68.86 ? 308 GLU A OE1 1
|
|
ATOM 609 O OE2 . GLU A 1 106 ? -37.761 27.464 9.739 1.00 95.18 ? 308 GLU A OE2 1
|
|
ATOM 610 N N . LEU A 1 107 ? -33.242 25.642 4.973 1.00 59.95 ? 309 LEU A N 1
|
|
ATOM 611 C CA . LEU A 1 107 ? -32.498 24.553 4.351 1.00 59.52 ? 309 LEU A CA 1
|
|
ATOM 612 C C . LEU A 1 107 ? -33.044 23.212 4.881 1.00 67.87 ? 309 LEU A C 1
|
|
ATOM 613 O O . LEU A 1 107 ? -33.013 22.198 4.172 1.00 69.42 ? 309 LEU A O 1
|
|
ATOM 614 C CB . LEU A 1 107 ? -31.017 24.704 4.681 1.00 56.70 ? 309 LEU A CB 1
|
|
ATOM 615 C CG . LEU A 1 107 ? -30.078 23.640 4.158 1.00 60.30 ? 309 LEU A CG 1
|
|
ATOM 616 C CD1 . LEU A 1 107 ? -30.052 23.614 2.622 1.00 61.87 ? 309 LEU A CD1 1
|
|
ATOM 617 C CD2 . LEU A 1 107 ? -28.715 23.819 4.745 1.00 58.25 ? 309 LEU A CD2 1
|
|
ATOM 618 N N . PHE A 1 108 ? -33.575 23.229 6.120 1.00 64.61 ? 310 PHE A N 1
|
|
ATOM 619 C CA . PHE A 1 108 ? -34.185 22.076 6.780 1.00 65.15 ? 310 PHE A CA 1
|
|
ATOM 620 C C . PHE A 1 108 ? -35.223 21.388 5.896 1.00 72.61 ? 310 PHE A C 1
|
|
ATOM 621 O O . PHE A 1 108 ? -35.230 20.161 5.817 1.00 73.81 ? 310 PHE A O 1
|
|
ATOM 622 C CB . PHE A 1 108 ? -34.805 22.512 8.109 1.00 65.65 ? 310 PHE A CB 1
|
|
ATOM 623 C CG . PHE A 1 108 ? -35.570 21.444 8.842 1.00 67.83 ? 310 PHE A CG 1
|
|
ATOM 624 C CD1 . PHE A 1 108 ? -34.906 20.468 9.569 1.00 69.31 ? 310 PHE A CD1 1
|
|
ATOM 625 C CD2 . PHE A 1 108 ? -36.960 21.440 8.846 1.00 72.38 ? 310 PHE A CD2 1
|
|
ATOM 626 C CE1 . PHE A 1 108 ? -35.617 19.503 10.288 1.00 72.06 ? 310 PHE A CE1 1
|
|
ATOM 627 C CE2 . PHE A 1 108 ? -37.672 20.480 9.572 1.00 76.36 ? 310 PHE A CE2 1
|
|
ATOM 628 C CZ . PHE A 1 108 ? -36.994 19.511 10.280 1.00 73.50 ? 310 PHE A CZ 1
|
|
ATOM 629 N N . ASP A 1 109 ? -36.066 22.182 5.201 1.00 70.61 ? 311 ASP A N 1
|
|
ATOM 630 C CA . ASP A 1 109 ? -37.129 21.700 4.306 1.00 73.12 ? 311 ASP A CA 1
|
|
ATOM 631 C C . ASP A 1 109 ? -36.593 21.002 3.036 1.00 76.22 ? 311 ASP A C 1
|
|
ATOM 632 O O . ASP A 1 109 ? -37.366 20.344 2.344 1.00 79.26 ? 311 ASP A O 1
|
|
ATOM 633 C CB . ASP A 1 109 ? -38.125 22.831 3.958 1.00 76.66 ? 311 ASP A CB 1
|
|
ATOM 634 C CG . ASP A 1 109 ? -38.703 23.577 5.159 1.00 92.40 ? 311 ASP A CG 1
|
|
ATOM 635 O OD1 . ASP A 1 109 ? -39.531 22.984 5.886 1.00 95.10 ? 311 ASP A OD1 1
|
|
ATOM 636 O OD2 . ASP A 1 109 ? -38.355 24.771 5.346 1.00 99.99 ? 311 ASP A OD2 1
|
|
ATOM 637 N N . LYS A 1 110 ? -35.276 21.134 2.748 1.00 69.03 ? 312 LYS A N 1
|
|
ATOM 638 C CA . LYS A 1 110 ? -34.581 20.511 1.617 1.00 68.31 ? 312 LYS A CA 1
|
|
ATOM 639 C C . LYS A 1 110 ? -33.851 19.208 2.049 1.00 74.24 ? 312 LYS A C 1
|
|
ATOM 640 O O . LYS A 1 110 ? -33.459 18.405 1.204 1.00 74.83 ? 312 LYS A O 1
|
|
ATOM 641 C CB . LYS A 1 110 ? -33.598 21.505 0.949 1.00 66.53 ? 312 LYS A CB 1
|
|
ATOM 642 C CG . LYS A 1 110 ? -34.214 22.850 0.512 1.00 71.74 ? 312 LYS A CG 1
|
|
ATOM 643 C CD . LYS A 1 110 ? -34.968 22.854 -0.837 1.00 73.08 ? 312 LYS A CD 1
|
|
ATOM 644 N N . VAL A 1 111 ? -33.695 18.992 3.362 1.00 71.91 ? 313 VAL A N 1
|
|
ATOM 645 C CA . VAL A 1 111 ? -32.979 17.834 3.918 1.00 72.47 ? 313 VAL A CA 1
|
|
ATOM 646 C C . VAL A 1 111 ? -33.834 16.811 4.702 1.00 81.03 ? 313 VAL A C 1
|
|
ATOM 647 O O . VAL A 1 111 ? -33.349 15.701 4.943 1.00 81.18 ? 313 VAL A O 1
|
|
ATOM 648 C CB . VAL A 1 111 ? -31.678 18.234 4.672 1.00 72.71 ? 313 VAL A CB 1
|
|
ATOM 649 C CG1 . VAL A 1 111 ? -30.666 18.863 3.727 1.00 71.31 ? 313 VAL A CG1 1
|
|
ATOM 650 C CG2 . VAL A 1 111 ? -31.963 19.161 5.846 1.00 70.54 ? 313 VAL A CG2 1
|
|
ATOM 651 N N . VAL A 1 112 ? -35.090 17.173 5.086 1.00 80.59 ? 314 VAL A N 1
|
|
ATOM 652 C CA . VAL A 1 112 ? -36.021 16.287 5.811 1.00 83.82 ? 314 VAL A CA 1
|
|
ATOM 653 C C . VAL A 1 112 ? -36.405 15.038 5.034 1.00 94.64 ? 314 VAL A C 1
|
|
ATOM 654 O O . VAL A 1 112 ? -36.464 15.071 3.802 1.00 95.43 ? 314 VAL A O 1
|
|
ATOM 655 C CB . VAL A 1 112 ? -37.294 16.978 6.365 1.00 88.19 ? 314 VAL A CB 1
|
|
ATOM 656 C CG1 . VAL A 1 112 ? -36.939 18.002 7.404 1.00 85.12 ? 314 VAL A CG1 1
|
|
ATOM 657 C CG2 . VAL A 1 112 ? -38.153 17.592 5.261 1.00 89.47 ? 314 VAL A CG2 1
|
|
ATOM 658 N N . GLY A 1 113 ? -36.722 13.977 5.775 1.00 95.26 ? 315 GLY A N 1
|
|
ATOM 659 C CA . GLY A 1 113 ? -37.170 12.703 5.224 1.00 99.46 ? 315 GLY A CA 1
|
|
ATOM 660 C C . GLY A 1 113 ? -36.191 12.035 4.282 1.00 105.20 ? 315 GLY A C 1
|
|
ATOM 661 O O . GLY A 1 113 ? -36.597 11.528 3.226 1.00 108.26 ? 315 GLY A O 1
|
|
ATOM 662 N N . ASN A 1 114 ? -34.889 12.035 4.667 1.00 98.57 ? 316 ASN A N 1
|
|
ATOM 663 C CA . ASN A 1 114 ? -33.788 11.428 3.910 1.00 98.13 ? 316 ASN A CA 1
|
|
ATOM 664 C C . ASN A 1 114 ? -33.568 12.042 2.510 1.00 100.99 ? 316 ASN A C 1
|
|
ATOM 665 O O . ASN A 1 114 ? -33.016 11.386 1.615 1.00 101.92 ? 316 ASN A O 1
|
|
ATOM 666 C CB . ASN A 1 114 ? -33.883 9.884 3.898 1.00 101.75 ? 316 ASN A CB 1
|
|
ATOM 667 C CG . ASN A 1 114 ? -34.025 9.261 5.273 1.00 130.44 ? 316 ASN A CG 1
|
|
ATOM 668 O OD1 . ASN A 1 114 ? -33.288 9.591 6.222 1.00 119.56 ? 316 ASN A OD1 1
|
|
ATOM 669 N ND2 . ASN A 1 114 ? -34.974 8.330 5.404 1.00 128.06 ? 316 ASN A ND2 1
|
|
ATOM 670 N N . LYS A 1 115 ? -33.984 13.320 2.340 1.00 94.60 ? 317 LYS A N 1
|
|
ATOM 671 C CA . LYS A 1 115 ? -33.797 14.060 1.097 1.00 93.44 ? 317 LYS A CA 1
|
|
ATOM 672 C C . LYS A 1 115 ? -32.321 14.437 0.985 1.00 94.83 ? 317 LYS A C 1
|
|
ATOM 673 O O . LYS A 1 115 ? -31.728 15.022 1.900 1.00 90.67 ? 317 LYS A O 1
|
|
ATOM 674 C CB . LYS A 1 115 ? -34.696 15.297 1.023 1.00 94.54 ? 317 LYS A CB 1
|
|
ATOM 675 C CG . LYS A 1 115 ? -36.142 15.010 0.645 1.00 95.38 ? 317 LYS A CG 1
|
|
ATOM 676 C CD . LYS A 1 115 ? -36.794 16.184 -0.106 1.00 97.63 ? 317 LYS A CD 1
|
|
ATOM 677 C CE . LYS A 1 115 ? -37.054 17.431 0.714 1.00 94.46 ? 317 LYS A CE 1
|
|
ATOM 678 N NZ . LYS A 1 115 ? -38.090 17.212 1.752 1.00 98.54 ? 317 LYS A NZ 1
|
|
ATOM 679 N N . ARG A 1 116 ? -31.727 14.020 -0.124 1.00 94.21 ? 318 ARG A N 1
|
|
ATOM 680 C CA . ARG A 1 116 ? -30.316 14.189 -0.413 1.00 92.90 ? 318 ARG A CA 1
|
|
ATOM 681 C C . ARG A 1 116 ? -30.093 15.300 -1.428 1.00 95.02 ? 318 ARG A C 1
|
|
ATOM 682 O O . ARG A 1 116 ? -30.563 15.206 -2.574 1.00 97.63 ? 318 ARG A O 1
|
|
ATOM 683 C CB . ARG A 1 116 ? -29.727 12.854 -0.928 1.00 96.25 ? 318 ARG A CB 1
|
|
ATOM 684 C CG . ARG A 1 116 ? -28.212 12.828 -0.942 1.00 102.76 ? 318 ARG A CG 1
|
|
ATOM 685 C CD . ARG A 1 116 ? -27.682 11.979 -2.071 1.00 110.13 ? 318 ARG A CD 1
|
|
ATOM 686 N NE . ARG A 1 116 ? -27.743 10.554 -1.757 1.00 124.47 ? 318 ARG A NE 1
|
|
ATOM 687 C CZ . ARG A 1 116 ? -26.779 9.881 -1.137 1.00 143.47 ? 318 ARG A CZ 1
|
|
ATOM 688 N NH1 . ARG A 1 116 ? -25.675 10.501 -0.739 1.00 133.03 ? 318 ARG A NH1 1
|
|
ATOM 689 N NH2 . ARG A 1 116 ? -26.913 8.583 -0.905 1.00 132.93 ? 318 ARG A NH2 1
|
|
ATOM 690 N N . LEU A 1 117 ? -29.345 16.340 -1.000 1.00 85.45 ? 319 LEU A N 1
|
|
ATOM 691 C CA . LEU A 1 117 ? -28.935 17.472 -1.824 1.00 82.23 ? 319 LEU A CA 1
|
|
ATOM 692 C C . LEU A 1 117 ? -27.828 16.982 -2.784 1.00 84.10 ? 319 LEU A C 1
|
|
ATOM 693 O O . LEU A 1 117 ? -27.017 16.118 -2.408 1.00 83.57 ? 319 LEU A O 1
|
|
ATOM 694 C CB . LEU A 1 117 ? -28.355 18.544 -0.894 1.00 78.81 ? 319 LEU A CB 1
|
|
ATOM 695 C CG . LEU A 1 117 ? -29.142 19.832 -0.612 1.00 81.80 ? 319 LEU A CG 1
|
|
ATOM 696 C CD1 . LEU A 1 117 ? -30.424 19.557 0.145 1.00 82.27 ? 319 LEU A CD1 1
|
|
ATOM 697 C CD2 . LEU A 1 117 ? -28.304 20.775 0.239 1.00 79.68 ? 319 LEU A CD2 1
|
|
ATOM 698 N N . LYS A 1 118 ? -27.820 17.515 -4.031 1.00 78.58 ? 320 LYS A N 1
|
|
ATOM 699 C CA . LYS A 1 118 ? -26.825 17.261 -5.092 1.00 77.68 ? 320 LYS A CA 1
|
|
ATOM 700 C C . LYS A 1 118 ? -25.456 17.676 -4.521 1.00 75.59 ? 320 LYS A C 1
|
|
ATOM 701 O O . LYS A 1 118 ? -25.386 18.732 -3.872 1.00 73.14 ? 320 LYS A O 1
|
|
ATOM 702 C CB . LYS A 1 118 ? -27.146 18.199 -6.266 1.00 80.83 ? 320 LYS A CB 1
|
|
ATOM 703 C CG . LYS A 1 118 ? -27.226 17.573 -7.638 1.00 77.37 ? 320 LYS A CG 1
|
|
ATOM 704 C CD . LYS A 1 118 ? -27.849 18.563 -8.618 1.00 82.44 ? 320 LYS A CD 1
|
|
ATOM 705 C CE . LYS A 1 118 ? -29.310 18.267 -8.879 1.00 99.71 ? 320 LYS A CE 1
|
|
ATOM 706 N NZ . LYS A 1 118 ? -29.889 19.182 -9.900 1.00 114.18 ? 320 LYS A NZ 1
|
|
ATOM 707 N N . GLU A 1 119 ? -24.382 16.879 -4.734 1.00 69.15 ? 321 GLU A N 1
|
|
ATOM 708 C CA . GLU A 1 119 ? -23.058 17.231 -4.190 1.00 65.84 ? 321 GLU A CA 1
|
|
ATOM 709 C C . GLU A 1 119 ? -22.632 18.683 -4.479 1.00 70.62 ? 321 GLU A C 1
|
|
ATOM 710 O O . GLU A 1 119 ? -22.107 19.357 -3.586 1.00 69.45 ? 321 GLU A O 1
|
|
ATOM 711 C CB . GLU A 1 119 ? -21.958 16.216 -4.548 1.00 67.94 ? 321 GLU A CB 1
|
|
ATOM 712 C CG . GLU A 1 119 ? -20.608 16.591 -3.949 1.00 69.64 ? 321 GLU A CG 1
|
|
ATOM 713 C CD . GLU A 1 119 ? -19.517 15.553 -3.794 1.00 83.42 ? 321 GLU A CD 1
|
|
ATOM 714 O OE1 . GLU A 1 119 ? -19.817 14.338 -3.793 1.00 83.68 ? 321 GLU A OE1 1
|
|
ATOM 715 O OE2 . GLU A 1 119 ? -18.355 15.972 -3.596 1.00 80.21 ? 321 GLU A OE2 1
|
|
ATOM 716 N N . ALA A 1 120 ? -22.928 19.170 -5.694 1.00 69.24 ? 322 ALA A N 1
|
|
ATOM 717 C CA . ALA A 1 120 ? -22.606 20.522 -6.142 1.00 68.60 ? 322 ALA A CA 1
|
|
ATOM 718 C C . ALA A 1 120 ? -23.371 21.585 -5.349 1.00 70.76 ? 322 ALA A C 1
|
|
ATOM 719 O O . ALA A 1 120 ? -22.763 22.580 -4.929 1.00 68.83 ? 322 ALA A O 1
|
|
ATOM 720 C CB . ALA A 1 120 ? -22.854 20.659 -7.634 1.00 72.10 ? 322 ALA A CB 1
|
|
ATOM 721 N N . THR A 1 121 ? -24.681 21.337 -5.087 1.00 67.66 ? 323 THR A N 1
|
|
ATOM 722 C CA . THR A 1 121 ? -25.568 22.214 -4.301 1.00 65.42 ? 323 THR A CA 1
|
|
ATOM 723 C C . THR A 1 121 ? -25.035 22.308 -2.864 1.00 66.15 ? 323 THR A C 1
|
|
ATOM 724 O O . THR A 1 121 ? -25.030 23.400 -2.311 1.00 65.13 ? 323 THR A O 1
|
|
ATOM 725 C CB . THR A 1 121 ? -27.020 21.697 -4.378 1.00 76.49 ? 323 THR A CB 1
|
|
ATOM 726 O OG1 . THR A 1 121 ? -27.457 21.634 -5.741 1.00 80.64 ? 323 THR A OG1 1
|
|
ATOM 727 C CG2 . THR A 1 121 ? -27.994 22.510 -3.545 1.00 70.51 ? 323 THR A CG2 1
|
|
ATOM 728 N N . CYS A 1 122 ? -24.561 21.171 -2.287 1.00 62.59 ? 324 CYS A N 1
|
|
ATOM 729 C CA . CYS A 1 122 ? -23.957 21.054 -0.950 1.00 60.88 ? 324 CYS A CA 1
|
|
ATOM 730 C C . CYS A 1 122 ? -22.802 22.007 -0.852 1.00 63.20 ? 324 CYS A C 1
|
|
ATOM 731 O O . CYS A 1 122 ? -22.725 22.770 0.122 1.00 62.38 ? 324 CYS A O 1
|
|
ATOM 732 C CB . CYS A 1 122 ? -23.483 19.631 -0.680 1.00 62.72 ? 324 CYS A CB 1
|
|
ATOM 733 S SG . CYS A 1 122 ? -24.807 18.457 -0.325 1.00 68.65 ? 324 CYS A SG 1
|
|
ATOM 734 N N . LYS A 1 123 ? -21.894 21.949 -1.862 1.00 57.12 ? 325 LYS A N 1
|
|
ATOM 735 C CA . LYS A 1 123 ? -20.709 22.782 -1.952 1.00 54.86 ? 325 LYS A CA 1
|
|
ATOM 736 C C . LYS A 1 123 ? -21.056 24.255 -2.012 1.00 59.39 ? 325 LYS A C 1
|
|
ATOM 737 O O . LYS A 1 123 ? -20.490 25.040 -1.259 1.00 57.78 ? 325 LYS A O 1
|
|
ATOM 738 C CB . LYS A 1 123 ? -19.843 22.371 -3.150 1.00 58.44 ? 325 LYS A CB 1
|
|
ATOM 739 C CG . LYS A 1 123 ? -18.394 22.846 -3.023 1.00 56.42 ? 325 LYS A CG 1
|
|
ATOM 740 C CD . LYS A 1 123 ? -17.563 22.514 -4.233 1.00 54.67 ? 325 LYS A CD 1
|
|
ATOM 741 C CE . LYS A 1 123 ? -17.261 21.045 -4.369 1.00 61.22 ? 325 LYS A CE 1
|
|
ATOM 742 N NZ . LYS A 1 123 ? -16.133 20.806 -5.324 1.00 72.37 ? 325 LYS A NZ 1
|
|
ATOM 743 N N . LEU A 1 124 ? -21.984 24.642 -2.900 1.00 58.39 ? 326 LEU A N 1
|
|
ATOM 744 C CA . LEU A 1 124 ? -22.363 26.047 -3.050 1.00 57.46 ? 326 LEU A CA 1
|
|
ATOM 745 C C . LEU A 1 124 ? -22.904 26.641 -1.740 1.00 57.82 ? 326 LEU A C 1
|
|
ATOM 746 O O . LEU A 1 124 ? -22.589 27.776 -1.392 1.00 56.03 ? 326 LEU A O 1
|
|
ATOM 747 C CB . LEU A 1 124 ? -23.355 26.232 -4.223 1.00 59.24 ? 326 LEU A CB 1
|
|
ATOM 748 C CG . LEU A 1 124 ? -23.821 27.676 -4.498 1.00 64.17 ? 326 LEU A CG 1
|
|
ATOM 749 C CD1 . LEU A 1 124 ? -22.655 28.587 -4.896 1.00 64.46 ? 326 LEU A CD1 1
|
|
ATOM 750 C CD2 . LEU A 1 124 ? -24.915 27.712 -5.535 1.00 69.62 ? 326 LEU A CD2 1
|
|
ATOM 751 N N . TYR A 1 125 ? -23.705 25.865 -1.025 1.00 54.26 ? 327 TYR A N 1
|
|
ATOM 752 C CA . TYR A 1 125 ? -24.312 26.277 0.238 1.00 52.70 ? 327 TYR A CA 1
|
|
ATOM 753 C C . TYR A 1 125 ? -23.258 26.291 1.348 1.00 56.98 ? 327 TYR A C 1
|
|
ATOM 754 O O . TYR A 1 125 ? -23.162 27.277 2.074 1.00 55.86 ? 327 TYR A O 1
|
|
ATOM 755 C CB . TYR A 1 125 ? -25.460 25.315 0.612 1.00 52.81 ? 327 TYR A CB 1
|
|
ATOM 756 C CG . TYR A 1 125 ? -26.664 25.340 -0.303 1.00 54.95 ? 327 TYR A CG 1
|
|
ATOM 757 C CD1 . TYR A 1 125 ? -26.778 26.288 -1.320 1.00 57.85 ? 327 TYR A CD1 1
|
|
ATOM 758 C CD2 . TYR A 1 125 ? -27.720 24.454 -0.117 1.00 56.41 ? 327 TYR A CD2 1
|
|
ATOM 759 C CE1 . TYR A 1 125 ? -27.900 26.335 -2.144 1.00 59.98 ? 327 TYR A CE1 1
|
|
ATOM 760 C CE2 . TYR A 1 125 ? -28.863 24.514 -0.914 1.00 58.77 ? 327 TYR A CE2 1
|
|
ATOM 761 C CZ . TYR A 1 125 ? -28.938 25.442 -1.937 1.00 63.97 ? 327 TYR A CZ 1
|
|
ATOM 762 O OH . TYR A 1 125 ? -30.040 25.470 -2.743 1.00 65.42 ? 327 TYR A OH 1
|
|
ATOM 763 N N . PHE A 1 126 ? -22.460 25.207 1.458 1.00 53.98 ? 328 PHE A N 1
|
|
ATOM 764 C CA . PHE A 1 126 ? -21.442 25.068 2.483 1.00 52.71 ? 328 PHE A CA 1
|
|
ATOM 765 C C . PHE A 1 126 ? -20.382 26.135 2.410 1.00 57.21 ? 328 PHE A C 1
|
|
ATOM 766 O O . PHE A 1 126 ? -20.022 26.707 3.449 1.00 57.65 ? 328 PHE A O 1
|
|
ATOM 767 C CB . PHE A 1 126 ? -20.837 23.663 2.494 1.00 54.94 ? 328 PHE A CB 1
|
|
ATOM 768 C CG . PHE A 1 126 ? -20.129 23.349 3.787 1.00 53.98 ? 328 PHE A CG 1
|
|
ATOM 769 C CD1 . PHE A 1 126 ? -20.844 23.187 4.966 1.00 55.03 ? 328 PHE A CD1 1
|
|
ATOM 770 C CD2 . PHE A 1 126 ? -18.745 23.217 3.824 1.00 54.86 ? 328 PHE A CD2 1
|
|
ATOM 771 C CE1 . PHE A 1 126 ? -20.185 22.941 6.172 1.00 55.10 ? 328 PHE A CE1 1
|
|
ATOM 772 C CE2 . PHE A 1 126 ? -18.086 22.952 5.026 1.00 56.71 ? 328 PHE A CE2 1
|
|
ATOM 773 C CZ . PHE A 1 126 ? -18.810 22.834 6.198 1.00 53.97 ? 328 PHE A CZ 1
|
|
ATOM 774 N N . TYR A 1 127 ? -19.921 26.442 1.195 1.00 53.84 ? 329 TYR A N 1
|
|
ATOM 775 C CA . TYR A 1 127 ? -18.931 27.494 0.937 1.00 53.86 ? 329 TYR A CA 1
|
|
ATOM 776 C C . TYR A 1 127 ? -19.408 28.813 1.531 1.00 58.66 ? 329 TYR A C 1
|
|
ATOM 777 O O . TYR A 1 127 ? -18.644 29.465 2.244 1.00 59.10 ? 329 TYR A O 1
|
|
ATOM 778 C CB . TYR A 1 127 ? -18.652 27.605 -0.576 1.00 56.72 ? 329 TYR A CB 1
|
|
ATOM 779 C CG . TYR A 1 127 ? -17.752 28.743 -0.993 1.00 58.94 ? 329 TYR A CG 1
|
|
ATOM 780 C CD1 . TYR A 1 127 ? -16.410 28.767 -0.629 1.00 60.16 ? 329 TYR A CD1 1
|
|
ATOM 781 C CD2 . TYR A 1 127 ? -18.227 29.773 -1.800 1.00 61.52 ? 329 TYR A CD2 1
|
|
ATOM 782 C CE1 . TYR A 1 127 ? -15.582 29.826 -0.993 1.00 61.86 ? 329 TYR A CE1 1
|
|
ATOM 783 C CE2 . TYR A 1 127 ? -17.398 30.822 -2.199 1.00 63.67 ? 329 TYR A CE2 1
|
|
ATOM 784 C CZ . TYR A 1 127 ? -16.080 30.855 -1.776 1.00 69.85 ? 329 TYR A CZ 1
|
|
ATOM 785 O OH . TYR A 1 127 ? -15.257 31.888 -2.165 1.00 73.29 ? 329 TYR A OH 1
|
|
ATOM 786 N N . GLN A 1 128 ? -20.695 29.149 1.320 1.00 55.11 ? 330 GLN A N 1
|
|
ATOM 787 C CA . GLN A 1 128 ? -21.328 30.355 1.856 1.00 54.80 ? 330 GLN A CA 1
|
|
ATOM 788 C C . GLN A 1 128 ? -21.427 30.332 3.395 1.00 58.53 ? 330 GLN A C 1
|
|
ATOM 789 O O . GLN A 1 128 ? -21.170 31.362 4.038 1.00 59.75 ? 330 GLN A O 1
|
|
ATOM 790 C CB . GLN A 1 128 ? -22.706 30.551 1.234 1.00 57.13 ? 330 GLN A CB 1
|
|
ATOM 791 C CG . GLN A 1 128 ? -22.674 30.807 -0.268 1.00 60.30 ? 330 GLN A CG 1
|
|
ATOM 792 C CD . GLN A 1 128 ? -24.049 30.836 -0.868 1.00 71.34 ? 330 GLN A CD 1
|
|
ATOM 793 O OE1 . GLN A 1 128 ? -24.818 31.770 -0.657 1.00 69.78 ? 330 GLN A OE1 1
|
|
ATOM 794 N NE2 . GLN A 1 128 ? -24.384 29.821 -1.643 1.00 62.36 ? 330 GLN A NE2 1
|
|
ATOM 795 N N . MET A 1 129 ? -21.768 29.156 3.982 1.00 52.40 ? 331 MET A N 1
|
|
ATOM 796 C CA . MET A 1 129 ? -21.870 28.931 5.437 1.00 48.95 ? 331 MET A CA 1
|
|
ATOM 797 C C . MET A 1 129 ? -20.476 29.137 6.050 1.00 53.77 ? 331 MET A C 1
|
|
ATOM 798 O O . MET A 1 129 ? -20.361 29.751 7.116 1.00 53.56 ? 331 MET A O 1
|
|
ATOM 799 C CB . MET A 1 129 ? -22.398 27.511 5.772 1.00 49.93 ? 331 MET A CB 1
|
|
ATOM 800 C CG . MET A 1 129 ? -23.825 27.237 5.314 1.00 52.90 ? 331 MET A CG 1
|
|
ATOM 801 S SD . MET A 1 129 ? -24.412 25.580 5.772 1.00 57.01 ? 331 MET A SD 1
|
|
ATOM 802 C CE . MET A 1 129 ? -25.228 25.136 4.340 1.00 55.13 ? 331 MET A CE 1
|
|
ATOM 803 N N . LEU A 1 130 ? -19.405 28.673 5.350 1.00 49.30 ? 332 LEU A N 1
|
|
ATOM 804 C CA . LEU A 1 130 ? -18.026 28.844 5.825 1.00 46.45 ? 332 LEU A CA 1
|
|
ATOM 805 C C . LEU A 1 130 ? -17.620 30.274 5.772 1.00 50.36 ? 332 LEU A C 1
|
|
ATOM 806 O O . LEU A 1 130 ? -16.945 30.738 6.681 1.00 50.32 ? 332 LEU A O 1
|
|
ATOM 807 C CB . LEU A 1 130 ? -17.049 28.017 5.018 1.00 46.89 ? 332 LEU A CB 1
|
|
ATOM 808 C CG . LEU A 1 130 ? -17.037 26.535 5.272 1.00 49.38 ? 332 LEU A CG 1
|
|
ATOM 809 C CD1 . LEU A 1 130 ? -16.240 25.841 4.181 1.00 50.68 ? 332 LEU A CD1 1
|
|
ATOM 810 C CD2 . LEU A 1 130 ? -16.477 26.224 6.638 1.00 45.84 ? 332 LEU A CD2 1
|
|
ATOM 811 N N . LEU A 1 131 ? -18.025 30.993 4.709 1.00 48.18 ? 333 LEU A N 1
|
|
ATOM 812 C CA . LEU A 1 131 ? -17.720 32.415 4.563 1.00 47.61 ? 333 LEU A CA 1
|
|
ATOM 813 C C . LEU A 1 131 ? -18.425 33.216 5.670 1.00 51.95 ? 333 LEU A C 1
|
|
ATOM 814 O O . LEU A 1 131 ? -17.824 34.123 6.244 1.00 53.10 ? 333 LEU A O 1
|
|
ATOM 815 C CB . LEU A 1 131 ? -18.142 32.924 3.173 1.00 48.55 ? 333 LEU A CB 1
|
|
ATOM 816 C CG . LEU A 1 131 ? -17.404 32.392 1.929 1.00 53.36 ? 333 LEU A CG 1
|
|
ATOM 817 C CD1 . LEU A 1 131 ? -18.002 33.006 0.673 1.00 55.25 ? 333 LEU A CD1 1
|
|
ATOM 818 C CD2 . LEU A 1 131 ? -15.900 32.694 1.970 1.00 51.58 ? 333 LEU A CD2 1
|
|
ATOM 819 N N . ALA A 1 132 ? -19.697 32.872 5.967 1.00 47.31 ? 334 ALA A N 1
|
|
ATOM 820 C CA . ALA A 1 132 ? -20.494 33.537 6.998 1.00 45.99 ? 334 ALA A CA 1
|
|
ATOM 821 C C . ALA A 1 132 ? -19.909 33.290 8.391 1.00 48.09 ? 334 ALA A C 1
|
|
ATOM 822 O O . ALA A 1 132 ? -19.642 34.236 9.111 1.00 48.40 ? 334 ALA A O 1
|
|
ATOM 823 C CB . ALA A 1 132 ? -21.939 33.072 6.922 1.00 46.39 ? 334 ALA A CB 1
|
|
ATOM 824 N N . VAL A 1 133 ? -19.653 32.029 8.740 1.00 44.41 ? 335 VAL A N 1
|
|
ATOM 825 C CA . VAL A 1 133 ? -19.038 31.647 10.012 1.00 43.56 ? 335 VAL A CA 1
|
|
ATOM 826 C C . VAL A 1 133 ? -17.583 32.200 10.134 1.00 47.09 ? 335 VAL A C 1
|
|
ATOM 827 O O . VAL A 1 133 ? -17.181 32.603 11.225 1.00 46.73 ? 335 VAL A O 1
|
|
ATOM 828 C CB . VAL A 1 133 ? -19.193 30.131 10.274 1.00 47.17 ? 335 VAL A CB 1
|
|
ATOM 829 C CG1 . VAL A 1 133 ? -18.510 29.713 11.562 1.00 46.21 ? 335 VAL A CG1 1
|
|
ATOM 830 C CG2 . VAL A 1 133 ? -20.678 29.753 10.321 1.00 47.20 ? 335 VAL A CG2 1
|
|
ATOM 831 N N . GLN A 1 134 ? -16.850 32.331 9.022 1.00 44.12 ? 336 GLN A N 1
|
|
ATOM 832 C CA . GLN A 1 134 ? -15.513 32.915 9.096 1.00 45.55 ? 336 GLN A CA 1
|
|
ATOM 833 C C . GLN A 1 134 ? -15.607 34.399 9.501 1.00 51.65 ? 336 GLN A C 1
|
|
ATOM 834 O O . GLN A 1 134 ? -14.930 34.799 10.448 1.00 53.36 ? 336 GLN A O 1
|
|
ATOM 835 C CB . GLN A 1 134 ? -14.726 32.678 7.807 1.00 47.78 ? 336 GLN A CB 1
|
|
ATOM 836 C CG . GLN A 1 134 ? -13.415 33.447 7.694 1.00 59.48 ? 336 GLN A CG 1
|
|
ATOM 837 C CD . GLN A 1 134 ? -12.775 33.239 6.342 1.00 74.18 ? 336 GLN A CD 1
|
|
ATOM 838 O OE1 . GLN A 1 134 ? -11.678 32.673 6.240 1.00 70.24 ? 336 GLN A OE1 1
|
|
ATOM 839 N NE2 . GLN A 1 134 ? -13.468 33.646 5.266 1.00 60.19 ? 336 GLN A NE2 1
|
|
ATOM 840 N N . TYR A 1 135 ? -16.541 35.154 8.880 1.00 48.21 ? 337 TYR A N 1
|
|
ATOM 841 C CA . TYR A 1 135 ? -16.853 36.564 9.166 1.00 48.87 ? 337 TYR A CA 1
|
|
ATOM 842 C C . TYR A 1 135 ? -17.187 36.742 10.666 1.00 53.76 ? 337 TYR A C 1
|
|
ATOM 843 O O . TYR A 1 135 ? -16.613 37.614 11.330 1.00 54.03 ? 337 TYR A O 1
|
|
ATOM 844 C CB . TYR A 1 135 ? -18.030 37.040 8.285 1.00 50.31 ? 337 TYR A CB 1
|
|
ATOM 845 C CG . TYR A 1 135 ? -18.434 38.483 8.522 1.00 53.93 ? 337 TYR A CG 1
|
|
ATOM 846 C CD1 . TYR A 1 135 ? -17.698 39.535 7.973 1.00 56.91 ? 337 TYR A CD1 1
|
|
ATOM 847 C CD2 . TYR A 1 135 ? -19.536 38.803 9.316 1.00 53.64 ? 337 TYR A CD2 1
|
|
ATOM 848 C CE1 . TYR A 1 135 ? -18.039 40.865 8.223 1.00 56.06 ? 337 TYR A CE1 1
|
|
ATOM 849 C CE2 . TYR A 1 135 ? -19.894 40.132 9.559 1.00 55.09 ? 337 TYR A CE2 1
|
|
ATOM 850 C CZ . TYR A 1 135 ? -19.146 41.157 9.003 1.00 61.77 ? 337 TYR A CZ 1
|
|
ATOM 851 O OH . TYR A 1 135 ? -19.494 42.469 9.219 1.00 66.65 ? 337 TYR A OH 1
|
|
ATOM 852 N N . LEU A 1 136 ? -18.086 35.874 11.192 1.00 48.51 ? 338 LEU A N 1
|
|
ATOM 853 C CA . LEU A 1 136 ? -18.519 35.856 12.584 1.00 46.59 ? 338 LEU A CA 1
|
|
ATOM 854 C C . LEU A 1 136 ? -17.319 35.767 13.520 1.00 53.56 ? 338 LEU A C 1
|
|
ATOM 855 O O . LEU A 1 136 ? -17.183 36.590 14.426 1.00 55.30 ? 338 LEU A O 1
|
|
ATOM 856 C CB . LEU A 1 136 ? -19.451 34.654 12.830 1.00 44.15 ? 338 LEU A CB 1
|
|
ATOM 857 C CG . LEU A 1 136 ? -20.882 34.704 12.246 1.00 46.58 ? 338 LEU A CG 1
|
|
ATOM 858 C CD1 . LEU A 1 136 ? -21.763 33.520 12.807 1.00 42.97 ? 338 LEU A CD1 1
|
|
ATOM 859 C CD2 . LEU A 1 136 ? -21.555 36.061 12.515 1.00 48.04 ? 338 LEU A CD2 1
|
|
ATOM 860 N N . HIS A 1 137 ? -16.429 34.784 13.269 1.00 48.82 ? 339 HIS A N 1
|
|
ATOM 861 C CA . HIS A 1 137 ? -15.250 34.502 14.086 1.00 46.93 ? 339 HIS A CA 1
|
|
ATOM 862 C C . HIS A 1 137 ? -14.251 35.643 14.027 1.00 53.58 ? 339 HIS A C 1
|
|
ATOM 863 O O . HIS A 1 137 ? -13.808 36.134 15.074 1.00 54.50 ? 339 HIS A O 1
|
|
ATOM 864 C CB . HIS A 1 137 ? -14.652 33.136 13.717 1.00 45.35 ? 339 HIS A CB 1
|
|
ATOM 865 C CG . HIS A 1 137 ? -15.552 31.960 14.036 1.00 46.09 ? 339 HIS A CG 1
|
|
ATOM 866 N ND1 . HIS A 1 137 ? -15.173 30.662 13.732 1.00 46.18 ? 339 HIS A ND1 1
|
|
ATOM 867 C CD2 . HIS A 1 137 ? -16.764 31.924 14.653 1.00 46.36 ? 339 HIS A CD2 1
|
|
ATOM 868 C CE1 . HIS A 1 137 ? -16.163 29.886 14.155 1.00 44.85 ? 339 HIS A CE1 1
|
|
ATOM 869 N NE2 . HIS A 1 137 ? -17.142 30.596 14.710 1.00 45.27 ? 339 HIS A NE2 1
|
|
ATOM 870 N N . GLU A 1 138 ? -14.010 36.157 12.814 1.00 51.15 ? 340 GLU A N 1
|
|
ATOM 871 C CA . GLU A 1 138 ? -13.171 37.332 12.580 1.00 51.96 ? 340 GLU A CA 1
|
|
ATOM 872 C C . GLU A 1 138 ? -13.637 38.542 13.395 1.00 57.21 ? 340 GLU A C 1
|
|
ATOM 873 O O . GLU A 1 138 ? -12.802 39.269 13.922 1.00 58.95 ? 340 GLU A O 1
|
|
ATOM 874 C CB . GLU A 1 138 ? -13.180 37.684 11.104 1.00 53.57 ? 340 GLU A CB 1
|
|
ATOM 875 C CG . GLU A 1 138 ? -12.356 36.703 10.311 1.00 62.05 ? 340 GLU A CG 1
|
|
ATOM 876 C CD . GLU A 1 138 ? -12.115 37.041 8.859 1.00 78.40 ? 340 GLU A CD 1
|
|
ATOM 877 O OE1 . GLU A 1 138 ? -12.954 37.750 8.251 1.00 61.49 ? 340 GLU A OE1 1
|
|
ATOM 878 O OE2 . GLU A 1 138 ? -11.096 36.550 8.318 1.00 75.89 ? 340 GLU A OE2 1
|
|
ATOM 879 N N . ASN A 1 139 ? -14.968 38.701 13.545 1.00 52.62 ? 341 ASN A N 1
|
|
ATOM 880 C CA . ASN A 1 139 ? -15.639 39.769 14.273 1.00 52.60 ? 341 ASN A CA 1
|
|
ATOM 881 C C . ASN A 1 139 ? -15.937 39.498 15.729 1.00 56.86 ? 341 ASN A C 1
|
|
ATOM 882 O O . ASN A 1 139 ? -16.611 40.313 16.358 1.00 57.92 ? 341 ASN A O 1
|
|
ATOM 883 C CB . ASN A 1 139 ? -16.900 40.168 13.543 1.00 51.82 ? 341 ASN A CB 1
|
|
ATOM 884 C CG . ASN A 1 139 ? -16.575 40.957 12.312 1.00 63.28 ? 341 ASN A CG 1
|
|
ATOM 885 O OD1 . ASN A 1 139 ? -16.274 42.153 12.375 1.00 60.65 ? 341 ASN A OD1 1
|
|
ATOM 886 N ND2 . ASN A 1 139 ? -16.515 40.277 11.187 1.00 49.56 ? 341 ASN A ND2 1
|
|
ATOM 887 N N . GLY A 1 140 ? -15.437 38.381 16.257 1.00 52.40 ? 342 GLY A N 1
|
|
ATOM 888 C CA . GLY A 1 140 ? -15.594 38.001 17.660 1.00 51.52 ? 342 GLY A CA 1
|
|
ATOM 889 C C . GLY A 1 140 ? -16.944 37.451 18.074 1.00 54.46 ? 342 GLY A C 1
|
|
ATOM 890 O O . GLY A 1 140 ? -17.277 37.496 19.258 1.00 55.19 ? 342 GLY A O 1
|
|
ATOM 891 N N . ILE A 1 141 ? -17.706 36.885 17.122 1.00 49.53 ? 343 ILE A N 1
|
|
ATOM 892 C CA . ILE A 1 141 ? -19.039 36.297 17.348 1.00 48.37 ? 343 ILE A CA 1
|
|
ATOM 893 C C . ILE A 1 141 ? -19.023 34.796 17.102 1.00 51.88 ? 343 ILE A C 1
|
|
ATOM 894 O O . ILE A 1 141 ? -18.562 34.359 16.049 1.00 51.78 ? 343 ILE A O 1
|
|
ATOM 895 C CB . ILE A 1 141 ? -20.121 36.984 16.430 1.00 50.62 ? 343 ILE A CB 1
|
|
ATOM 896 C CG1 . ILE A 1 141 ? -20.049 38.532 16.447 1.00 50.80 ? 343 ILE A CG1 1
|
|
ATOM 897 C CG2 . ILE A 1 141 ? -21.560 36.404 16.614 1.00 48.97 ? 343 ILE A CG2 1
|
|
ATOM 898 C CD1 . ILE A 1 141 ? -20.627 39.207 17.688 1.00 58.90 ? 343 ILE A CD1 1
|
|
ATOM 899 N N . ILE A 1 142 ? -19.553 34.023 18.063 1.00 50.17 ? 344 ILE A N 1
|
|
ATOM 900 C CA . ILE A 1 142 ? -19.766 32.564 17.990 1.00 50.24 ? 344 ILE A CA 1
|
|
ATOM 901 C C . ILE A 1 142 ? -21.299 32.405 17.924 1.00 51.31 ? 344 ILE A C 1
|
|
ATOM 902 O O . ILE A 1 142 ? -21.971 32.831 18.855 1.00 50.97 ? 344 ILE A O 1
|
|
ATOM 903 C CB . ILE A 1 142 ? -19.234 31.773 19.223 1.00 54.55 ? 344 ILE A CB 1
|
|
ATOM 904 C CG1 . ILE A 1 142 ? -17.798 32.101 19.592 1.00 55.68 ? 344 ILE A CG1 1
|
|
ATOM 905 C CG2 . ILE A 1 142 ? -19.406 30.259 19.023 1.00 56.66 ? 344 ILE A CG2 1
|
|
ATOM 906 C CD1 . ILE A 1 142 ? -17.582 31.758 21.073 1.00 58.55 ? 344 ILE A CD1 1
|
|
ATOM 907 N N . HIS A 1 143 ? -21.830 31.803 16.849 1.00 45.70 ? 345 HIS A N 1
|
|
ATOM 908 C CA . HIS A 1 143 ? -23.266 31.594 16.645 1.00 45.22 ? 345 HIS A CA 1
|
|
ATOM 909 C C . HIS A 1 143 ? -23.899 30.677 17.731 1.00 50.88 ? 345 HIS A C 1
|
|
ATOM 910 O O . HIS A 1 143 ? -24.953 30.997 18.287 1.00 51.19 ? 345 HIS A O 1
|
|
ATOM 911 C CB . HIS A 1 143 ? -23.530 31.080 15.229 1.00 45.28 ? 345 HIS A CB 1
|
|
ATOM 912 C CG . HIS A 1 143 ? -24.978 31.075 14.868 1.00 49.75 ? 345 HIS A CG 1
|
|
ATOM 913 N ND1 . HIS A 1 143 ? -25.816 30.023 15.238 1.00 52.10 ? 345 HIS A ND1 1
|
|
ATOM 914 C CD2 . HIS A 1 143 ? -25.706 31.996 14.203 1.00 51.96 ? 345 HIS A CD2 1
|
|
ATOM 915 C CE1 . HIS A 1 143 ? -27.010 30.335 14.781 1.00 51.93 ? 345 HIS A CE1 1
|
|
ATOM 916 N NE2 . HIS A 1 143 ? -26.998 31.511 14.154 1.00 52.71 ? 345 HIS A NE2 1
|
|
ATOM 917 N N . ARG A 1 144 ? -23.258 29.530 17.998 1.00 47.88 ? 346 ARG A N 1
|
|
ATOM 918 C CA . ARG A 1 144 ? -23.645 28.561 19.016 1.00 47.27 ? 346 ARG A CA 1
|
|
ATOM 919 C C . ARG A 1 144 ? -24.927 27.740 18.724 1.00 52.32 ? 346 ARG A C 1
|
|
ATOM 920 O O . ARG A 1 144 ? -25.262 26.859 19.511 1.00 55.00 ? 346 ARG A O 1
|
|
ATOM 921 C CB . ARG A 1 144 ? -23.674 29.234 20.408 1.00 44.20 ? 346 ARG A CB 1
|
|
ATOM 922 C CG . ARG A 1 144 ? -22.303 29.525 21.027 1.00 38.86 ? 346 ARG A CG 1
|
|
ATOM 923 C CD . ARG A 1 144 ? -22.397 30.100 22.428 1.00 48.46 ? 346 ARG A CD 1
|
|
ATOM 924 N NE . ARG A 1 144 ? -23.349 29.357 23.257 1.00 75.05 ? 346 ARG A NE 1
|
|
ATOM 925 C CZ . ARG A 1 144 ? -24.254 29.915 24.055 1.00 108.68 ? 346 ARG A CZ 1
|
|
ATOM 926 N NH1 . ARG A 1 144 ? -24.300 31.238 24.198 1.00 101.90 ? 346 ARG A NH1 1
|
|
ATOM 927 N NH2 . ARG A 1 144 ? -25.120 29.157 24.717 1.00 105.65 ? 346 ARG A NH2 1
|
|
ATOM 928 N N . ASP A 1 145 ? -25.636 28.001 17.626 1.00 47.49 ? 347 ASP A N 1
|
|
ATOM 929 C CA . ASP A 1 145 ? -26.855 27.255 17.300 1.00 48.24 ? 347 ASP A CA 1
|
|
ATOM 930 C C . ASP A 1 145 ? -27.039 27.046 15.778 1.00 55.03 ? 347 ASP A C 1
|
|
ATOM 931 O O . ASP A 1 145 ? -28.130 27.257 15.230 1.00 56.10 ? 347 ASP A O 1
|
|
ATOM 932 C CB . ASP A 1 145 ? -28.089 27.893 17.976 1.00 50.69 ? 347 ASP A CB 1
|
|
ATOM 933 C CG . ASP A 1 145 ? -29.362 27.060 17.961 1.00 58.93 ? 347 ASP A CG 1
|
|
ATOM 934 O OD1 . ASP A 1 145 ? -29.262 25.808 17.981 1.00 60.20 ? 347 ASP A OD1 1
|
|
ATOM 935 O OD2 . ASP A 1 145 ? -30.451 27.654 17.917 1.00 64.49 ? 347 ASP A OD2 1
|
|
ATOM 936 N N . LEU A 1 146 ? -25.950 26.627 15.087 1.00 50.29 ? 348 LEU A N 1
|
|
ATOM 937 C CA . LEU A 1 146 ? -25.986 26.374 13.640 1.00 48.38 ? 348 LEU A CA 1
|
|
ATOM 938 C C . LEU A 1 146 ? -26.635 25.020 13.365 1.00 52.80 ? 348 LEU A C 1
|
|
ATOM 939 O O . LEU A 1 146 ? -26.212 24.002 13.913 1.00 52.88 ? 348 LEU A O 1
|
|
ATOM 940 C CB . LEU A 1 146 ? -24.570 26.422 13.029 1.00 46.67 ? 348 LEU A CB 1
|
|
ATOM 941 C CG . LEU A 1 146 ? -23.872 27.773 12.997 1.00 49.50 ? 348 LEU A CG 1
|
|
ATOM 942 C CD1 . LEU A 1 146 ? -22.442 27.622 12.596 1.00 48.06 ? 348 LEU A CD1 1
|
|
ATOM 943 C CD2 . LEU A 1 146 ? -24.576 28.753 12.068 1.00 51.94 ? 348 LEU A CD2 1
|
|
ATOM 944 N N . LYS A 1 147 ? -27.721 25.033 12.582 1.00 49.55 ? 349 LYS A N 1
|
|
ATOM 945 C CA . LYS A 1 147 ? -28.484 23.855 12.150 1.00 49.07 ? 349 LYS A CA 1
|
|
ATOM 946 C C . LYS A 1 147 ? -29.207 24.181 10.843 1.00 56.51 ? 349 LYS A C 1
|
|
ATOM 947 O O . LYS A 1 147 ? -29.273 25.366 10.493 1.00 56.17 ? 349 LYS A O 1
|
|
ATOM 948 C CB . LYS A 1 147 ? -29.427 23.316 13.255 1.00 49.86 ? 349 LYS A CB 1
|
|
ATOM 949 C CG . LYS A 1 147 ? -30.253 24.339 13.987 1.00 56.06 ? 349 LYS A CG 1
|
|
ATOM 950 C CD . LYS A 1 147 ? -30.664 23.802 15.336 1.00 67.49 ? 349 LYS A CD 1
|
|
ATOM 951 C CE . LYS A 1 147 ? -31.978 24.413 15.782 1.00 80.04 ? 349 LYS A CE 1
|
|
ATOM 952 N NZ . LYS A 1 147 ? -32.167 24.316 17.255 1.00 93.27 ? 349 LYS A NZ 1
|
|
ATOM 953 N N . PRO A 1 148 ? -29.729 23.185 10.071 1.00 55.66 ? 350 PRO A N 1
|
|
ATOM 954 C CA . PRO A 1 148 ? -30.432 23.518 8.824 1.00 56.52 ? 350 PRO A CA 1
|
|
ATOM 955 C C . PRO A 1 148 ? -31.599 24.483 8.992 1.00 61.80 ? 350 PRO A C 1
|
|
ATOM 956 O O . PRO A 1 148 ? -31.887 25.246 8.063 1.00 62.95 ? 350 PRO A O 1
|
|
ATOM 957 C CB . PRO A 1 148 ? -30.908 22.152 8.325 1.00 59.88 ? 350 PRO A CB 1
|
|
ATOM 958 C CG . PRO A 1 148 ? -29.944 21.191 8.914 1.00 63.04 ? 350 PRO A CG 1
|
|
ATOM 959 C CD . PRO A 1 148 ? -29.717 21.723 10.277 1.00 57.38 ? 350 PRO A CD 1
|
|
ATOM 960 N N . GLU A 1 149 ? -32.250 24.486 10.173 1.00 58.16 ? 351 GLU A N 1
|
|
ATOM 961 C CA . GLU A 1 149 ? -33.390 25.401 10.417 1.00 58.34 ? 351 GLU A CA 1
|
|
ATOM 962 C C . GLU A 1 149 ? -33.016 26.885 10.574 1.00 59.74 ? 351 GLU A C 1
|
|
ATOM 963 O O . GLU A 1 149 ? -33.899 27.746 10.555 1.00 60.41 ? 351 GLU A O 1
|
|
ATOM 964 C CB . GLU A 1 149 ? -34.405 24.883 11.473 1.00 60.39 ? 351 GLU A CB 1
|
|
ATOM 965 C CG . GLU A 1 149 ? -33.803 24.050 12.584 1.00 68.13 ? 351 GLU A CG 1
|
|
ATOM 966 C CD . GLU A 1 149 ? -33.777 22.547 12.372 1.00 87.73 ? 351 GLU A CD 1
|
|
ATOM 967 O OE1 . GLU A 1 149 ? -34.865 21.932 12.439 1.00 109.82 ? 351 GLU A OE1 1
|
|
ATOM 968 O OE2 . GLU A 1 149 ? -32.671 21.970 12.253 1.00 62.32 ? 351 GLU A OE2 1
|
|
ATOM 969 N N . ASN A 1 150 ? -31.697 27.179 10.688 1.00 53.22 ? 352 ASN A N 1
|
|
ATOM 970 C CA . ASN A 1 150 ? -31.162 28.543 10.821 1.00 51.14 ? 352 ASN A CA 1
|
|
ATOM 971 C C . ASN A 1 150 ? -30.363 28.991 9.591 1.00 52.68 ? 352 ASN A C 1
|
|
ATOM 972 O O . ASN A 1 150 ? -29.694 30.028 9.619 1.00 50.26 ? 352 ASN A O 1
|
|
ATOM 973 C CB . ASN A 1 150 ? -30.348 28.693 12.108 1.00 50.51 ? 352 ASN A CB 1
|
|
ATOM 974 C CG . ASN A 1 150 ? -31.171 28.598 13.358 1.00 76.78 ? 352 ASN A CG 1
|
|
ATOM 975 O OD1 . ASN A 1 150 ? -32.346 28.992 13.408 1.00 85.65 ? 352 ASN A OD1 1
|
|
ATOM 976 N ND2 . ASN A 1 150 ? -30.568 28.064 14.397 1.00 62.43 ? 352 ASN A ND2 1
|
|
ATOM 977 N N . VAL A 1 151 ? -30.430 28.190 8.515 1.00 50.39 ? 353 VAL A N 1
|
|
ATOM 978 C CA . VAL A 1 151 ? -29.772 28.484 7.240 1.00 50.08 ? 353 VAL A CA 1
|
|
ATOM 979 C C . VAL A 1 151 ? -30.918 28.701 6.233 1.00 58.37 ? 353 VAL A C 1
|
|
ATOM 980 O O . VAL A 1 151 ? -31.654 27.751 5.946 1.00 60.22 ? 353 VAL A O 1
|
|
ATOM 981 C CB . VAL A 1 151 ? -28.754 27.393 6.797 1.00 50.95 ? 353 VAL A CB 1
|
|
ATOM 982 C CG1 . VAL A 1 151 ? -28.088 27.770 5.483 1.00 50.30 ? 353 VAL A CG1 1
|
|
ATOM 983 C CG2 . VAL A 1 151 ? -27.710 27.130 7.887 1.00 48.17 ? 353 VAL A CG2 1
|
|
ATOM 984 N N . LEU A 1 152 ? -31.113 29.974 5.776 1.00 54.16 ? 354 LEU A N 1
|
|
ATOM 985 C CA . LEU A 1 152 ? -32.184 30.347 4.847 1.00 54.91 ? 354 LEU A CA 1
|
|
ATOM 986 C C . LEU A 1 152 ? -31.708 30.459 3.408 1.00 59.02 ? 354 LEU A C 1
|
|
ATOM 987 O O . LEU A 1 152 ? -30.598 30.944 3.163 1.00 56.92 ? 354 LEU A O 1
|
|
ATOM 988 C CB . LEU A 1 152 ? -32.858 31.662 5.255 1.00 55.05 ? 354 LEU A CB 1
|
|
ATOM 989 C CG . LEU A 1 152 ? -33.334 31.814 6.689 1.00 57.54 ? 354 LEU A CG 1
|
|
ATOM 990 C CD1 . LEU A 1 152 ? -33.486 33.266 7.040 1.00 57.12 ? 354 LEU A CD1 1
|
|
ATOM 991 C CD2 . LEU A 1 152 ? -34.617 31.087 6.906 1.00 60.37 ? 354 LEU A CD2 1
|
|
ATOM 992 N N . LEU A 1 153 ? -32.576 30.048 2.461 1.00 56.93 ? 355 LEU A N 1
|
|
ATOM 993 C CA . LEU A 1 153 ? -32.310 30.099 1.019 1.00 58.52 ? 355 LEU A CA 1
|
|
ATOM 994 C C . LEU A 1 153 ? -32.998 31.335 0.394 1.00 64.13 ? 355 LEU A C 1
|
|
ATOM 995 O O . LEU A 1 153 ? -34.138 31.653 0.742 1.00 63.44 ? 355 LEU A O 1
|
|
ATOM 996 C CB . LEU A 1 153 ? -32.750 28.786 0.302 1.00 59.88 ? 355 LEU A CB 1
|
|
ATOM 997 C CG . LEU A 1 153 ? -32.466 27.409 0.968 1.00 61.74 ? 355 LEU A CG 1
|
|
ATOM 998 C CD1 . LEU A 1 153 ? -32.752 26.279 0.020 1.00 62.89 ? 355 LEU A CD1 1
|
|
ATOM 999 C CD2 . LEU A 1 153 ? -31.055 27.285 1.435 1.00 59.56 ? 355 LEU A CD2 1
|
|
ATOM 1000 N N . SER A 1 154 ? -32.294 32.041 -0.503 1.00 62.68 ? 356 SER A N 1
|
|
ATOM 1001 C CA . SER A 1 154 ? -32.799 33.278 -1.098 1.00 65.39 ? 356 SER A CA 1
|
|
ATOM 1002 C C . SER A 1 154 ? -33.935 33.125 -2.106 1.00 73.84 ? 356 SER A C 1
|
|
ATOM 1003 O O . SER A 1 154 ? -34.764 34.033 -2.243 1.00 75.05 ? 356 SER A O 1
|
|
ATOM 1004 C CB . SER A 1 154 ? -31.659 34.129 -1.646 1.00 69.23 ? 356 SER A CB 1
|
|
ATOM 1005 O OG . SER A 1 154 ? -31.037 33.470 -2.735 1.00 84.12 ? 356 SER A OG 1
|
|
ATOM 1006 N N . SER A 1 155 ? -33.975 31.990 -2.806 1.00 72.27 ? 357 SER A N 1
|
|
ATOM 1007 C CA . SER A 1 155 ? -35.010 31.698 -3.800 1.00 75.39 ? 357 SER A CA 1
|
|
ATOM 1008 C C . SER A 1 155 ? -35.335 30.205 -3.880 1.00 81.25 ? 357 SER A C 1
|
|
ATOM 1009 O O . SER A 1 155 ? -34.643 29.363 -3.299 1.00 79.69 ? 357 SER A O 1
|
|
ATOM 1010 C CB . SER A 1 155 ? -34.639 32.263 -5.175 1.00 80.00 ? 357 SER A CB 1
|
|
ATOM 1011 O OG . SER A 1 155 ? -33.581 31.567 -5.815 1.00 86.18 ? 357 SER A OG 1
|
|
ATOM 1012 N N . GLN A 1 156 ? -36.387 29.882 -4.613 1.00 81.34 ? 358 GLN A N 1
|
|
ATOM 1013 C CA . GLN A 1 156 ? -36.834 28.507 -4.791 1.00 82.71 ? 358 GLN A CA 1
|
|
ATOM 1014 C C . GLN A 1 156 ? -35.915 27.740 -5.784 1.00 86.23 ? 358 GLN A C 1
|
|
ATOM 1015 O O . GLN A 1 156 ? -36.120 26.548 -6.029 1.00 85.66 ? 358 GLN A O 1
|
|
ATOM 1016 C CB . GLN A 1 156 ? -38.322 28.490 -5.203 1.00 87.57 ? 358 GLN A CB 1
|
|
ATOM 1017 C CG . GLN A 1 156 ? -39.283 29.062 -4.144 1.00 103.89 ? 358 GLN A CG 1
|
|
ATOM 1018 C CD . GLN A 1 156 ? -39.460 30.573 -4.182 1.00 127.13 ? 358 GLN A CD 1
|
|
ATOM 1019 O OE1 . GLN A 1 156 ? -38.684 31.325 -4.802 1.00 119.59 ? 358 GLN A OE1 1
|
|
ATOM 1020 N NE2 . GLN A 1 156 ? -40.488 31.057 -3.490 1.00 123.25 ? 358 GLN A NE2 1
|
|
ATOM 1021 N N . GLU A 1 157 ? -34.881 28.431 -6.313 1.00 82.62 ? 359 GLU A N 1
|
|
ATOM 1022 C CA . GLU A 1 157 ? -33.881 27.893 -7.237 1.00 83.03 ? 359 GLU A CA 1
|
|
ATOM 1023 C C . GLU A 1 157 ? -32.817 27.210 -6.413 1.00 82.65 ? 359 GLU A C 1
|
|
ATOM 1024 O O . GLU A 1 157 ? -32.486 27.709 -5.335 1.00 80.50 ? 359 GLU A O 1
|
|
ATOM 1025 C CB . GLU A 1 157 ? -33.245 29.020 -8.069 1.00 85.59 ? 359 GLU A CB 1
|
|
ATOM 1026 C CG . GLU A 1 157 ? -34.224 29.767 -8.965 1.00 100.02 ? 359 GLU A CG 1
|
|
ATOM 1027 C CD . GLU A 1 157 ? -34.532 29.127 -10.305 1.00 124.03 ? 359 GLU A CD 1
|
|
ATOM 1028 O OE1 . GLU A 1 157 ? -34.034 28.008 -10.573 1.00 113.93 ? 359 GLU A OE1 1
|
|
ATOM 1029 O OE2 . GLU A 1 157 ? -35.264 29.762 -11.098 1.00 121.14 ? 359 GLU A OE2 1
|
|
ATOM 1030 N N . GLU A 1 158 ? -32.298 26.062 -6.888 1.00 78.30 ? 360 GLU A N 1
|
|
ATOM 1031 C CA . GLU A 1 158 ? -31.286 25.307 -6.144 1.00 75.33 ? 360 GLU A CA 1
|
|
ATOM 1032 C C . GLU A 1 158 ? -29.937 26.010 -6.097 1.00 74.58 ? 360 GLU A C 1
|
|
ATOM 1033 O O . GLU A 1 158 ? -29.187 25.829 -5.150 1.00 69.69 ? 360 GLU A O 1
|
|
ATOM 1034 C CB . GLU A 1 158 ? -31.211 23.815 -6.552 1.00 78.31 ? 360 GLU A CB 1
|
|
ATOM 1035 C CG . GLU A 1 158 ? -30.603 23.531 -7.913 1.00 94.10 ? 360 GLU A CG 1
|
|
ATOM 1036 C CD . GLU A 1 158 ? -30.512 22.064 -8.299 1.00 124.14 ? 360 GLU A CD 1
|
|
ATOM 1037 O OE1 . GLU A 1 158 ? -29.960 21.268 -7.504 1.00 126.26 ? 360 GLU A OE1 1
|
|
ATOM 1038 O OE2 . GLU A 1 158 ? -30.943 21.723 -9.425 1.00 116.23 ? 360 GLU A OE2 1
|
|
ATOM 1039 N N . ASP A 1 159 ? -29.647 26.828 -7.106 1.00 73.19 ? 361 ASP A N 1
|
|
ATOM 1040 C CA . ASP A 1 159 ? -28.433 27.625 -7.152 1.00 71.87 ? 361 ASP A CA 1
|
|
ATOM 1041 C C . ASP A 1 159 ? -28.897 28.979 -6.641 1.00 74.76 ? 361 ASP A C 1
|
|
ATOM 1042 O O . ASP A 1 159 ? -29.571 29.729 -7.359 1.00 76.84 ? 361 ASP A O 1
|
|
ATOM 1043 C CB . ASP A 1 159 ? -27.890 27.696 -8.594 1.00 76.78 ? 361 ASP A CB 1
|
|
ATOM 1044 C CG . ASP A 1 159 ? -27.101 26.485 -9.092 1.00 88.95 ? 361 ASP A CG 1
|
|
ATOM 1045 O OD1 . ASP A 1 159 ? -26.825 25.557 -8.270 1.00 87.14 ? 361 ASP A OD1 1
|
|
ATOM 1046 O OD2 . ASP A 1 159 ? -26.692 26.492 -10.283 1.00 95.23 ? 361 ASP A OD2 1
|
|
ATOM 1047 N N . CYS A 1 160 ? -28.680 29.223 -5.348 1.00 68.46 ? 362 CYS A N 1
|
|
ATOM 1048 C CA . CYS A 1 160 ? -29.126 30.455 -4.704 1.00 67.74 ? 362 CYS A CA 1
|
|
ATOM 1049 C C . CYS A 1 160 ? -28.201 30.898 -3.588 1.00 71.67 ? 362 CYS A C 1
|
|
ATOM 1050 O O . CYS A 1 160 ? -27.294 30.156 -3.177 1.00 70.66 ? 362 CYS A O 1
|
|
ATOM 1051 C CB . CYS A 1 160 ? -30.567 30.321 -4.215 1.00 68.04 ? 362 CYS A CB 1
|
|
ATOM 1052 S SG . CYS A 1 160 ? -30.772 29.202 -2.805 1.00 69.50 ? 362 CYS A SG 1
|
|
ATOM 1053 N N . LEU A 1 161 ? -28.438 32.122 -3.089 1.00 68.68 ? 363 LEU A N 1
|
|
ATOM 1054 C CA . LEU A 1 161 ? -27.673 32.650 -1.968 1.00 66.37 ? 363 LEU A CA 1
|
|
ATOM 1055 C C . LEU A 1 161 ? -28.296 32.170 -0.679 1.00 66.88 ? 363 LEU A C 1
|
|
ATOM 1056 O O . LEU A 1 161 ? -29.521 32.082 -0.571 1.00 66.49 ? 363 LEU A O 1
|
|
ATOM 1057 C CB . LEU A 1 161 ? -27.623 34.183 -1.988 1.00 67.45 ? 363 LEU A CB 1
|
|
ATOM 1058 C CG . LEU A 1 161 ? -26.731 34.831 -3.045 1.00 73.29 ? 363 LEU A CG 1
|
|
ATOM 1059 C CD1 . LEU A 1 161 ? -26.975 36.325 -3.088 1.00 74.62 ? 363 LEU A CD1 1
|
|
ATOM 1060 C CD2 . LEU A 1 161 ? -25.245 34.546 -2.778 1.00 72.95 ? 363 LEU A CD2 1
|
|
ATOM 1061 N N . ILE A 1 162 ? -27.456 31.809 0.280 1.00 61.80 ? 364 ILE A N 1
|
|
ATOM 1062 C CA . ILE A 1 162 ? -27.926 31.369 1.596 1.00 60.07 ? 364 ILE A CA 1
|
|
ATOM 1063 C C . ILE A 1 162 ? -27.567 32.448 2.622 1.00 63.46 ? 364 ILE A C 1
|
|
ATOM 1064 O O . ILE A 1 162 ? -26.633 33.227 2.394 1.00 65.25 ? 364 ILE A O 1
|
|
ATOM 1065 C CB . ILE A 1 162 ? -27.512 29.898 2.027 1.00 61.06 ? 364 ILE A CB 1
|
|
ATOM 1066 C CG1 . ILE A 1 162 ? -26.009 29.736 2.333 1.00 60.32 ? 364 ILE A CG1 1
|
|
ATOM 1067 C CG2 . ILE A 1 162 ? -27.957 28.870 1.020 1.00 60.16 ? 364 ILE A CG2 1
|
|
ATOM 1068 C CD1 . ILE A 1 162 ? -25.534 30.230 3.720 1.00 66.25 ? 364 ILE A CD1 1
|
|
ATOM 1069 N N . LYS A 1 163 ? -28.302 32.499 3.730 1.00 56.70 ? 365 LYS A N 1
|
|
ATOM 1070 C CA . LYS A 1 163 ? -28.037 33.442 4.814 1.00 54.08 ? 365 LYS A CA 1
|
|
ATOM 1071 C C . LYS A 1 163 ? -28.254 32.735 6.133 1.00 55.41 ? 365 LYS A C 1
|
|
ATOM 1072 O O . LYS A 1 163 ? -29.176 31.911 6.260 1.00 53.66 ? 365 LYS A O 1
|
|
ATOM 1073 C CB . LYS A 1 163 ? -28.893 34.728 4.712 1.00 57.30 ? 365 LYS A CB 1
|
|
ATOM 1074 C CG . LYS A 1 163 ? -28.586 35.581 3.476 1.00 62.92 ? 365 LYS A CG 1
|
|
ATOM 1075 C CD . LYS A 1 163 ? -29.118 36.986 3.601 1.00 71.43 ? 365 LYS A CD 1
|
|
ATOM 1076 C CE . LYS A 1 163 ? -29.258 37.597 2.228 1.00 77.00 ? 365 LYS A CE 1
|
|
ATOM 1077 N NZ . LYS A 1 163 ? -28.519 38.881 2.088 1.00 78.69 ? 365 LYS A NZ 1
|
|
ATOM 1078 N N . ILE A 1 164 ? -27.351 33.005 7.092 1.00 51.61 ? 366 ILE A N 1
|
|
ATOM 1079 C CA . ILE A 1 164 ? -27.369 32.473 8.448 1.00 50.40 ? 366 ILE A CA 1
|
|
ATOM 1080 C C . ILE A 1 164 ? -28.279 33.391 9.232 1.00 56.32 ? 366 ILE A C 1
|
|
ATOM 1081 O O . ILE A 1 164 ? -28.151 34.614 9.153 1.00 56.94 ? 366 ILE A O 1
|
|
ATOM 1082 C CB . ILE A 1 164 ? -25.922 32.387 9.053 1.00 52.97 ? 366 ILE A CB 1
|
|
ATOM 1083 C CG1 . ILE A 1 164 ? -24.995 31.448 8.249 1.00 52.93 ? 366 ILE A CG1 1
|
|
ATOM 1084 C CG2 . ILE A 1 164 ? -25.901 32.039 10.548 1.00 54.71 ? 366 ILE A CG2 1
|
|
ATOM 1085 C CD1 . ILE A 1 164 ? -25.395 30.014 8.155 1.00 57.63 ? 366 ILE A CD1 1
|
|
ATOM 1086 N N . THR A 1 165 ? -29.212 32.795 9.976 1.00 54.54 ? 367 THR A N 1
|
|
ATOM 1087 C CA . THR A 1 165 ? -30.175 33.491 10.821 1.00 54.83 ? 367 THR A CA 1
|
|
ATOM 1088 C C . THR A 1 165 ? -30.117 32.968 12.277 1.00 57.47 ? 367 THR A C 1
|
|
ATOM 1089 O O . THR A 1 165 ? -29.385 32.020 12.562 1.00 53.77 ? 367 THR A O 1
|
|
ATOM 1090 C CB . THR A 1 165 ? -31.563 33.407 10.169 1.00 62.83 ? 367 THR A CB 1
|
|
ATOM 1091 O OG1 . THR A 1 165 ? -32.400 34.444 10.681 1.00 70.60 ? 367 THR A OG1 1
|
|
ATOM 1092 C CG2 . THR A 1 165 ? -32.227 32.050 10.349 1.00 58.64 ? 367 THR A CG2 1
|
|
ATOM 1093 N N . ASP A 1 166 ? -30.898 33.600 13.183 1.00 57.97 ? 368 ASP A N 1
|
|
ATOM 1094 C CA . ASP A 1 166 ? -31.081 33.238 14.602 1.00 58.66 ? 368 ASP A CA 1
|
|
ATOM 1095 C C . ASP A 1 166 ? -29.811 33.339 15.464 1.00 58.13 ? 368 ASP A C 1
|
|
ATOM 1096 O O . ASP A 1 166 ? -29.145 32.334 15.750 1.00 56.29 ? 368 ASP A O 1
|
|
ATOM 1097 C CB . ASP A 1 166 ? -31.860 31.898 14.749 1.00 62.14 ? 368 ASP A CB 1
|
|
ATOM 1098 C CG . ASP A 1 166 ? -32.180 31.427 16.155 1.00 85.15 ? 368 ASP A CG 1
|
|
ATOM 1099 O OD1 . ASP A 1 166 ? -32.348 32.299 17.061 1.00 88.07 ? 368 ASP A OD1 1
|
|
ATOM 1100 O OD2 . ASP A 1 166 ? -32.313 30.191 16.349 1.00 94.81 ? 368 ASP A OD2 1
|
|
ATOM 1101 N N . PHE A 1 167 ? -29.500 34.586 15.881 1.00 51.77 ? 369 PHE A N 1
|
|
ATOM 1102 C CA . PHE A 1 167 ? -28.343 34.903 16.702 1.00 49.29 ? 369 PHE A CA 1
|
|
ATOM 1103 C C . PHE A 1 167 ? -28.725 35.028 18.166 1.00 56.08 ? 369 PHE A C 1
|
|
ATOM 1104 O O . PHE A 1 167 ? -28.002 35.645 18.935 1.00 58.38 ? 369 PHE A O 1
|
|
ATOM 1105 C CB . PHE A 1 167 ? -27.624 36.142 16.159 1.00 50.32 ? 369 PHE A CB 1
|
|
ATOM 1106 C CG . PHE A 1 167 ? -26.961 35.886 14.820 1.00 50.29 ? 369 PHE A CG 1
|
|
ATOM 1107 C CD1 . PHE A 1 167 ? -27.694 35.953 13.634 1.00 54.16 ? 369 PHE A CD1 1
|
|
ATOM 1108 C CD2 . PHE A 1 167 ? -25.607 35.595 14.743 1.00 49.82 ? 369 PHE A CD2 1
|
|
ATOM 1109 C CE1 . PHE A 1 167 ? -27.093 35.699 12.399 1.00 54.39 ? 369 PHE A CE1 1
|
|
ATOM 1110 C CE2 . PHE A 1 167 ? -24.999 35.355 13.505 1.00 53.09 ? 369 PHE A CE2 1
|
|
ATOM 1111 C CZ . PHE A 1 167 ? -25.745 35.394 12.344 1.00 52.29 ? 369 PHE A CZ 1
|
|
ATOM 1112 N N . GLY A 1 168 ? -29.839 34.395 18.541 1.00 52.74 ? 370 GLY A N 1
|
|
ATOM 1113 C CA . GLY A 1 168 ? -30.393 34.365 19.885 1.00 53.89 ? 370 GLY A CA 1
|
|
ATOM 1114 C C . GLY A 1 168 ? -29.511 33.722 20.930 1.00 61.32 ? 370 GLY A C 1
|
|
ATOM 1115 O O . GLY A 1 168 ? -29.521 34.156 22.084 1.00 64.77 ? 370 GLY A O 1
|
|
ATOM 1116 N N . HIS A 1 169 ? -28.766 32.676 20.551 1.00 58.11 ? 371 HIS A N 1
|
|
ATOM 1117 C CA . HIS A 1 169 ? -27.835 31.942 21.427 1.00 58.13 ? 371 HIS A CA 1
|
|
ATOM 1118 C C . HIS A 1 169 ? -26.375 32.323 21.160 1.00 57.17 ? 371 HIS A C 1
|
|
ATOM 1119 O O . HIS A 1 169 ? -25.476 31.697 21.711 1.00 54.02 ? 371 HIS A O 1
|
|
ATOM 1120 C CB . HIS A 1 169 ? -28.007 30.417 21.259 1.00 60.08 ? 371 HIS A CB 1
|
|
ATOM 1121 C CG . HIS A 1 169 ? -29.396 29.945 21.537 1.00 66.68 ? 371 HIS A CG 1
|
|
ATOM 1122 N ND1 . HIS A 1 169 ? -30.207 29.460 20.527 1.00 69.91 ? 371 HIS A ND1 1
|
|
ATOM 1123 C CD2 . HIS A 1 169 ? -30.098 29.957 22.692 1.00 70.99 ? 371 HIS A CD2 1
|
|
ATOM 1124 C CE1 . HIS A 1 169 ? -31.358 29.150 21.108 1.00 71.16 ? 371 HIS A CE1 1
|
|
ATOM 1125 N NE2 . HIS A 1 169 ? -31.338 29.434 22.410 1.00 72.28 ? 371 HIS A NE2 1
|
|
ATOM 1126 N N . SER A 1 170 ? -26.136 33.322 20.294 1.00 54.31 ? 372 SER A N 1
|
|
ATOM 1127 C CA . SER A 1 170 ? -24.778 33.717 19.947 1.00 53.41 ? 372 SER A CA 1
|
|
ATOM 1128 C C . SER A 1 170 ? -24.037 34.406 21.087 1.00 58.61 ? 372 SER A C 1
|
|
ATOM 1129 O O . SER A 1 170 ? -24.686 34.909 22.000 1.00 60.23 ? 372 SER A O 1
|
|
ATOM 1130 C CB . SER A 1 170 ? -24.724 34.447 18.610 1.00 55.61 ? 372 SER A CB 1
|
|
ATOM 1131 O OG . SER A 1 170 ? -25.365 35.705 18.666 1.00 67.33 ? 372 SER A OG 1
|
|
ATOM 1132 N N . LYS A 1 171 ? -22.698 34.307 21.115 1.00 55.27 ? 373 LYS A N 1
|
|
ATOM 1133 C CA . LYS A 1 171 ? -21.866 34.877 22.188 1.00 56.25 ? 373 LYS A CA 1
|
|
ATOM 1134 C C . LYS A 1 171 ? -20.788 35.799 21.618 1.00 63.31 ? 373 LYS A C 1
|
|
ATOM 1135 O O . LYS A 1 171 ? -20.383 35.608 20.474 1.00 62.43 ? 373 LYS A O 1
|
|
ATOM 1136 C CB . LYS A 1 171 ? -21.231 33.760 23.045 1.00 56.58 ? 373 LYS A CB 1
|
|
ATOM 1137 N N . ILE A 1 172 ? -20.343 36.807 22.402 1.00 63.74 ? 374 ILE A N 1
|
|
ATOM 1138 C CA . ILE A 1 172 ? -19.264 37.740 22.029 1.00 64.88 ? 374 ILE A CA 1
|
|
ATOM 1139 C C . ILE A 1 172 ? -17.994 37.363 22.801 1.00 73.15 ? 374 ILE A C 1
|
|
ATOM 1140 O O . ILE A 1 172 ? -18.042 37.229 24.021 1.00 73.31 ? 374 ILE A O 1
|
|
ATOM 1141 C CB . ILE A 1 172 ? -19.625 39.234 22.228 1.00 68.53 ? 374 ILE A CB 1
|
|
ATOM 1142 C CG1 . ILE A 1 172 ? -20.810 39.632 21.358 1.00 68.60 ? 374 ILE A CG1 1
|
|
ATOM 1143 C CG2 . ILE A 1 172 ? -18.417 40.125 21.923 1.00 68.99 ? 374 ILE A CG2 1
|
|
ATOM 1144 C CD1 . ILE A 1 172 ? -21.616 40.788 21.924 1.00 75.06 ? 374 ILE A CD1 1
|
|
ATOM 1145 N N . LEU A 1 173 ? -16.864 37.238 22.088 1.00 72.97 ? 375 LEU A N 1
|
|
ATOM 1146 C CA . LEU A 1 173 ? -15.550 36.855 22.625 1.00 74.58 ? 375 LEU A CA 1
|
|
ATOM 1147 C C . LEU A 1 173 ? -14.880 37.849 23.574 1.00 87.09 ? 375 LEU A C 1
|
|
ATOM 1148 O O . LEU A 1 173 ? -14.155 37.420 24.486 1.00 88.69 ? 375 LEU A O 1
|
|
ATOM 1149 C CB . LEU A 1 173 ? -14.628 36.418 21.496 1.00 73.12 ? 375 LEU A CB 1
|
|
ATOM 1150 C CG . LEU A 1 173 ? -15.174 35.239 20.712 1.00 75.12 ? 375 LEU A CG 1
|
|
ATOM 1151 C CD1 . LEU A 1 173 ? -14.353 34.955 19.491 1.00 73.96 ? 375 LEU A CD1 1
|
|
ATOM 1152 C CD2 . LEU A 1 173 ? -15.257 34.037 21.585 1.00 78.64 ? 375 LEU A CD2 1
|
|
ATOM 1153 N N . GLY A 1 174 ? -15.163 39.140 23.369 1.00 94.85 ? 376 GLY A N 1
|
|
ATOM 1154 C CA . GLY A 1 174 ? -14.716 40.285 24.171 1.00 97.53 ? 376 GLY A CA 1
|
|
ATOM 1155 C C . GLY A 1 174 ? -13.352 40.257 24.848 1.00 105.33 ? 376 GLY A C 1
|
|
ATOM 1156 O O . GLY A 1 174 ? -12.323 40.094 24.179 1.00 106.36 ? 376 GLY A O 1
|
|
ATOM 1157 N N . GLU A 1 175 ? -13.337 40.480 26.188 1.00 102.78 ? 377 GLU A N 1
|
|
ATOM 1158 C CA . GLU A 1 175 ? -12.119 40.494 27.010 1.00 103.43 ? 377 GLU A CA 1
|
|
ATOM 1159 C C . GLU A 1 175 ? -12.298 39.528 28.175 1.00 105.16 ? 377 GLU A C 1
|
|
ATOM 1160 O O . GLU A 1 175 ? -13.061 39.797 29.107 1.00 105.26 ? 377 GLU A O 1
|
|
ATOM 1161 C CB . GLU A 1 175 ? -11.770 41.916 27.489 1.00 106.79 ? 377 GLU A CB 1
|
|
ATOM 1162 N N . THR A 1 176 ? -11.625 38.376 28.077 1.00 99.03 ? 378 THR A N 1
|
|
ATOM 1163 C CA . THR A 1 176 ? -11.691 37.273 29.028 1.00 96.27 ? 378 THR A CA 1
|
|
ATOM 1164 C C . THR A 1 176 ? -11.220 37.657 30.424 1.00 97.77 ? 378 THR A C 1
|
|
ATOM 1165 O O . THR A 1 176 ? -10.250 38.410 30.585 1.00 98.84 ? 378 THR A O 1
|
|
ATOM 1166 C CB . THR A 1 176 ? -10.989 36.029 28.456 1.00 103.26 ? 378 THR A CB 1
|
|
ATOM 1167 O OG1 . THR A 1 176 ? -11.260 35.941 27.052 1.00 105.81 ? 378 THR A OG1 1
|
|
ATOM 1168 C CG2 . THR A 1 176 ? -11.449 34.748 29.119 1.00 100.42 ? 378 THR A CG2 1
|
|
ATOM 1169 N N . SER A 1 177 ? -11.944 37.145 31.438 1.00 90.12 ? 379 SER A N 1
|
|
ATOM 1170 C CA . SER A 1 177 ? -11.607 37.334 32.837 1.00 88.62 ? 379 SER A CA 1
|
|
ATOM 1171 C C . SER A 1 177 ? -10.360 36.490 33.149 1.00 88.13 ? 379 SER A C 1
|
|
ATOM 1172 O O . SER A 1 177 ? -9.638 36.810 34.092 1.00 89.82 ? 379 SER A O 1
|
|
ATOM 1173 C CB . SER A 1 177 ? -12.780 36.948 33.736 1.00 91.59 ? 379 SER A CB 1
|
|
ATOM 1174 O OG . SER A 1 177 ? -13.143 35.584 33.591 1.00 101.90 ? 379 SER A OG 1
|
|
ATOM 1175 N N . LEU A 1 178 ? -10.093 35.443 32.331 1.00 78.82 ? 380 LEU A N 1
|
|
ATOM 1176 C CA . LEU A 1 178 ? -8.926 34.583 32.467 1.00 76.91 ? 380 LEU A CA 1
|
|
ATOM 1177 C C . LEU A 1 178 ? -7.647 35.367 32.169 1.00 84.05 ? 380 LEU A C 1
|
|
ATOM 1178 O O . LEU A 1 178 ? -6.678 35.241 32.922 1.00 83.87 ? 380 LEU A O 1
|
|
ATOM 1179 C CB . LEU A 1 178 ? -9.043 33.318 31.597 1.00 74.57 ? 380 LEU A CB 1
|
|
ATOM 1180 C CG . LEU A 1 178 ? -7.909 32.289 31.684 1.00 77.14 ? 380 LEU A CG 1
|
|
ATOM 1181 C CD1 . LEU A 1 178 ? -7.782 31.695 33.069 1.00 76.14 ? 380 LEU A CD1 1
|
|
ATOM 1182 C CD2 . LEU A 1 178 ? -8.115 31.196 30.706 1.00 76.87 ? 380 LEU A CD2 1
|
|
ATOM 1183 N N . MET A 1 179 ? -7.663 36.210 31.119 1.00 83.09 ? 381 MET A N 1
|
|
ATOM 1184 C CA . MET A 1 179 ? -6.521 37.055 30.760 1.00 86.26 ? 381 MET A CA 1
|
|
ATOM 1185 C C . MET A 1 179 ? -6.204 38.015 31.917 1.00 90.24 ? 381 MET A C 1
|
|
ATOM 1186 O O . MET A 1 179 ? -5.037 38.159 32.284 1.00 91.46 ? 381 MET A O 1
|
|
ATOM 1187 C CB . MET A 1 179 ? -6.775 37.823 29.454 1.00 90.39 ? 381 MET A CB 1
|
|
ATOM 1188 C CG . MET A 1 179 ? -7.081 36.925 28.254 1.00 94.95 ? 381 MET A CG 1
|
|
ATOM 1189 S SD . MET A 1 179 ? -7.744 37.856 26.824 1.00 101.41 ? 381 MET A SD 1
|
|
ATOM 1190 C CE . MET A 1 179 ? -8.269 36.495 25.758 1.00 96.67 ? 381 MET A CE 1
|
|
ATOM 1191 N N . ARG A 1 180 ? -7.253 38.605 32.538 1.00 85.36 ? 382 ARG A N 1
|
|
ATOM 1192 C CA . ARG A 1 180 ? -7.147 39.495 33.706 1.00 85.47 ? 382 ARG A CA 1
|
|
ATOM 1193 C C . ARG A 1 180 ? -6.556 38.747 34.932 1.00 86.19 ? 382 ARG A C 1
|
|
ATOM 1194 O O . ARG A 1 180 ? -5.651 39.275 35.574 1.00 86.46 ? 382 ARG A O 1
|
|
ATOM 1195 C CB . ARG A 1 180 ? -8.515 40.122 34.038 1.00 85.45 ? 382 ARG A CB 1
|
|
ATOM 1196 N N . THR A 1 181 ? -7.045 37.507 35.218 1.00 79.82 ? 383 THR A N 1
|
|
ATOM 1197 C CA . THR A 1 181 ? -6.591 36.604 36.299 1.00 78.31 ? 383 THR A CA 1
|
|
ATOM 1198 C C . THR A 1 181 ? -5.112 36.221 36.089 1.00 81.98 ? 383 THR A C 1
|
|
ATOM 1199 O O . THR A 1 181 ? -4.351 36.176 37.052 1.00 82.14 ? 383 THR A O 1
|
|
ATOM 1200 C CB . THR A 1 181 ? -7.527 35.362 36.379 1.00 84.23 ? 383 THR A CB 1
|
|
ATOM 1201 O OG1 . THR A 1 181 ? -8.829 35.757 36.812 1.00 87.48 ? 383 THR A OG1 1
|
|
ATOM 1202 C CG2 . THR A 1 181 ? -7.030 34.293 37.318 1.00 80.07 ? 383 THR A CG2 1
|
|
ATOM 1203 N N . LEU A 1 182 ? -4.708 35.970 34.827 1.00 78.34 ? 384 LEU A N 1
|
|
ATOM 1204 C CA . LEU A 1 182 ? -3.335 35.604 34.482 1.00 78.68 ? 384 LEU A CA 1
|
|
ATOM 1205 C C . LEU A 1 182 ? -2.367 36.750 34.662 1.00 86.96 ? 384 LEU A C 1
|
|
ATOM 1206 O O . LEU A 1 182 ? -1.161 36.509 34.723 1.00 89.69 ? 384 LEU A O 1
|
|
ATOM 1207 C CB . LEU A 1 182 ? -3.213 35.044 33.047 1.00 77.53 ? 384 LEU A CB 1
|
|
ATOM 1208 C CG . LEU A 1 182 ? -3.826 33.681 32.720 1.00 77.98 ? 384 LEU A CG 1
|
|
ATOM 1209 C CD1 . LEU A 1 182 ? -3.425 33.254 31.343 1.00 76.98 ? 384 LEU A CD1 1
|
|
ATOM 1210 C CD2 . LEU A 1 182 ? -3.471 32.614 33.760 1.00 77.65 ? 384 LEU A CD2 1
|
|
ATOM 1211 N N . CYS A 1 183 ? -2.864 37.993 34.730 1.00 84.25 ? 385 CYS A N 1
|
|
ATOM 1212 C CA . CYS A 1 183 ? -1.976 39.137 34.925 1.00 87.17 ? 385 CYS A CA 1
|
|
ATOM 1213 C C . CYS A 1 183 ? -1.432 39.198 36.350 1.00 91.65 ? 385 CYS A C 1
|
|
ATOM 1214 O O . CYS A 1 183 ? -0.367 39.779 36.578 1.00 93.20 ? 385 CYS A O 1
|
|
ATOM 1215 C CB . CYS A 1 183 ? -2.640 40.441 34.503 1.00 88.78 ? 385 CYS A CB 1
|
|
ATOM 1216 S SG . CYS A 1 183 ? -2.786 40.640 32.710 1.00 93.21 ? 385 CYS A SG 1
|
|
ATOM 1217 N N . GLY A 1 184 ? -2.135 38.542 37.274 1.00 86.75 ? 386 GLY A N 1
|
|
ATOM 1218 C CA . GLY A 1 184 ? -1.730 38.459 38.669 1.00 87.61 ? 386 GLY A CA 1
|
|
ATOM 1219 C C . GLY A 1 184 ? -0.807 37.300 39.011 1.00 91.83 ? 386 GLY A C 1
|
|
ATOM 1220 O O . GLY A 1 184 ? -0.397 36.516 38.144 1.00 90.55 ? 386 GLY A O 1
|
|
ATOM 1221 N N . THR A 1 185 ? -0.467 37.202 40.302 1.00 89.36 ? 387 THR A N 1
|
|
ATOM 1222 C CA . THR A 1 185 ? 0.347 36.121 40.842 1.00 88.98 ? 387 THR A CA 1
|
|
ATOM 1223 C C . THR A 1 185 ? -0.611 34.980 41.175 1.00 88.87 ? 387 THR A C 1
|
|
ATOM 1224 O O . THR A 1 185 ? -1.714 35.230 41.686 1.00 88.80 ? 387 THR A O 1
|
|
ATOM 1225 C CB . THR A 1 185 ? 1.215 36.587 42.033 1.00 103.04 ? 387 THR A CB 1
|
|
ATOM 1226 O OG1 . THR A 1 185 ? 2.165 35.564 42.355 1.00 101.68 ? 387 THR A OG1 1
|
|
ATOM 1227 C CG2 . THR A 1 185 ? 0.386 36.993 43.282 1.00 103.52 ? 387 THR A CG2 1
|
|
ATOM 1228 N N . PRO A 1 186 ? -0.239 33.725 40.871 1.00 81.57 ? 388 PRO A N 1
|
|
ATOM 1229 C CA . PRO A 1 186 ? -1.167 32.621 41.132 1.00 77.88 ? 388 PRO A CA 1
|
|
ATOM 1230 C C . PRO A 1 186 ? -1.056 32.001 42.519 1.00 75.88 ? 388 PRO A C 1
|
|
ATOM 1231 O O . PRO A 1 186 ? -1.617 30.934 42.725 1.00 73.79 ? 388 PRO A O 1
|
|
ATOM 1232 C CB . PRO A 1 186 ? -0.855 31.638 40.007 1.00 79.60 ? 388 PRO A CB 1
|
|
ATOM 1233 C CG . PRO A 1 186 ? 0.596 31.893 39.672 1.00 86.48 ? 388 PRO A CG 1
|
|
ATOM 1234 C CD . PRO A 1 186 ? 0.996 33.241 40.225 1.00 83.79 ? 388 PRO A CD 1
|
|
ATOM 1235 N N . THR A 1 187 ? -0.402 32.683 43.482 1.00 71.02 ? 389 THR A N 1
|
|
ATOM 1236 C CA . THR A 1 187 ? -0.257 32.190 44.862 1.00 70.51 ? 389 THR A CA 1
|
|
ATOM 1237 C C . THR A 1 187 ? -1.563 31.571 45.379 1.00 71.87 ? 389 THR A C 1
|
|
ATOM 1238 O O . THR A 1 187 ? -1.558 30.433 45.858 1.00 70.73 ? 389 THR A O 1
|
|
ATOM 1239 C CB . THR A 1 187 ? 0.262 33.282 45.823 1.00 75.14 ? 389 THR A CB 1
|
|
ATOM 1240 O OG1 . THR A 1 187 ? 1.075 34.208 45.111 1.00 77.52 ? 389 THR A OG1 1
|
|
ATOM 1241 C CG2 . THR A 1 187 ? 1.056 32.701 46.980 1.00 72.09 ? 389 THR A CG2 1
|
|
ATOM 1242 N N . TYR A 1 188 ? -2.689 32.297 45.181 1.00 66.61 ? 390 TYR A N 1
|
|
ATOM 1243 C CA . TYR A 1 188 ? -4.030 31.895 45.599 1.00 62.99 ? 390 TYR A CA 1
|
|
ATOM 1244 C C . TYR A 1 188 ? -4.897 31.293 44.472 1.00 63.66 ? 390 TYR A C 1
|
|
ATOM 1245 O O . TYR A 1 188 ? -6.036 30.924 44.730 1.00 63.51 ? 390 TYR A O 1
|
|
ATOM 1246 C CB . TYR A 1 188 ? -4.732 33.073 46.279 1.00 62.92 ? 390 TYR A CB 1
|
|
ATOM 1247 C CG . TYR A 1 188 ? -3.863 33.792 47.282 1.00 64.08 ? 390 TYR A CG 1
|
|
ATOM 1248 C CD1 . TYR A 1 188 ? -3.805 33.376 48.608 1.00 65.91 ? 390 TYR A CD1 1
|
|
ATOM 1249 C CD2 . TYR A 1 188 ? -3.100 34.894 46.909 1.00 65.85 ? 390 TYR A CD2 1
|
|
ATOM 1250 C CE1 . TYR A 1 188 ? -2.969 34.004 49.528 1.00 67.56 ? 390 TYR A CE1 1
|
|
ATOM 1251 C CE2 . TYR A 1 188 ? -2.289 35.554 47.827 1.00 68.80 ? 390 TYR A CE2 1
|
|
ATOM 1252 C CZ . TYR A 1 188 ? -2.217 35.099 49.135 1.00 76.65 ? 390 TYR A CZ 1
|
|
ATOM 1253 O OH . TYR A 1 188 ? -1.432 35.765 50.046 1.00 79.61 ? 390 TYR A OH 1
|
|
ATOM 1254 N N . LEU A 1 189 ? -4.358 31.147 43.259 1.00 58.42 ? 391 LEU A N 1
|
|
ATOM 1255 C CA . LEU A 1 189 ? -5.106 30.618 42.126 1.00 57.71 ? 391 LEU A CA 1
|
|
ATOM 1256 C C . LEU A 1 189 ? -5.298 29.082 42.092 1.00 62.34 ? 391 LEU A C 1
|
|
ATOM 1257 O O . LEU A 1 189 ? -4.313 28.341 42.057 1.00 62.36 ? 391 LEU A O 1
|
|
ATOM 1258 C CB . LEU A 1 189 ? -4.468 31.114 40.831 1.00 58.63 ? 391 LEU A CB 1
|
|
ATOM 1259 C CG . LEU A 1 189 ? -5.308 31.061 39.575 1.00 62.92 ? 391 LEU A CG 1
|
|
ATOM 1260 C CD1 . LEU A 1 189 ? -6.648 31.779 39.751 1.00 60.91 ? 391 LEU A CD1 1
|
|
ATOM 1261 C CD2 . LEU A 1 189 ? -4.542 31.648 38.424 1.00 69.30 ? 391 LEU A CD2 1
|
|
ATOM 1262 N N . ALA A 1 190 ? -6.592 28.624 42.055 1.00 57.40 ? 392 ALA A N 1
|
|
ATOM 1263 C CA . ALA A 1 190 ? -7.044 27.225 42.002 1.00 54.31 ? 392 ALA A CA 1
|
|
ATOM 1264 C C . ALA A 1 190 ? -6.438 26.551 40.801 1.00 57.40 ? 392 ALA A C 1
|
|
ATOM 1265 O O . ALA A 1 190 ? -6.268 27.226 39.775 1.00 56.64 ? 392 ALA A O 1
|
|
ATOM 1266 C CB . ALA A 1 190 ? -8.555 27.158 41.925 1.00 53.58 ? 392 ALA A CB 1
|
|
ATOM 1267 N N . PRO A 1 191 ? -6.071 25.241 40.923 1.00 53.45 ? 393 PRO A N 1
|
|
ATOM 1268 C CA . PRO A 1 191 ? -5.438 24.543 39.798 1.00 53.94 ? 393 PRO A CA 1
|
|
ATOM 1269 C C . PRO A 1 191 ? -6.290 24.424 38.541 1.00 58.67 ? 393 PRO A C 1
|
|
ATOM 1270 O O . PRO A 1 191 ? -5.767 24.607 37.448 1.00 60.33 ? 393 PRO A O 1
|
|
ATOM 1271 C CB . PRO A 1 191 ? -5.097 23.165 40.375 1.00 55.93 ? 393 PRO A CB 1
|
|
ATOM 1272 C CG . PRO A 1 191 ? -5.325 23.246 41.814 1.00 58.98 ? 393 PRO A CG 1
|
|
ATOM 1273 C CD . PRO A 1 191 ? -6.253 24.331 42.072 1.00 53.82 ? 393 PRO A CD 1
|
|
ATOM 1274 N N . GLU A 1 192 ? -7.588 24.148 38.676 1.00 53.23 ? 394 GLU A N 1
|
|
ATOM 1275 C CA . GLU A 1 192 ? -8.450 24.019 37.495 1.00 52.18 ? 394 GLU A CA 1
|
|
ATOM 1276 C C . GLU A 1 192 ? -8.444 25.254 36.563 1.00 58.08 ? 394 GLU A C 1
|
|
ATOM 1277 O O . GLU A 1 192 ? -8.698 25.118 35.357 1.00 59.54 ? 394 GLU A O 1
|
|
ATOM 1278 C CB . GLU A 1 192 ? -9.874 23.603 37.882 1.00 51.84 ? 394 GLU A CB 1
|
|
ATOM 1279 C CG . GLU A 1 192 ? -10.578 24.617 38.754 1.00 54.00 ? 394 GLU A CG 1
|
|
ATOM 1280 C CD . GLU A 1 192 ? -10.525 24.469 40.260 1.00 53.92 ? 394 GLU A CD 1
|
|
ATOM 1281 O OE1 . GLU A 1 192 ? -9.622 23.797 40.812 1.00 56.38 ? 394 GLU A OE1 1
|
|
ATOM 1282 O OE2 . GLU A 1 192 ? -11.402 25.086 40.898 1.00 42.55 ? 394 GLU A OE2 1
|
|
ATOM 1283 N N . VAL A 1 193 ? -8.139 26.447 37.128 1.00 52.07 ? 395 VAL A N 1
|
|
ATOM 1284 C CA . VAL A 1 193 ? -8.082 27.693 36.375 1.00 50.11 ? 395 VAL A CA 1
|
|
ATOM 1285 C C . VAL A 1 193 ? -6.848 27.656 35.484 1.00 52.80 ? 395 VAL A C 1
|
|
ATOM 1286 O O . VAL A 1 193 ? -6.929 28.002 34.304 1.00 53.32 ? 395 VAL A O 1
|
|
ATOM 1287 C CB . VAL A 1 193 ? -8.141 28.923 37.307 1.00 52.98 ? 395 VAL A CB 1
|
|
ATOM 1288 C CG1 . VAL A 1 193 ? -7.961 30.219 36.529 1.00 52.77 ? 395 VAL A CG1 1
|
|
ATOM 1289 C CG2 . VAL A 1 193 ? -9.454 28.946 38.079 1.00 51.42 ? 395 VAL A CG2 1
|
|
ATOM 1290 N N . LEU A 1 194 ? -5.743 27.162 36.020 1.00 47.22 ? 396 LEU A N 1
|
|
ATOM 1291 C CA . LEU A 1 194 ? -4.494 27.028 35.283 1.00 47.77 ? 396 LEU A CA 1
|
|
ATOM 1292 C C . LEU A 1 194 ? -4.598 25.936 34.200 1.00 55.56 ? 396 LEU A C 1
|
|
ATOM 1293 O O . LEU A 1 194 ? -3.973 26.047 33.148 1.00 56.66 ? 396 LEU A O 1
|
|
ATOM 1294 C CB . LEU A 1 194 ? -3.334 26.745 36.262 1.00 48.28 ? 396 LEU A CB 1
|
|
ATOM 1295 C CG . LEU A 1 194 ? -2.984 27.878 37.271 1.00 53.02 ? 396 LEU A CG 1
|
|
ATOM 1296 C CD1 . LEU A 1 194 ? -2.114 27.369 38.409 1.00 52.61 ? 396 LEU A CD1 1
|
|
ATOM 1297 C CD2 . LEU A 1 194 ? -2.322 29.081 36.586 1.00 56.51 ? 396 LEU A CD2 1
|
|
ATOM 1298 N N . VAL A 1 195 ? -5.429 24.914 34.443 1.00 53.99 ? 397 VAL A N 1
|
|
ATOM 1299 C CA . VAL A 1 195 ? -5.683 23.781 33.544 1.00 53.87 ? 397 VAL A CA 1
|
|
ATOM 1300 C C . VAL A 1 195 ? -6.555 24.203 32.369 1.00 58.66 ? 397 VAL A C 1
|
|
ATOM 1301 O O . VAL A 1 195 ? -6.383 23.671 31.275 1.00 61.96 ? 397 VAL A O 1
|
|
ATOM 1302 C CB . VAL A 1 195 ? -6.251 22.562 34.328 1.00 57.05 ? 397 VAL A CB 1
|
|
ATOM 1303 C CG1 . VAL A 1 195 ? -6.903 21.539 33.413 1.00 56.45 ? 397 VAL A CG1 1
|
|
ATOM 1304 C CG2 . VAL A 1 195 ? -5.164 21.909 35.170 1.00 57.22 ? 397 VAL A CG2 1
|
|
ATOM 1305 N N . SER A 1 196 ? -7.458 25.168 32.575 1.00 52.74 ? 398 SER A N 1
|
|
ATOM 1306 C CA . SER A 1 196 ? -8.328 25.687 31.520 1.00 51.65 ? 398 SER A CA 1
|
|
ATOM 1307 C C . SER A 1 196 ? -7.589 26.575 30.513 1.00 58.89 ? 398 SER A C 1
|
|
ATOM 1308 O O . SER A 1 196 ? -8.110 26.824 29.426 1.00 60.50 ? 398 SER A O 1
|
|
ATOM 1309 C CB . SER A 1 196 ? -9.492 26.452 32.126 1.00 53.28 ? 398 SER A CB 1
|
|
ATOM 1310 O OG . SER A 1 196 ? -9.062 27.510 32.965 1.00 63.30 ? 398 SER A OG 1
|
|
ATOM 1311 N N . VAL A 1 197 ? -6.379 27.043 30.864 1.00 56.25 ? 399 VAL A N 1
|
|
ATOM 1312 C CA . VAL A 1 197 ? -5.531 27.908 30.034 1.00 56.97 ? 399 VAL A CA 1
|
|
ATOM 1313 C C . VAL A 1 197 ? -5.206 27.228 28.681 1.00 63.32 ? 399 VAL A C 1
|
|
ATOM 1314 O O . VAL A 1 197 ? -5.210 27.900 27.659 1.00 64.35 ? 399 VAL A O 1
|
|
ATOM 1315 C CB . VAL A 1 197 ? -4.277 28.420 30.818 1.00 61.59 ? 399 VAL A CB 1
|
|
ATOM 1316 C CG1 . VAL A 1 197 ? -3.343 29.249 29.941 1.00 63.04 ? 399 VAL A CG1 1
|
|
ATOM 1317 C CG2 . VAL A 1 197 ? -4.687 29.230 32.039 1.00 61.00 ? 399 VAL A CG2 1
|
|
ATOM 1318 N N . GLY A 1 198 ? -5.020 25.911 28.682 1.00 60.59 ? 400 GLY A N 1
|
|
ATOM 1319 C CA . GLY A 1 198 ? -4.703 25.138 27.485 1.00 61.61 ? 400 GLY A CA 1
|
|
ATOM 1320 C C . GLY A 1 198 ? -5.775 25.110 26.415 1.00 67.98 ? 400 GLY A C 1
|
|
ATOM 1321 O O . GLY A 1 198 ? -5.458 25.149 25.219 1.00 69.25 ? 400 GLY A O 1
|
|
ATOM 1322 N N . THR A 1 199 ? -7.057 25.053 26.836 1.00 63.99 ? 401 THR A N 1
|
|
ATOM 1323 C CA . THR A 1 199 ? -8.217 25.012 25.928 1.00 62.61 ? 401 THR A CA 1
|
|
ATOM 1324 C C . THR A 1 199 ? -8.775 26.404 25.618 1.00 63.73 ? 401 THR A C 1
|
|
ATOM 1325 O O . THR A 1 199 ? -9.320 26.596 24.534 1.00 64.70 ? 401 THR A O 1
|
|
ATOM 1326 C CB . THR A 1 199 ? -9.305 24.136 26.508 1.00 72.05 ? 401 THR A CB 1
|
|
ATOM 1327 O OG1 . THR A 1 199 ? -9.916 24.852 27.580 1.00 78.95 ? 401 THR A OG1 1
|
|
ATOM 1328 C CG2 . THR A 1 199 ? -8.761 22.801 27.028 1.00 73.07 ? 401 THR A CG2 1
|
|
ATOM 1329 N N . ALA A 1 200 ? -8.664 27.362 26.576 1.00 56.13 ? 402 ALA A N 1
|
|
ATOM 1330 C CA . ALA A 1 200 ? -9.187 28.735 26.477 1.00 53.59 ? 402 ALA A CA 1
|
|
ATOM 1331 C C . ALA A 1 200 ? -9.053 29.370 25.099 1.00 58.00 ? 402 ALA A C 1
|
|
ATOM 1332 O O . ALA A 1 200 ? -7.979 29.324 24.503 1.00 61.66 ? 402 ALA A O 1
|
|
ATOM 1333 C CB . ALA A 1 200 ? -8.552 29.613 27.530 1.00 54.00 ? 402 ALA A CB 1
|
|
ATOM 1334 N N . GLY A 1 201 ? -10.137 29.924 24.584 1.00 51.33 ? 403 GLY A N 1
|
|
ATOM 1335 C CA . GLY A 1 201 ? -10.126 30.563 23.269 1.00 50.94 ? 403 GLY A CA 1
|
|
ATOM 1336 C C . GLY A 1 201 ? -10.414 29.675 22.062 1.00 54.24 ? 403 GLY A C 1
|
|
ATOM 1337 O O . GLY A 1 201 ? -10.137 30.087 20.935 1.00 56.86 ? 403 GLY A O 1
|
|
ATOM 1338 N N . TYR A 1 202 ? -10.962 28.456 22.277 1.00 46.83 ? 404 TYR A N 1
|
|
ATOM 1339 C CA . TYR A 1 202 ? -11.352 27.521 21.229 1.00 44.83 ? 404 TYR A CA 1
|
|
ATOM 1340 C C . TYR A 1 202 ? -12.867 27.300 21.254 1.00 48.72 ? 404 TYR A C 1
|
|
ATOM 1341 O O . TYR A 1 202 ? -13.330 26.270 20.779 1.00 49.89 ? 404 TYR A O 1
|
|
ATOM 1342 C CB . TYR A 1 202 ? -10.578 26.191 21.337 1.00 45.63 ? 404 TYR A CB 1
|
|
ATOM 1343 C CG . TYR A 1 202 ? -9.264 26.249 20.582 1.00 50.26 ? 404 TYR A CG 1
|
|
ATOM 1344 C CD1 . TYR A 1 202 ? -8.155 26.912 21.117 1.00 53.06 ? 404 TYR A CD1 1
|
|
ATOM 1345 C CD2 . TYR A 1 202 ? -9.163 25.760 19.284 1.00 51.04 ? 404 TYR A CD2 1
|
|
ATOM 1346 C CE1 . TYR A 1 202 ? -6.967 27.036 20.398 1.00 52.21 ? 404 TYR A CE1 1
|
|
ATOM 1347 C CE2 . TYR A 1 202 ? -7.988 25.906 18.545 1.00 52.81 ? 404 TYR A CE2 1
|
|
ATOM 1348 C CZ . TYR A 1 202 ? -6.888 26.529 19.114 1.00 57.64 ? 404 TYR A CZ 1
|
|
ATOM 1349 O OH . TYR A 1 202 ? -5.716 26.623 18.410 1.00 61.49 ? 404 TYR A OH 1
|
|
ATOM 1350 N N . ASN A 1 203 ? -13.644 28.263 21.796 1.00 43.76 ? 405 ASN A N 1
|
|
ATOM 1351 C CA . ASN A 1 203 ? -15.104 28.111 21.903 1.00 43.38 ? 405 ASN A CA 1
|
|
ATOM 1352 C C . ASN A 1 203 ? -15.754 28.177 20.537 1.00 46.70 ? 405 ASN A C 1
|
|
ATOM 1353 O O . ASN A 1 203 ? -16.772 27.519 20.306 1.00 45.36 ? 405 ASN A O 1
|
|
ATOM 1354 C CB . ASN A 1 203 ? -15.766 29.133 22.864 1.00 43.90 ? 405 ASN A CB 1
|
|
ATOM 1355 C CG . ASN A 1 203 ? -15.101 29.407 24.191 1.00 78.39 ? 405 ASN A CG 1
|
|
ATOM 1356 O OD1 . ASN A 1 203 ? -13.895 29.686 24.297 1.00 78.48 ? 405 ASN A OD1 1
|
|
ATOM 1357 N ND2 . ASN A 1 203 ? -15.926 29.532 25.208 1.00 76.11 ? 405 ASN A ND2 1
|
|
ATOM 1358 N N . ARG A 1 204 ? -15.135 28.952 19.629 1.00 43.49 ? 406 ARG A N 1
|
|
ATOM 1359 C CA . ARG A 1 204 ? -15.556 29.143 18.247 1.00 43.29 ? 406 ARG A CA 1
|
|
ATOM 1360 C C . ARG A 1 204 ? -15.581 27.822 17.539 1.00 46.54 ? 406 ARG A C 1
|
|
ATOM 1361 O O . ARG A 1 204 ? -16.374 27.676 16.637 1.00 48.64 ? 406 ARG A O 1
|
|
ATOM 1362 C CB . ARG A 1 204 ? -14.626 30.135 17.504 1.00 43.74 ? 406 ARG A CB 1
|
|
ATOM 1363 C CG . ARG A 1 204 ? -13.222 29.589 17.167 1.00 46.30 ? 406 ARG A CG 1
|
|
ATOM 1364 C CD . ARG A 1 204 ? -12.341 30.636 16.580 1.00 41.40 ? 406 ARG A CD 1
|
|
ATOM 1365 N NE . ARG A 1 204 ? -12.128 31.698 17.553 1.00 49.92 ? 406 ARG A NE 1
|
|
ATOM 1366 C CZ . ARG A 1 204 ? -11.358 32.754 17.346 1.00 62.56 ? 406 ARG A CZ 1
|
|
ATOM 1367 N NH1 . ARG A 1 204 ? -10.712 32.898 16.197 1.00 53.51 ? 406 ARG A NH1 1
|
|
ATOM 1368 N NH2 . ARG A 1 204 ? -11.230 33.678 18.281 1.00 53.40 ? 406 ARG A NH2 1
|
|
ATOM 1369 N N . ALA A 1 205 ? -14.703 26.865 17.929 1.00 41.87 ? 407 ALA A N 1
|
|
ATOM 1370 C CA . ALA A 1 205 ? -14.654 25.518 17.357 1.00 41.32 ? 407 ALA A CA 1
|
|
ATOM 1371 C C . ALA A 1 205 ? -16.007 24.791 17.446 1.00 46.13 ? 407 ALA A C 1
|
|
ATOM 1372 O O . ALA A 1 205 ? -16.229 23.900 16.644 1.00 47.62 ? 407 ALA A O 1
|
|
ATOM 1373 C CB . ALA A 1 205 ? -13.551 24.696 18.000 1.00 41.39 ? 407 ALA A CB 1
|
|
ATOM 1374 N N . VAL A 1 206 ? -16.933 25.202 18.357 1.00 42.14 ? 408 VAL A N 1
|
|
ATOM 1375 C CA . VAL A 1 206 ? -18.280 24.603 18.446 1.00 42.22 ? 408 VAL A CA 1
|
|
ATOM 1376 C C . VAL A 1 206 ? -19.076 24.832 17.166 1.00 46.92 ? 408 VAL A C 1
|
|
ATOM 1377 O O . VAL A 1 206 ? -19.866 23.977 16.789 1.00 49.33 ? 408 VAL A O 1
|
|
ATOM 1378 C CB . VAL A 1 206 ? -19.107 24.955 19.724 1.00 45.74 ? 408 VAL A CB 1
|
|
ATOM 1379 C CG1 . VAL A 1 206 ? -18.324 24.646 20.992 1.00 46.01 ? 408 VAL A CG1 1
|
|
ATOM 1380 C CG2 . VAL A 1 206 ? -19.627 26.396 19.730 1.00 44.36 ? 408 VAL A CG2 1
|
|
ATOM 1381 N N . ASP A 1 207 ? -18.855 25.982 16.505 1.00 41.96 ? 409 ASP A N 1
|
|
ATOM 1382 C CA . ASP A 1 207 ? -19.468 26.369 15.241 1.00 41.94 ? 409 ASP A CA 1
|
|
ATOM 1383 C C . ASP A 1 207 ? -18.975 25.498 14.083 1.00 48.57 ? 409 ASP A C 1
|
|
ATOM 1384 O O . ASP A 1 207 ? -19.713 25.281 13.125 1.00 48.06 ? 409 ASP A O 1
|
|
ATOM 1385 C CB . ASP A 1 207 ? -19.196 27.847 14.934 1.00 42.58 ? 409 ASP A CB 1
|
|
ATOM 1386 C CG . ASP A 1 207 ? -20.090 28.844 15.625 1.00 45.18 ? 409 ASP A CG 1
|
|
ATOM 1387 O OD1 . ASP A 1 207 ? -21.173 28.422 16.157 1.00 42.40 ? 409 ASP A OD1 1
|
|
ATOM 1388 O OD2 . ASP A 1 207 ? -19.770 30.067 15.563 1.00 47.23 ? 409 ASP A OD2 1
|
|
ATOM 1389 N N . CYS A 1 208 ? -17.735 25.003 14.169 1.00 48.30 ? 410 CYS A N 1
|
|
ATOM 1390 C CA . CYS A 1 208 ? -17.185 24.124 13.142 1.00 50.20 ? 410 CYS A CA 1
|
|
ATOM 1391 C C . CYS A 1 208 ? -17.667 22.704 13.288 1.00 53.07 ? 410 CYS A C 1
|
|
ATOM 1392 O O . CYS A 1 208 ? -17.830 22.022 12.288 1.00 54.87 ? 410 CYS A O 1
|
|
ATOM 1393 C CB . CYS A 1 208 ? -15.675 24.214 13.112 1.00 52.23 ? 410 CYS A CB 1
|
|
ATOM 1394 S SG . CYS A 1 208 ? -15.093 25.864 12.725 1.00 57.13 ? 410 CYS A SG 1
|
|
ATOM 1395 N N . TRP A 1 209 ? -17.959 22.277 14.512 1.00 47.67 ? 411 TRP A N 1
|
|
ATOM 1396 C CA . TRP A 1 209 ? -18.544 20.980 14.744 1.00 47.78 ? 411 TRP A CA 1
|
|
ATOM 1397 C C . TRP A 1 209 ? -19.911 20.985 14.028 1.00 55.44 ? 411 TRP A C 1
|
|
ATOM 1398 O O . TRP A 1 209 ? -20.104 20.193 13.106 1.00 57.31 ? 411 TRP A O 1
|
|
ATOM 1399 C CB . TRP A 1 209 ? -18.699 20.713 16.252 1.00 45.02 ? 411 TRP A CB 1
|
|
ATOM 1400 C CG . TRP A 1 209 ? -19.374 19.403 16.545 1.00 46.66 ? 411 TRP A CG 1
|
|
ATOM 1401 C CD1 . TRP A 1 209 ? -20.716 19.190 16.692 1.00 49.63 ? 411 TRP A CD1 1
|
|
ATOM 1402 C CD2 . TRP A 1 209 ? -18.756 18.105 16.578 1.00 47.38 ? 411 TRP A CD2 1
|
|
ATOM 1403 N NE1 . TRP A 1 209 ? -20.966 17.850 16.868 1.00 50.14 ? 411 TRP A NE1 1
|
|
ATOM 1404 C CE2 . TRP A 1 209 ? -19.781 17.159 16.801 1.00 51.74 ? 411 TRP A CE2 1
|
|
ATOM 1405 C CE3 . TRP A 1 209 ? -17.430 17.652 16.463 1.00 49.51 ? 411 TRP A CE3 1
|
|
ATOM 1406 C CZ2 . TRP A 1 209 ? -19.519 15.791 16.963 1.00 52.38 ? 411 TRP A CZ2 1
|
|
ATOM 1407 C CZ3 . TRP A 1 209 ? -17.169 16.289 16.614 1.00 52.31 ? 411 TRP A CZ3 1
|
|
ATOM 1408 C CH2 . TRP A 1 209 ? -18.206 15.376 16.860 1.00 53.66 ? 411 TRP A CH2 1
|
|
ATOM 1409 N N . SER A 1 210 ? -20.811 21.938 14.399 1.00 51.35 ? 412 SER A N 1
|
|
ATOM 1410 C CA . SER A 1 210 ? -22.173 22.135 13.864 1.00 50.64 ? 412 SER A CA 1
|
|
ATOM 1411 C C . SER A 1 210 ? -22.220 22.135 12.334 1.00 54.41 ? 412 SER A C 1
|
|
ATOM 1412 O O . SER A 1 210 ? -23.051 21.446 11.743 1.00 55.11 ? 412 SER A O 1
|
|
ATOM 1413 C CB . SER A 1 210 ? -22.773 23.417 14.421 1.00 53.00 ? 412 SER A CB 1
|
|
ATOM 1414 O OG . SER A 1 210 ? -22.815 23.403 15.842 1.00 62.45 ? 412 SER A OG 1
|
|
ATOM 1415 N N . LEU A 1 211 ? -21.292 22.860 11.698 1.00 50.05 ? 413 LEU A N 1
|
|
ATOM 1416 C CA . LEU A 1 211 ? -21.141 22.920 10.239 1.00 50.18 ? 413 LEU A CA 1
|
|
ATOM 1417 C C . LEU A 1 211 ? -20.838 21.528 9.658 1.00 55.74 ? 413 LEU A C 1
|
|
ATOM 1418 O O . LEU A 1 211 ? -21.322 21.184 8.572 1.00 56.99 ? 413 LEU A O 1
|
|
ATOM 1419 C CB . LEU A 1 211 ? -20.009 23.908 9.835 1.00 49.03 ? 413 LEU A CB 1
|
|
ATOM 1420 C CG . LEU A 1 211 ? -20.294 25.408 9.909 1.00 50.74 ? 413 LEU A CG 1
|
|
ATOM 1421 C CD1 . LEU A 1 211 ? -19.110 26.192 9.418 1.00 50.35 ? 413 LEU A CD1 1
|
|
ATOM 1422 C CD2 . LEU A 1 211 ? -21.533 25.804 9.105 1.00 52.30 ? 413 LEU A CD2 1
|
|
ATOM 1423 N N . GLY A 1 212 ? -20.046 20.752 10.398 1.00 51.29 ? 414 GLY A N 1
|
|
ATOM 1424 C CA . GLY A 1 212 ? -19.667 19.396 10.026 1.00 52.15 ? 414 GLY A CA 1
|
|
ATOM 1425 C C . GLY A 1 212 ? -20.846 18.453 10.092 1.00 56.82 ? 414 GLY A C 1
|
|
ATOM 1426 O O . GLY A 1 212 ? -20.959 17.562 9.253 1.00 60.24 ? 414 GLY A O 1
|
|
ATOM 1427 N N . VAL A 1 213 ? -21.726 18.637 11.095 1.00 50.63 ? 415 VAL A N 1
|
|
ATOM 1428 C CA . VAL A 1 213 ? -22.962 17.861 11.280 1.00 49.80 ? 415 VAL A CA 1
|
|
ATOM 1429 C C . VAL A 1 213 ? -23.928 18.300 10.155 1.00 55.26 ? 415 VAL A C 1
|
|
ATOM 1430 O O . VAL A 1 213 ? -24.620 17.447 9.598 1.00 57.84 ? 415 VAL A O 1
|
|
ATOM 1431 C CB . VAL A 1 213 ? -23.580 18.015 12.707 1.00 50.85 ? 415 VAL A CB 1
|
|
ATOM 1432 C CG1 . VAL A 1 213 ? -24.873 17.228 12.851 1.00 51.36 ? 415 VAL A CG1 1
|
|
ATOM 1433 C CG2 . VAL A 1 213 ? -22.601 17.580 13.781 1.00 49.98 ? 415 VAL A CG2 1
|
|
ATOM 1434 N N . ILE A 1 214 ? -23.939 19.611 9.793 1.00 49.85 ? 416 ILE A N 1
|
|
ATOM 1435 C CA . ILE A 1 214 ? -24.774 20.137 8.711 1.00 49.95 ? 416 ILE A CA 1
|
|
ATOM 1436 C C . ILE A 1 214 ? -24.344 19.528 7.366 1.00 57.14 ? 416 ILE A C 1
|
|
ATOM 1437 O O . ILE A 1 214 ? -25.191 18.992 6.646 1.00 59.39 ? 416 ILE A O 1
|
|
ATOM 1438 C CB . ILE A 1 214 ? -24.817 21.687 8.678 1.00 51.08 ? 416 ILE A CB 1
|
|
ATOM 1439 C CG1 . ILE A 1 214 ? -25.566 22.233 9.893 1.00 50.13 ? 416 ILE A CG1 1
|
|
ATOM 1440 C CG2 . ILE A 1 214 ? -25.466 22.208 7.363 1.00 51.74 ? 416 ILE A CG2 1
|
|
ATOM 1441 C CD1 . ILE A 1 214 ? -25.337 23.769 10.127 1.00 55.32 ? 416 ILE A CD1 1
|
|
ATOM 1442 N N . LEU A 1 215 ? -23.032 19.582 7.048 1.00 52.90 ? 417 LEU A N 1
|
|
ATOM 1443 C CA . LEU A 1 215 ? -22.466 19.045 5.804 1.00 53.65 ? 417 LEU A CA 1
|
|
ATOM 1444 C C . LEU A 1 215 ? -22.772 17.549 5.619 1.00 59.41 ? 417 LEU A C 1
|
|
ATOM 1445 O O . LEU A 1 215 ? -23.107 17.119 4.511 1.00 63.53 ? 417 LEU A O 1
|
|
ATOM 1446 C CB . LEU A 1 215 ? -20.946 19.349 5.715 1.00 53.09 ? 417 LEU A CB 1
|
|
ATOM 1447 C CG . LEU A 1 215 ? -20.202 18.929 4.434 1.00 58.39 ? 417 LEU A CG 1
|
|
ATOM 1448 C CD1 . LEU A 1 215 ? -20.824 19.572 3.183 1.00 59.19 ? 417 LEU A CD1 1
|
|
ATOM 1449 C CD2 . LEU A 1 215 ? -18.738 19.257 4.521 1.00 57.09 ? 417 LEU A CD2 1
|
|
ATOM 1450 N N . PHE A 1 216 ? -22.687 16.777 6.697 1.00 53.17 ? 418 PHE A N 1
|
|
ATOM 1451 C CA . PHE A 1 216 ? -22.989 15.352 6.732 1.00 54.35 ? 418 PHE A CA 1
|
|
ATOM 1452 C C . PHE A 1 216 ? -24.463 15.119 6.333 1.00 58.29 ? 418 PHE A C 1
|
|
ATOM 1453 O O . PHE A 1 216 ? -24.737 14.346 5.425 1.00 58.57 ? 418 PHE A O 1
|
|
ATOM 1454 C CB . PHE A 1 216 ? -22.711 14.814 8.153 1.00 55.60 ? 418 PHE A CB 1
|
|
ATOM 1455 C CG . PHE A 1 216 ? -22.734 13.310 8.301 1.00 58.59 ? 418 PHE A CG 1
|
|
ATOM 1456 C CD1 . PHE A 1 216 ? -23.936 12.607 8.256 1.00 62.77 ? 418 PHE A CD1 1
|
|
ATOM 1457 C CD2 . PHE A 1 216 ? -21.562 12.601 8.528 1.00 60.20 ? 418 PHE A CD2 1
|
|
ATOM 1458 C CE1 . PHE A 1 216 ? -23.964 11.223 8.417 1.00 64.73 ? 418 PHE A CE1 1
|
|
ATOM 1459 C CE2 . PHE A 1 216 ? -21.593 11.218 8.699 1.00 65.23 ? 418 PHE A CE2 1
|
|
ATOM 1460 C CZ . PHE A 1 216 ? -22.799 10.541 8.656 1.00 64.55 ? 418 PHE A CZ 1
|
|
ATOM 1461 N N . ILE A 1 217 ? -25.395 15.817 6.994 1.00 55.38 ? 419 ILE A N 1
|
|
ATOM 1462 C CA . ILE A 1 217 ? -26.839 15.734 6.727 1.00 56.84 ? 419 ILE A CA 1
|
|
ATOM 1463 C C . ILE A 1 217 ? -27.158 16.098 5.262 1.00 63.62 ? 419 ILE A C 1
|
|
ATOM 1464 O O . ILE A 1 217 ? -27.948 15.411 4.619 1.00 65.25 ? 419 ILE A O 1
|
|
ATOM 1465 C CB . ILE A 1 217 ? -27.636 16.578 7.768 1.00 57.91 ? 419 ILE A CB 1
|
|
ATOM 1466 C CG1 . ILE A 1 217 ? -27.624 15.883 9.134 1.00 57.76 ? 419 ILE A CG1 1
|
|
ATOM 1467 C CG2 . ILE A 1 217 ? -29.080 16.862 7.310 1.00 59.22 ? 419 ILE A CG2 1
|
|
ATOM 1468 C CD1 . ILE A 1 217 ? -27.710 16.809 10.325 1.00 63.16 ? 419 ILE A CD1 1
|
|
ATOM 1469 N N . CYS A 1 218 ? -26.539 17.167 4.746 1.00 59.67 ? 420 CYS A N 1
|
|
ATOM 1470 C CA . CYS A 1 218 ? -26.736 17.603 3.373 1.00 60.35 ? 420 CYS A CA 1
|
|
ATOM 1471 C C . CYS A 1 218 ? -26.297 16.565 2.352 1.00 66.05 ? 420 CYS A C 1
|
|
ATOM 1472 O O . CYS A 1 218 ? -27.052 16.273 1.424 1.00 67.33 ? 420 CYS A O 1
|
|
ATOM 1473 C CB . CYS A 1 218 ? -26.033 18.928 3.140 1.00 59.39 ? 420 CYS A CB 1
|
|
ATOM 1474 S SG . CYS A 1 218 ? -26.791 20.302 4.004 1.00 62.08 ? 420 CYS A SG 1
|
|
ATOM 1475 N N . LEU A 1 219 ? -25.065 16.031 2.521 1.00 62.23 ? 421 LEU A N 1
|
|
ATOM 1476 C CA . LEU A 1 219 ? -24.439 15.060 1.624 1.00 63.25 ? 421 LEU A CA 1
|
|
ATOM 1477 C C . LEU A 1 219 ? -25.106 13.703 1.635 1.00 70.66 ? 421 LEU A C 1
|
|
ATOM 1478 O O . LEU A 1 219 ? -25.266 13.116 0.571 1.00 74.37 ? 421 LEU A O 1
|
|
ATOM 1479 C CB . LEU A 1 219 ? -22.938 14.892 1.947 1.00 61.94 ? 421 LEU A CB 1
|
|
ATOM 1480 C CG . LEU A 1 219 ? -22.010 16.092 1.730 1.00 63.28 ? 421 LEU A CG 1
|
|
ATOM 1481 C CD1 . LEU A 1 219 ? -20.670 15.810 2.315 1.00 63.16 ? 421 LEU A CD1 1
|
|
ATOM 1482 C CD2 . LEU A 1 219 ? -21.829 16.431 0.241 1.00 62.73 ? 421 LEU A CD2 1
|
|
ATOM 1483 N N . SER A 1 220 ? -25.473 13.198 2.825 1.00 66.38 ? 422 SER A N 1
|
|
ATOM 1484 C CA . SER A 1 220 ? -26.033 11.860 3.036 1.00 68.16 ? 422 SER A CA 1
|
|
ATOM 1485 C C . SER A 1 220 ? -27.573 11.704 3.149 1.00 73.57 ? 422 SER A C 1
|
|
ATOM 1486 O O . SER A 1 220 ? -28.098 10.629 2.866 1.00 75.81 ? 422 SER A O 1
|
|
ATOM 1487 C CB . SER A 1 220 ? -25.345 11.208 4.230 1.00 70.74 ? 422 SER A CB 1
|
|
ATOM 1488 O OG . SER A 1 220 ? -25.718 11.810 5.459 1.00 78.60 ? 422 SER A OG 1
|
|
ATOM 1489 N N . GLY A 1 221 ? -28.262 12.746 3.599 1.00 69.17 ? 423 GLY A N 1
|
|
ATOM 1490 C CA . GLY A 1 221 ? -29.704 12.730 3.825 1.00 69.83 ? 423 GLY A CA 1
|
|
ATOM 1491 C C . GLY A 1 221 ? -30.041 12.278 5.234 1.00 74.21 ? 423 GLY A C 1
|
|
ATOM 1492 O O . GLY A 1 221 ? -31.192 12.379 5.654 1.00 74.49 ? 423 GLY A O 1
|
|
ATOM 1493 N N . TYR A 1 222 ? -29.035 11.783 5.980 1.00 70.66 ? 424 TYR A N 1
|
|
ATOM 1494 C CA . TYR A 1 222 ? -29.211 11.289 7.346 1.00 70.51 ? 424 TYR A CA 1
|
|
ATOM 1495 C C . TYR A 1 222 ? -28.261 11.953 8.368 1.00 72.12 ? 424 TYR A C 1
|
|
ATOM 1496 O O . TYR A 1 222 ? -27.145 12.335 7.998 1.00 69.21 ? 424 TYR A O 1
|
|
ATOM 1497 C CB . TYR A 1 222 ? -29.138 9.729 7.397 1.00 73.43 ? 424 TYR A CB 1
|
|
ATOM 1498 C CG . TYR A 1 222 ? -27.745 9.132 7.326 1.00 73.50 ? 424 TYR A CG 1
|
|
ATOM 1499 C CD1 . TYR A 1 222 ? -27.017 8.869 8.483 1.00 73.41 ? 424 TYR A CD1 1
|
|
ATOM 1500 C CD2 . TYR A 1 222 ? -27.194 8.739 6.108 1.00 75.65 ? 424 TYR A CD2 1
|
|
ATOM 1501 C CE1 . TYR A 1 222 ? -25.748 8.293 8.427 1.00 73.04 ? 424 TYR A CE1 1
|
|
ATOM 1502 C CE2 . TYR A 1 222 ? -25.929 8.151 6.040 1.00 76.88 ? 424 TYR A CE2 1
|
|
ATOM 1503 C CZ . TYR A 1 222 ? -25.195 7.959 7.200 1.00 82.94 ? 424 TYR A CZ 1
|
|
ATOM 1504 O OH . TYR A 1 222 ? -23.929 7.416 7.126 1.00 83.65 ? 424 TYR A OH 1
|
|
ATOM 1505 N N . PRO A 1 223 ? -28.668 12.044 9.664 1.00 69.26 ? 425 PRO A N 1
|
|
ATOM 1506 C CA . PRO A 1 223 ? -27.766 12.631 10.683 1.00 67.17 ? 425 PRO A CA 1
|
|
ATOM 1507 C C . PRO A 1 223 ? -26.613 11.707 11.112 1.00 72.17 ? 425 PRO A C 1
|
|
ATOM 1508 O O . PRO A 1 223 ? -26.784 10.477 11.167 1.00 74.08 ? 425 PRO A O 1
|
|
ATOM 1509 C CB . PRO A 1 223 ? -28.704 12.921 11.860 1.00 68.50 ? 425 PRO A CB 1
|
|
ATOM 1510 C CG . PRO A 1 223 ? -29.766 11.874 11.747 1.00 75.20 ? 425 PRO A CG 1
|
|
ATOM 1511 C CD . PRO A 1 223 ? -29.959 11.631 10.262 1.00 71.74 ? 425 PRO A CD 1
|
|
ATOM 1512 N N . PRO A 1 224 ? -25.437 12.273 11.462 1.00 67.10 ? 426 PRO A N 1
|
|
ATOM 1513 C CA . PRO A 1 224 ? -24.314 11.405 11.876 1.00 67.61 ? 426 PRO A CA 1
|
|
ATOM 1514 C C . PRO A 1 224 ? -24.489 10.746 13.242 1.00 71.74 ? 426 PRO A C 1
|
|
ATOM 1515 O O . PRO A 1 224 ? -23.962 9.658 13.457 1.00 73.05 ? 426 PRO A O 1
|
|
ATOM 1516 C CB . PRO A 1 224 ? -23.095 12.349 11.849 1.00 67.29 ? 426 PRO A CB 1
|
|
ATOM 1517 C CG . PRO A 1 224 ? -23.638 13.723 11.911 1.00 69.00 ? 426 PRO A CG 1
|
|
ATOM 1518 C CD . PRO A 1 224 ? -25.066 13.708 11.466 1.00 65.59 ? 426 PRO A CD 1
|
|
ATOM 1519 N N . PHE A 1 225 ? -25.188 11.429 14.170 1.00 66.85 ? 427 PHE A N 1
|
|
ATOM 1520 C CA . PHE A 1 225 ? -25.418 10.979 15.543 1.00 67.20 ? 427 PHE A CA 1
|
|
ATOM 1521 C C . PHE A 1 225 ? -26.933 10.943 15.790 1.00 75.84 ? 427 PHE A C 1
|
|
ATOM 1522 O O . PHE A 1 225 ? -27.603 11.964 15.676 1.00 75.09 ? 427 PHE A O 1
|
|
ATOM 1523 C CB . PHE A 1 225 ? -24.670 11.882 16.548 1.00 65.91 ? 427 PHE A CB 1
|
|
ATOM 1524 C CG . PHE A 1 225 ? -23.225 12.151 16.179 1.00 65.54 ? 427 PHE A CG 1
|
|
ATOM 1525 C CD1 . PHE A 1 225 ? -22.227 11.240 16.498 1.00 68.44 ? 427 PHE A CD1 1
|
|
ATOM 1526 C CD2 . PHE A 1 225 ? -22.870 13.300 15.477 1.00 64.24 ? 427 PHE A CD2 1
|
|
ATOM 1527 C CE1 . PHE A 1 225 ? -20.897 11.481 16.127 1.00 67.71 ? 427 PHE A CE1 1
|
|
ATOM 1528 C CE2 . PHE A 1 225 ? -21.547 13.526 15.095 1.00 65.30 ? 427 PHE A CE2 1
|
|
ATOM 1529 C CZ . PHE A 1 225 ? -20.571 12.617 15.422 1.00 64.05 ? 427 PHE A CZ 1
|
|
ATOM 1530 N N . SER A 1 226 ? -27.479 9.748 16.051 1.00 77.04 ? 428 SER A N 1
|
|
ATOM 1531 C CA . SER A 1 226 ? -28.915 9.535 16.216 1.00 79.45 ? 428 SER A CA 1
|
|
ATOM 1532 C C . SER A 1 226 ? -29.218 8.357 17.129 1.00 88.24 ? 428 SER A C 1
|
|
ATOM 1533 O O . SER A 1 226 ? -28.421 7.421 17.245 1.00 89.54 ? 428 SER A O 1
|
|
ATOM 1534 C CB . SER A 1 226 ? -29.554 9.284 14.849 1.00 85.46 ? 428 SER A CB 1
|
|
ATOM 1535 O OG . SER A 1 226 ? -30.958 9.089 14.915 1.00 99.10 ? 428 SER A OG 1
|
|
ATOM 1536 N N . GLU A 1 227 ? -30.406 8.371 17.727 1.00 87.49 ? 429 GLU A N 1
|
|
ATOM 1537 C CA . GLU A 1 227 ? -30.833 7.260 18.564 1.00 90.33 ? 429 GLU A CA 1
|
|
ATOM 1538 C C . GLU A 1 227 ? -31.520 6.168 17.727 1.00 99.89 ? 429 GLU A C 1
|
|
ATOM 1539 O O . GLU A 1 227 ? -31.707 5.061 18.236 1.00 102.49 ? 429 GLU A O 1
|
|
ATOM 1540 C CB . GLU A 1 227 ? -31.653 7.741 19.771 1.00 91.28 ? 429 GLU A CB 1
|
|
ATOM 1541 C CG . GLU A 1 227 ? -30.792 8.509 20.769 1.00 99.38 ? 429 GLU A CG 1
|
|
ATOM 1542 C CD . GLU A 1 227 ? -31.471 9.201 21.938 1.00 115.34 ? 429 GLU A CD 1
|
|
ATOM 1543 O OE1 . GLU A 1 227 ? -32.715 9.357 21.912 1.00 107.82 ? 429 GLU A OE1 1
|
|
ATOM 1544 O OE2 . GLU A 1 227 ? -30.749 9.595 22.885 1.00 97.33 ? 429 GLU A OE2 1
|
|
ATOM 1545 N N . HIS A 1 228 ? -31.812 6.453 16.418 1.00 98.22 ? 430 HIS A N 1
|
|
ATOM 1546 C CA . HIS A 1 228 ? -32.425 5.511 15.464 1.00 102.29 ? 430 HIS A CA 1
|
|
ATOM 1547 C C . HIS A 1 228 ? -31.491 4.344 15.114 1.00 109.03 ? 430 HIS A C 1
|
|
ATOM 1548 O O . HIS A 1 228 ? -30.347 4.567 14.695 1.00 107.16 ? 430 HIS A O 1
|
|
ATOM 1549 C CB . HIS A 1 228 ? -32.940 6.208 14.182 1.00 103.01 ? 430 HIS A CB 1
|
|
ATOM 1550 C CG . HIS A 1 228 ? -33.637 5.272 13.222 1.00 110.09 ? 430 HIS A CG 1
|
|
ATOM 1551 N ND1 . HIS A 1 228 ? -34.987 4.979 13.346 1.00 114.35 ? 430 HIS A ND1 1
|
|
ATOM 1552 C CD2 . HIS A 1 228 ? -33.138 4.576 12.170 1.00 113.06 ? 430 HIS A CD2 1
|
|
ATOM 1553 C CE1 . HIS A 1 228 ? -35.264 4.139 12.359 1.00 116.42 ? 430 HIS A CE1 1
|
|
ATOM 1554 N NE2 . HIS A 1 228 ? -34.184 3.871 11.624 1.00 116.13 ? 430 HIS A NE2 1
|
|
ATOM 1555 N N . ARG A 1 229 ? -32.020 3.104 15.269 1.00 109.56 ? 431 ARG A N 1
|
|
ATOM 1556 C CA . ARG A 1 229 ? -31.355 1.814 15.044 1.00 112.09 ? 431 ARG A CA 1
|
|
ATOM 1557 C C . ARG A 1 229 ? -29.915 1.759 15.620 1.00 113.76 ? 431 ARG A C 1
|
|
ATOM 1558 O O . ARG A 1 229 ? -28.942 1.512 14.896 1.00 113.95 ? 431 ARG A O 1
|
|
ATOM 1559 C CB . ARG A 1 229 ? -31.464 1.360 13.572 1.00 114.87 ? 431 ARG A CB 1
|
|
ATOM 1560 N N . THR A 1 230 ? -29.800 2.049 16.935 1.00 106.95 ? 432 THR A N 1
|
|
ATOM 1561 C CA . THR A 1 230 ? -28.540 2.111 17.682 1.00 103.56 ? 432 THR A CA 1
|
|
ATOM 1562 C C . THR A 1 230 ? -28.772 1.777 19.154 1.00 104.71 ? 432 THR A C 1
|
|
ATOM 1563 O O . THR A 1 230 ? -29.835 2.089 19.693 1.00 104.57 ? 432 THR A O 1
|
|
ATOM 1564 C CB . THR A 1 230 ? -27.919 3.518 17.544 1.00 104.62 ? 432 THR A CB 1
|
|
ATOM 1565 N N . GLN A 1 231 ? -27.773 1.162 19.803 1.00 99.10 ? 433 GLN A N 1
|
|
ATOM 1566 C CA . GLN A 1 231 ? -27.801 0.816 21.230 1.00 98.20 ? 433 GLN A CA 1
|
|
ATOM 1567 C C . GLN A 1 231 ? -27.075 1.909 22.035 1.00 96.27 ? 433 GLN A C 1
|
|
ATOM 1568 O O . GLN A 1 231 ? -27.486 2.260 23.145 1.00 94.79 ? 433 GLN A O 1
|
|
ATOM 1569 C CB . GLN A 1 231 ? -27.133 -0.554 21.467 1.00 101.74 ? 433 GLN A CB 1
|
|
ATOM 1570 N N . VAL A 1 232 ? -26.004 2.452 21.442 1.00 89.52 ? 434 VAL A N 1
|
|
ATOM 1571 C CA . VAL A 1 232 ? -25.125 3.470 22.008 1.00 85.88 ? 434 VAL A CA 1
|
|
ATOM 1572 C C . VAL A 1 232 ? -25.846 4.813 22.179 1.00 86.08 ? 434 VAL A C 1
|
|
ATOM 1573 O O . VAL A 1 232 ? -26.466 5.302 21.226 1.00 86.61 ? 434 VAL A O 1
|
|
ATOM 1574 C CB . VAL A 1 232 ? -23.799 3.549 21.188 1.00 89.34 ? 434 VAL A CB 1
|
|
ATOM 1575 C CG1 . VAL A 1 232 ? -24.057 3.577 19.679 1.00 89.95 ? 434 VAL A CG1 1
|
|
ATOM 1576 C CG2 . VAL A 1 232 ? -22.910 4.714 21.626 1.00 86.12 ? 434 VAL A CG2 1
|
|
ATOM 1577 N N . SER A 1 233 ? -25.785 5.401 23.397 1.00 78.22 ? 435 SER A N 1
|
|
ATOM 1578 C CA . SER A 1 233 ? -26.447 6.685 23.652 1.00 74.45 ? 435 SER A CA 1
|
|
ATOM 1579 C C . SER A 1 233 ? -25.877 7.780 22.772 1.00 76.41 ? 435 SER A C 1
|
|
ATOM 1580 O O . SER A 1 233 ? -24.677 7.769 22.468 1.00 75.95 ? 435 SER A O 1
|
|
ATOM 1581 C CB . SER A 1 233 ? -26.390 7.076 25.130 1.00 74.58 ? 435 SER A CB 1
|
|
ATOM 1582 O OG . SER A 1 233 ? -25.158 7.647 25.544 1.00 76.79 ? 435 SER A OG 1
|
|
ATOM 1583 N N . LEU A 1 234 ? -26.755 8.714 22.339 1.00 71.31 ? 436 LEU A N 1
|
|
ATOM 1584 C CA . LEU A 1 234 ? -26.423 9.868 21.501 1.00 67.12 ? 436 LEU A CA 1
|
|
ATOM 1585 C C . LEU A 1 234 ? -25.229 10.640 22.108 1.00 67.22 ? 436 LEU A C 1
|
|
ATOM 1586 O O . LEU A 1 234 ? -24.315 10.965 21.370 1.00 67.08 ? 436 LEU A O 1
|
|
ATOM 1587 C CB . LEU A 1 234 ? -27.691 10.729 21.270 1.00 66.21 ? 436 LEU A CB 1
|
|
ATOM 1588 C CG . LEU A 1 234 ? -27.622 12.034 20.449 1.00 68.04 ? 436 LEU A CG 1
|
|
ATOM 1589 C CD1 . LEU A 1 234 ? -26.962 11.841 19.115 1.00 68.30 ? 436 LEU A CD1 1
|
|
ATOM 1590 C CD2 . LEU A 1 234 ? -28.984 12.546 20.172 1.00 69.05 ? 436 LEU A CD2 1
|
|
ATOM 1591 N N . LYS A 1 235 ? -25.162 10.781 23.446 1.00 61.49 ? 437 LYS A N 1
|
|
ATOM 1592 C CA . LYS A 1 235 ? -24.045 11.432 24.151 1.00 58.98 ? 437 LYS A CA 1
|
|
ATOM 1593 C C . LYS A 1 235 ? -22.726 10.709 23.898 1.00 65.52 ? 437 LYS A C 1
|
|
ATOM 1594 O O . LYS A 1 235 ? -21.722 11.364 23.610 1.00 64.45 ? 437 LYS A O 1
|
|
ATOM 1595 C CB . LYS A 1 235 ? -24.305 11.460 25.673 1.00 59.89 ? 437 LYS A CB 1
|
|
ATOM 1596 C CG . LYS A 1 235 ? -23.348 12.353 26.434 1.00 58.22 ? 437 LYS A CG 1
|
|
ATOM 1597 C CD . LYS A 1 235 ? -22.879 11.746 27.728 1.00 61.00 ? 437 LYS A CD 1
|
|
ATOM 1598 C CE . LYS A 1 235 ? -22.179 12.799 28.565 1.00 71.64 ? 437 LYS A CE 1
|
|
ATOM 1599 N NZ . LYS A 1 235 ? -21.422 12.190 29.696 1.00 84.96 ? 437 LYS A NZ 1
|
|
ATOM 1600 N N . ASP A 1 236 ? -22.723 9.363 24.057 1.00 65.30 ? 438 ASP A N 1
|
|
ATOM 1601 C CA . ASP A 1 236 ? -21.546 8.504 23.879 1.00 65.73 ? 438 ASP A CA 1
|
|
ATOM 1602 C C . ASP A 1 236 ? -21.047 8.586 22.452 1.00 68.99 ? 438 ASP A C 1
|
|
ATOM 1603 O O . ASP A 1 236 ? -19.838 8.683 22.249 1.00 68.49 ? 438 ASP A O 1
|
|
ATOM 1604 C CB . ASP A 1 236 ? -21.864 7.041 24.241 1.00 70.39 ? 438 ASP A CB 1
|
|
ATOM 1605 C CG . ASP A 1 236 ? -22.181 6.753 25.702 1.00 81.45 ? 438 ASP A CG 1
|
|
ATOM 1606 O OD1 . ASP A 1 236 ? -21.948 7.653 26.560 1.00 79.22 ? 438 ASP A OD1 1
|
|
ATOM 1607 O OD2 . ASP A 1 236 ? -22.678 5.632 25.990 1.00 88.99 ? 438 ASP A OD2 1
|
|
ATOM 1608 N N . GLN A 1 237 ? -21.978 8.573 21.463 1.00 64.89 ? 439 GLN A N 1
|
|
ATOM 1609 C CA . GLN A 1 237 ? -21.660 8.706 20.037 1.00 63.32 ? 439 GLN A CA 1
|
|
ATOM 1610 C C . GLN A 1 237 ? -20.878 9.990 19.840 1.00 63.44 ? 439 GLN A C 1
|
|
ATOM 1611 O O . GLN A 1 237 ? -19.766 9.940 19.321 1.00 64.50 ? 439 GLN A O 1
|
|
ATOM 1612 C CB . GLN A 1 237 ? -22.932 8.765 19.171 1.00 64.96 ? 439 GLN A CB 1
|
|
ATOM 1613 C CG . GLN A 1 237 ? -23.784 7.514 19.201 1.00 80.46 ? 439 GLN A CG 1
|
|
ATOM 1614 C CD . GLN A 1 237 ? -25.021 7.672 18.353 1.00 96.72 ? 439 GLN A CD 1
|
|
ATOM 1615 O OE1 . GLN A 1 237 ? -24.958 7.998 17.159 1.00 89.41 ? 439 GLN A OE1 1
|
|
ATOM 1616 N NE2 . GLN A 1 237 ? -26.175 7.417 18.946 1.00 89.80 ? 439 GLN A NE2 1
|
|
ATOM 1617 N N . ILE A 1 238 ? -21.435 11.130 20.295 1.00 55.27 ? 440 ILE A N 1
|
|
ATOM 1618 C CA . ILE A 1 238 ? -20.809 12.443 20.146 1.00 52.01 ? 440 ILE A CA 1
|
|
ATOM 1619 C C . ILE A 1 238 ? -19.447 12.560 20.847 1.00 56.87 ? 440 ILE A C 1
|
|
ATOM 1620 O O . ILE A 1 238 ? -18.517 13.038 20.223 1.00 56.93 ? 440 ILE A O 1
|
|
ATOM 1621 C CB . ILE A 1 238 ? -21.773 13.624 20.460 1.00 52.22 ? 440 ILE A CB 1
|
|
ATOM 1622 C CG1 . ILE A 1 238 ? -23.096 13.493 19.676 1.00 52.23 ? 440 ILE A CG1 1
|
|
ATOM 1623 C CG2 . ILE A 1 238 ? -21.093 14.962 20.165 1.00 49.98 ? 440 ILE A CG2 1
|
|
ATOM 1624 C CD1 . ILE A 1 238 ? -24.245 14.270 20.265 1.00 50.43 ? 440 ILE A CD1 1
|
|
ATOM 1625 N N . THR A 1 239 ? -19.316 12.134 22.113 1.00 54.92 ? 441 THR A N 1
|
|
ATOM 1626 C CA . THR A 1 239 ? -18.028 12.266 22.815 1.00 54.70 ? 441 THR A CA 1
|
|
ATOM 1627 C C . THR A 1 239 ? -16.945 11.421 22.210 1.00 61.42 ? 441 THR A C 1
|
|
ATOM 1628 O O . THR A 1 239 ? -15.811 11.887 22.091 1.00 62.56 ? 441 THR A O 1
|
|
ATOM 1629 C CB . THR A 1 239 ? -18.144 12.158 24.331 1.00 58.04 ? 441 THR A CB 1
|
|
ATOM 1630 O OG1 . THR A 1 239 ? -18.579 10.842 24.682 1.00 65.71 ? 441 THR A OG1 1
|
|
ATOM 1631 C CG2 . THR A 1 239 ? -19.059 13.219 24.911 1.00 44.47 ? 441 THR A CG2 1
|
|
ATOM 1632 N N . SER A 1 240 ? -17.299 10.218 21.754 1.00 58.76 ? 442 SER A N 1
|
|
ATOM 1633 C CA . SER A 1 240 ? -16.369 9.326 21.069 1.00 59.71 ? 442 SER A CA 1
|
|
ATOM 1634 C C . SER A 1 240 ? -16.144 9.774 19.613 1.00 67.69 ? 442 SER A C 1
|
|
ATOM 1635 O O . SER A 1 240 ? -15.235 9.258 18.952 1.00 68.79 ? 442 SER A O 1
|
|
ATOM 1636 C CB . SER A 1 240 ? -16.904 7.899 21.087 1.00 61.46 ? 442 SER A CB 1
|
|
ATOM 1637 O OG . SER A 1 240 ? -18.066 7.780 20.287 1.00 63.29 ? 442 SER A OG 1
|
|
ATOM 1638 N N . GLY A 1 241 ? -17.007 10.680 19.120 1.00 65.31 ? 443 GLY A N 1
|
|
ATOM 1639 C CA . GLY A 1 241 ? -17.019 11.171 17.741 1.00 64.95 ? 443 GLY A CA 1
|
|
ATOM 1640 C C . GLY A 1 241 ? -17.178 10.056 16.722 1.00 70.44 ? 443 GLY A C 1
|
|
ATOM 1641 O O . GLY A 1 241 ? -16.596 10.123 15.636 1.00 70.49 ? 443 GLY A O 1
|
|
ATOM 1642 N N . LYS A 1 242 ? -17.958 9.016 17.078 1.00 68.88 ? 444 LYS A N 1
|
|
ATOM 1643 C CA . LYS A 1 242 ? -18.190 7.848 16.228 1.00 72.11 ? 444 LYS A CA 1
|
|
ATOM 1644 C C . LYS A 1 242 ? -19.531 7.953 15.499 1.00 77.26 ? 444 LYS A C 1
|
|
ATOM 1645 O O . LYS A 1 242 ? -20.559 7.467 15.976 1.00 79.57 ? 444 LYS A O 1
|
|
ATOM 1646 C CB . LYS A 1 242 ? -18.012 6.519 17.010 1.00 76.08 ? 444 LYS A CB 1
|
|
ATOM 1647 N N . TYR A 1 243 ? -19.507 8.633 14.351 1.00 71.74 ? 445 TYR A N 1
|
|
ATOM 1648 C CA . TYR A 1 243 ? -20.674 8.855 13.505 1.00 71.21 ? 445 TYR A CA 1
|
|
ATOM 1649 C C . TYR A 1 243 ? -21.104 7.572 12.819 1.00 78.41 ? 445 TYR A C 1
|
|
ATOM 1650 O O . TYR A 1 243 ? -20.290 6.676 12.552 1.00 79.60 ? 445 TYR A O 1
|
|
ATOM 1651 C CB . TYR A 1 243 ? -20.406 9.956 12.455 1.00 69.84 ? 445 TYR A CB 1
|
|
ATOM 1652 C CG . TYR A 1 243 ? -19.096 9.780 11.725 1.00 70.83 ? 445 TYR A CG 1
|
|
ATOM 1653 C CD1 . TYR A 1 243 ? -18.993 8.927 10.633 1.00 75.00 ? 445 TYR A CD1 1
|
|
ATOM 1654 C CD2 . TYR A 1 243 ? -17.954 10.468 12.126 1.00 70.20 ? 445 TYR A CD2 1
|
|
ATOM 1655 C CE1 . TYR A 1 243 ? -17.776 8.725 9.979 1.00 77.30 ? 445 TYR A CE1 1
|
|
ATOM 1656 C CE2 . TYR A 1 243 ? -16.740 10.308 11.454 1.00 71.95 ? 445 TYR A CE2 1
|
|
ATOM 1657 C CZ . TYR A 1 243 ? -16.650 9.419 10.393 1.00 83.44 ? 445 TYR A CZ 1
|
|
ATOM 1658 O OH . TYR A 1 243 ? -15.456 9.231 9.735 1.00 87.21 ? 445 TYR A OH 1
|
|
ATOM 1659 N N . ASN A 1 244 ? -22.391 7.504 12.514 1.00 66.16 ? 446 ASN A N 1
|
|
ATOM 1660 C CA . ASN A 1 244 ? -22.972 6.389 11.816 1.00 68.26 ? 446 ASN A CA 1
|
|
ATOM 1661 C C . ASN A 1 244 ? -22.577 6.507 10.342 1.00 71.71 ? 446 ASN A C 1
|
|
ATOM 1662 O O . ASN A 1 244 ? -23.066 7.392 9.629 1.00 67.13 ? 446 ASN A O 1
|
|
ATOM 1663 C CB . ASN A 1 244 ? -24.487 6.410 12.009 1.00 70.18 ? 446 ASN A CB 1
|
|
ATOM 1664 C CG . ASN A 1 244 ? -25.167 5.160 11.542 1.00 91.81 ? 446 ASN A CG 1
|
|
ATOM 1665 O OD1 . ASN A 1 244 ? -24.915 4.060 12.043 1.00 90.19 ? 446 ASN A OD1 1
|
|
ATOM 1666 N ND2 . ASN A 1 244 ? -26.060 5.309 10.584 1.00 82.46 ? 446 ASN A ND2 1
|
|
ATOM 1667 N N . PHE A 1 245 ? -21.637 5.656 9.901 1.00 72.67 ? 447 PHE A N 1
|
|
ATOM 1668 C CA . PHE A 1 245 ? -21.226 5.682 8.500 1.00 73.74 ? 447 PHE A CA 1
|
|
ATOM 1669 C C . PHE A 1 245 ? -21.905 4.562 7.709 1.00 81.07 ? 447 PHE A C 1
|
|
ATOM 1670 O O . PHE A 1 245 ? -21.664 3.394 8.003 1.00 84.48 ? 447 PHE A O 1
|
|
ATOM 1671 C CB . PHE A 1 245 ? -19.690 5.665 8.341 1.00 76.21 ? 447 PHE A CB 1
|
|
ATOM 1672 C CG . PHE A 1 245 ? -19.263 5.782 6.894 1.00 78.74 ? 447 PHE A CG 1
|
|
ATOM 1673 C CD1 . PHE A 1 245 ? -19.270 7.012 6.248 1.00 78.95 ? 447 PHE A CD1 1
|
|
ATOM 1674 C CD2 . PHE A 1 245 ? -18.927 4.649 6.157 1.00 84.86 ? 447 PHE A CD2 1
|
|
ATOM 1675 C CE1 . PHE A 1 245 ? -18.916 7.116 4.907 1.00 81.00 ? 447 PHE A CE1 1
|
|
ATOM 1676 C CE2 . PHE A 1 245 ? -18.592 4.749 4.804 1.00 88.81 ? 447 PHE A CE2 1
|
|
ATOM 1677 C CZ . PHE A 1 245 ? -18.584 5.985 4.189 1.00 84.55 ? 447 PHE A CZ 1
|
|
ATOM 1678 N N . ILE A 1 246 ? -22.750 4.914 6.710 1.00 77.13 ? 448 ILE A N 1
|
|
ATOM 1679 C CA . ILE A 1 246 ? -23.458 3.945 5.851 1.00 79.61 ? 448 ILE A CA 1
|
|
ATOM 1680 C C . ILE A 1 246 ? -22.809 3.924 4.447 1.00 87.73 ? 448 ILE A C 1
|
|
ATOM 1681 O O . ILE A 1 246 ? -23.056 4.826 3.642 1.00 85.06 ? 448 ILE A O 1
|
|
ATOM 1682 C CB . ILE A 1 246 ? -24.997 4.165 5.823 1.00 80.93 ? 448 ILE A CB 1
|
|
ATOM 1683 C CG1 . ILE A 1 246 ? -25.587 4.149 7.247 1.00 78.59 ? 448 ILE A CG1 1
|
|
ATOM 1684 C CG2 . ILE A 1 246 ? -25.667 3.110 4.940 1.00 85.49 ? 448 ILE A CG2 1
|
|
ATOM 1685 C CD1 . ILE A 1 246 ? -26.959 4.707 7.365 1.00 80.68 ? 448 ILE A CD1 1
|
|
ATOM 1686 N N . PRO A 1 247 ? -21.956 2.911 4.161 1.00 91.81 ? 449 PRO A N 1
|
|
ATOM 1687 C CA . PRO A 1 247 ? -21.226 2.881 2.871 1.00 94.44 ? 449 PRO A CA 1
|
|
ATOM 1688 C C . PRO A 1 247 ? -22.026 3.078 1.589 1.00 101.76 ? 449 PRO A C 1
|
|
ATOM 1689 O O . PRO A 1 247 ? -21.572 3.824 0.719 1.00 100.62 ? 449 PRO A O 1
|
|
ATOM 1690 C CB . PRO A 1 247 ? -20.511 1.527 2.893 1.00 99.90 ? 449 PRO A CB 1
|
|
ATOM 1691 C CG . PRO A 1 247 ? -20.352 1.205 4.336 1.00 103.41 ? 449 PRO A CG 1
|
|
ATOM 1692 C CD . PRO A 1 247 ? -21.558 1.777 5.027 1.00 96.31 ? 449 PRO A CD 1
|
|
ATOM 1693 N N . GLU A 1 248 ? -23.199 2.416 1.473 1.00 102.13 ? 450 GLU A N 1
|
|
ATOM 1694 C CA . GLU A 1 248 ? -24.081 2.480 0.294 1.00 103.97 ? 450 GLU A CA 1
|
|
ATOM 1695 C C . GLU A 1 248 ? -24.524 3.915 0.017 1.00 103.91 ? 450 GLU A C 1
|
|
ATOM 1696 O O . GLU A 1 248 ? -24.526 4.354 -1.134 1.00 104.04 ? 450 GLU A O 1
|
|
ATOM 1697 C CB . GLU A 1 248 ? -25.315 1.559 0.451 1.00 107.93 ? 450 GLU A CB 1
|
|
ATOM 1698 C CG . GLU A 1 248 ? -25.005 0.110 0.813 1.00 124.22 ? 450 GLU A CG 1
|
|
ATOM 1699 C CD . GLU A 1 248 ? -25.064 -0.264 2.287 1.00 143.29 ? 450 GLU A CD 1
|
|
ATOM 1700 O OE1 . GLU A 1 248 ? -25.802 0.396 3.056 1.00 127.16 ? 450 GLU A OE1 1
|
|
ATOM 1701 O OE2 . GLU A 1 248 ? -24.415 -1.269 2.659 1.00 138.06 ? 450 GLU A OE2 1
|
|
ATOM 1702 N N . VAL A 1 249 ? -24.866 4.645 1.079 1.00 97.28 ? 451 VAL A N 1
|
|
ATOM 1703 C CA . VAL A 1 249 ? -25.314 6.034 1.002 1.00 94.43 ? 451 VAL A CA 1
|
|
ATOM 1704 C C . VAL A 1 249 ? -24.170 6.941 0.510 1.00 97.70 ? 451 VAL A C 1
|
|
ATOM 1705 O O . VAL A 1 249 ? -24.355 7.703 -0.445 1.00 96.32 ? 451 VAL A O 1
|
|
ATOM 1706 C CB . VAL A 1 249 ? -25.896 6.488 2.375 1.00 95.37 ? 451 VAL A CB 1
|
|
ATOM 1707 C CG1 . VAL A 1 249 ? -26.141 7.991 2.417 1.00 91.42 ? 451 VAL A CG1 1
|
|
ATOM 1708 C CG2 . VAL A 1 249 ? -27.173 5.723 2.715 1.00 96.61 ? 451 VAL A CG2 1
|
|
ATOM 1709 N N . TRP A 1 250 ? -22.986 6.806 1.146 1.00 94.55 ? 452 TRP A N 1
|
|
ATOM 1710 C CA . TRP A 1 250 ? -21.777 7.598 0.911 1.00 93.07 ? 452 TRP A CA 1
|
|
ATOM 1711 C C . TRP A 1 250 ? -20.953 7.285 -0.327 1.00 99.52 ? 452 TRP A C 1
|
|
ATOM 1712 O O . TRP A 1 250 ? -20.121 8.110 -0.704 1.00 97.79 ? 452 TRP A O 1
|
|
ATOM 1713 C CB . TRP A 1 250 ? -20.903 7.621 2.161 1.00 90.19 ? 452 TRP A CB 1
|
|
ATOM 1714 C CG . TRP A 1 250 ? -21.458 8.492 3.247 1.00 87.54 ? 452 TRP A CG 1
|
|
ATOM 1715 C CD1 . TRP A 1 250 ? -22.320 8.122 4.238 1.00 89.81 ? 452 TRP A CD1 1
|
|
ATOM 1716 C CD2 . TRP A 1 250 ? -21.170 9.883 3.458 1.00 84.33 ? 452 TRP A CD2 1
|
|
ATOM 1717 N NE1 . TRP A 1 250 ? -22.601 9.199 5.047 1.00 86.00 ? 452 TRP A NE1 1
|
|
ATOM 1718 C CE2 . TRP A 1 250 ? -21.903 10.294 4.596 1.00 86.02 ? 452 TRP A CE2 1
|
|
ATOM 1719 C CE3 . TRP A 1 250 ? -20.375 10.833 2.782 1.00 84.47 ? 452 TRP A CE3 1
|
|
ATOM 1720 C CZ2 . TRP A 1 250 ? -21.867 11.618 5.074 1.00 82.14 ? 452 TRP A CZ2 1
|
|
ATOM 1721 C CZ3 . TRP A 1 250 ? -20.344 12.140 3.254 1.00 82.69 ? 452 TRP A CZ3 1
|
|
ATOM 1722 C CH2 . TRP A 1 250 ? -21.083 12.523 4.383 1.00 81.08 ? 452 TRP A CH2 1
|
|
ATOM 1723 N N . ALA A 1 251 ? -21.188 6.122 -0.974 1.00 100.22 ? 453 ALA A N 1
|
|
ATOM 1724 C CA . ALA A 1 251 ? -20.499 5.711 -2.207 1.00 102.91 ? 453 ALA A CA 1
|
|
ATOM 1725 C C . ALA A 1 251 ? -20.818 6.687 -3.357 1.00 107.26 ? 453 ALA A C 1
|
|
ATOM 1726 O O . ALA A 1 251 ? -20.020 6.841 -4.286 1.00 108.93 ? 453 ALA A O 1
|
|
ATOM 1727 C CB . ALA A 1 251 ? -20.912 4.305 -2.582 1.00 107.31 ? 453 ALA A CB 1
|
|
ATOM 1728 N N . GLU A 1 252 ? -21.979 7.363 -3.255 1.00 101.79 ? 454 GLU A N 1
|
|
ATOM 1729 C CA . GLU A 1 252 ? -22.497 8.375 -4.180 1.00 100.75 ? 454 GLU A CA 1
|
|
ATOM 1730 C C . GLU A 1 252 ? -21.711 9.680 -4.022 1.00 98.22 ? 454 GLU A C 1
|
|
ATOM 1731 O O . GLU A 1 252 ? -21.568 10.437 -4.984 1.00 99.71 ? 454 GLU A O 1
|
|
ATOM 1732 C CB . GLU A 1 252 ? -23.995 8.650 -3.886 1.00 100.90 ? 454 GLU A CB 1
|
|
ATOM 1733 C CG . GLU A 1 252 ? -24.906 7.441 -4.054 1.00 113.35 ? 454 GLU A CG 1
|
|
ATOM 1734 N N . VAL A 1 253 ? -21.233 9.946 -2.798 1.00 87.59 ? 455 VAL A N 1
|
|
ATOM 1735 C CA . VAL A 1 253 ? -20.485 11.160 -2.399 1.00 82.09 ? 455 VAL A CA 1
|
|
ATOM 1736 C C . VAL A 1 253 ? -18.981 10.970 -2.701 1.00 84.15 ? 455 VAL A C 1
|
|
ATOM 1737 O O . VAL A 1 253 ? -18.477 9.844 -2.637 1.00 85.56 ? 455 VAL A O 1
|
|
ATOM 1738 C CB . VAL A 1 253 ? -20.775 11.516 -0.896 1.00 80.43 ? 455 VAL A CB 1
|
|
ATOM 1739 C CG1 . VAL A 1 253 ? -19.982 12.726 -0.417 1.00 77.15 ? 455 VAL A CG1 1
|
|
ATOM 1740 C CG2 . VAL A 1 253 ? -22.269 11.728 -0.653 1.00 78.24 ? 455 VAL A CG2 1
|
|
ATOM 1741 N N . SER A 1 254 ? -18.286 12.065 -3.064 1.00 77.38 ? 456 SER A N 1
|
|
ATOM 1742 C CA . SER A 1 254 ? -16.850 12.050 -3.347 1.00 77.84 ? 456 SER A CA 1
|
|
ATOM 1743 C C . SER A 1 254 ? -16.019 11.830 -2.067 1.00 82.57 ? 456 SER A C 1
|
|
ATOM 1744 O O . SER A 1 254 ? -16.480 12.136 -0.957 1.00 80.67 ? 456 SER A O 1
|
|
ATOM 1745 C CB . SER A 1 254 ? -16.424 13.342 -4.045 1.00 78.41 ? 456 SER A CB 1
|
|
ATOM 1746 O OG . SER A 1 254 ? -16.056 14.377 -3.144 1.00 80.94 ? 456 SER A OG 1
|
|
ATOM 1747 N N . GLU A 1 255 ? -14.784 11.324 -2.237 1.00 81.38 ? 457 GLU A N 1
|
|
ATOM 1748 C CA . GLU A 1 255 ? -13.822 11.085 -1.156 1.00 80.38 ? 457 GLU A CA 1
|
|
ATOM 1749 C C . GLU A 1 255 ? -13.382 12.408 -0.502 1.00 81.08 ? 457 GLU A C 1
|
|
ATOM 1750 O O . GLU A 1 255 ? -13.153 12.439 0.715 1.00 79.50 ? 457 GLU A O 1
|
|
ATOM 1751 C CB . GLU A 1 255 ? -12.610 10.299 -1.685 1.00 85.17 ? 457 GLU A CB 1
|
|
ATOM 1752 N N . LYS A 1 256 ? -13.305 13.501 -1.313 1.00 75.75 ? 458 LYS A N 1
|
|
ATOM 1753 C CA . LYS A 1 256 ? -12.947 14.851 -0.869 1.00 72.72 ? 458 LYS A CA 1
|
|
ATOM 1754 C C . LYS A 1 256 ? -14.017 15.442 0.060 1.00 73.48 ? 458 LYS A C 1
|
|
ATOM 1755 O O . LYS A 1 256 ? -13.671 15.997 1.101 1.00 71.21 ? 458 LYS A O 1
|
|
ATOM 1756 C CB . LYS A 1 256 ? -12.725 15.783 -2.066 1.00 75.38 ? 458 LYS A CB 1
|
|
ATOM 1757 C CG . LYS A 1 256 ? -11.410 15.568 -2.781 1.00 80.08 ? 458 LYS A CG 1
|
|
ATOM 1758 C CD . LYS A 1 256 ? -11.327 16.399 -4.048 1.00 83.86 ? 458 LYS A CD 1
|
|
ATOM 1759 C CE . LYS A 1 256 ? -9.919 16.469 -4.577 1.00 88.39 ? 458 LYS A CE 1
|
|
ATOM 1760 N NZ . LYS A 1 256 ? -9.746 17.644 -5.459 1.00 103.71 ? 458 LYS A NZ 1
|
|
ATOM 1761 N N . ALA A 1 257 ? -15.307 15.326 -0.315 1.00 69.72 ? 459 ALA A N 1
|
|
ATOM 1762 C CA . ALA A 1 257 ? -16.424 15.826 0.482 1.00 66.76 ? 459 ALA A CA 1
|
|
ATOM 1763 C C . ALA A 1 257 ? -16.375 15.190 1.873 1.00 70.10 ? 459 ALA A C 1
|
|
ATOM 1764 O O . ALA A 1 257 ? -16.295 15.915 2.867 1.00 67.15 ? 459 ALA A O 1
|
|
ATOM 1765 C CB . ALA A 1 257 ? -17.744 15.502 -0.208 1.00 68.16 ? 459 ALA A CB 1
|
|
ATOM 1766 N N . LEU A 1 258 ? -16.308 13.840 1.926 1.00 68.68 ? 460 LEU A N 1
|
|
ATOM 1767 C CA . LEU A 1 258 ? -16.231 13.052 3.162 1.00 68.09 ? 460 LEU A CA 1
|
|
ATOM 1768 C C . LEU A 1 258 ? -14.960 13.329 3.996 1.00 71.36 ? 460 LEU A C 1
|
|
ATOM 1769 O O . LEU A 1 258 ? -15.022 13.243 5.225 1.00 70.57 ? 460 LEU A O 1
|
|
ATOM 1770 C CB . LEU A 1 258 ? -16.385 11.552 2.842 1.00 71.04 ? 460 LEU A CB 1
|
|
ATOM 1771 C CG . LEU A 1 258 ? -16.256 10.535 3.986 1.00 75.80 ? 460 LEU A CG 1
|
|
ATOM 1772 C CD1 . LEU A 1 258 ? -17.393 10.667 5.007 1.00 73.65 ? 460 LEU A CD1 1
|
|
ATOM 1773 C CD2 . LEU A 1 258 ? -16.173 9.136 3.439 1.00 80.18 ? 460 LEU A CD2 1
|
|
ATOM 1774 N N . ASP A 1 259 ? -13.821 13.661 3.337 1.00 67.73 ? 461 ASP A N 1
|
|
ATOM 1775 C CA . ASP A 1 259 ? -12.565 13.992 4.021 1.00 66.40 ? 461 ASP A CA 1
|
|
ATOM 1776 C C . ASP A 1 259 ? -12.771 15.234 4.873 1.00 67.38 ? 461 ASP A C 1
|
|
ATOM 1777 O O . ASP A 1 259 ? -12.397 15.215 6.044 1.00 67.91 ? 461 ASP A O 1
|
|
ATOM 1778 C CB . ASP A 1 259 ? -11.407 14.187 3.022 1.00 69.79 ? 461 ASP A CB 1
|
|
ATOM 1779 C CG . ASP A 1 259 ? -10.043 14.387 3.663 1.00 77.98 ? 461 ASP A CG 1
|
|
ATOM 1780 O OD1 . ASP A 1 259 ? -9.557 13.450 4.337 1.00 79.78 ? 461 ASP A OD1 1
|
|
ATOM 1781 O OD2 . ASP A 1 259 ? -9.434 15.451 3.438 1.00 82.29 ? 461 ASP A OD2 1
|
|
ATOM 1782 N N . LEU A 1 260 ? -13.433 16.281 4.316 1.00 60.70 ? 462 LEU A N 1
|
|
ATOM 1783 C CA . LEU A 1 260 ? -13.740 17.533 5.029 1.00 57.09 ? 462 LEU A CA 1
|
|
ATOM 1784 C C . LEU A 1 260 ? -14.638 17.285 6.237 1.00 61.41 ? 462 LEU A C 1
|
|
ATOM 1785 O O . LEU A 1 260 ? -14.365 17.826 7.302 1.00 60.64 ? 462 LEU A O 1
|
|
ATOM 1786 C CB . LEU A 1 260 ? -14.374 18.543 4.073 1.00 55.56 ? 462 LEU A CB 1
|
|
ATOM 1787 C CG . LEU A 1 260 ? -14.716 19.941 4.588 1.00 56.57 ? 462 LEU A CG 1
|
|
ATOM 1788 C CD1 . LEU A 1 260 ? -13.531 20.644 5.258 1.00 54.35 ? 462 LEU A CD1 1
|
|
ATOM 1789 C CD2 . LEU A 1 260 ? -15.187 20.780 3.444 1.00 61.71 ? 462 LEU A CD2 1
|
|
ATOM 1790 N N . VAL A 1 261 ? -15.681 16.439 6.074 1.00 59.15 ? 463 VAL A N 1
|
|
ATOM 1791 C CA . VAL A 1 261 ? -16.626 16.026 7.119 1.00 57.83 ? 463 VAL A CA 1
|
|
ATOM 1792 C C . VAL A 1 261 ? -15.786 15.478 8.271 1.00 62.80 ? 463 VAL A C 1
|
|
ATOM 1793 O O . VAL A 1 261 ? -15.796 16.059 9.359 1.00 61.43 ? 463 VAL A O 1
|
|
ATOM 1794 C CB . VAL A 1 261 ? -17.670 14.983 6.587 1.00 62.34 ? 463 VAL A CB 1
|
|
ATOM 1795 C CG1 . VAL A 1 261 ? -18.502 14.377 7.720 1.00 61.53 ? 463 VAL A CG1 1
|
|
ATOM 1796 C CG2 . VAL A 1 261 ? -18.573 15.591 5.517 1.00 61.20 ? 463 VAL A CG2 1
|
|
ATOM 1797 N N . LYS A 1 262 ? -14.978 14.428 7.986 1.00 61.27 ? 464 LYS A N 1
|
|
ATOM 1798 C CA . LYS A 1 262 ? -14.054 13.769 8.917 1.00 61.40 ? 464 LYS A CA 1
|
|
ATOM 1799 C C . LYS A 1 262 ? -13.184 14.785 9.657 1.00 64.89 ? 464 LYS A C 1
|
|
ATOM 1800 O O . LYS A 1 262 ? -13.031 14.657 10.858 1.00 66.70 ? 464 LYS A O 1
|
|
ATOM 1801 C CB . LYS A 1 262 ? -13.167 12.751 8.178 1.00 65.55 ? 464 LYS A CB 1
|
|
ATOM 1802 C CG . LYS A 1 262 ? -13.864 11.466 7.757 1.00 66.58 ? 464 LYS A CG 1
|
|
ATOM 1803 C CD . LYS A 1 262 ? -12.929 10.594 6.940 1.00 75.11 ? 464 LYS A CD 1
|
|
ATOM 1804 C CE . LYS A 1 262 ? -13.330 9.145 6.965 1.00 94.71 ? 464 LYS A CE 1
|
|
ATOM 1805 N NZ . LYS A 1 262 ? -12.298 8.286 6.332 1.00 109.69 ? 464 LYS A NZ 1
|
|
ATOM 1806 N N . LYS A 1 263 ? -12.678 15.824 8.963 1.00 59.87 ? 465 LYS A N 1
|
|
ATOM 1807 C CA . LYS A 1 263 ? -11.834 16.879 9.543 1.00 57.43 ? 465 LYS A CA 1
|
|
ATOM 1808 C C . LYS A 1 263 ? -12.561 17.857 10.464 1.00 59.38 ? 465 LYS A C 1
|
|
ATOM 1809 O O . LYS A 1 263 ? -11.929 18.475 11.319 1.00 58.48 ? 465 LYS A O 1
|
|
ATOM 1810 C CB . LYS A 1 263 ? -11.025 17.589 8.458 1.00 58.05 ? 465 LYS A CB 1
|
|
ATOM 1811 C CG . LYS A 1 263 ? -9.770 16.806 8.121 1.00 59.83 ? 465 LYS A CG 1
|
|
ATOM 1812 C CD . LYS A 1 263 ? -9.309 17.002 6.694 1.00 67.61 ? 465 LYS A CD 1
|
|
ATOM 1813 C CE . LYS A 1 263 ? -8.114 16.122 6.387 1.00 73.92 ? 465 LYS A CE 1
|
|
ATOM 1814 N NZ . LYS A 1 263 ? -7.484 16.459 5.070 1.00 81.13 ? 465 LYS A NZ 1
|
|
ATOM 1815 N N . LEU A 1 264 ? -13.881 17.998 10.294 1.00 55.55 ? 466 LEU A N 1
|
|
ATOM 1816 C CA . LEU A 1 264 ? -14.721 18.886 11.119 1.00 53.24 ? 466 LEU A CA 1
|
|
ATOM 1817 C C . LEU A 1 264 ? -15.345 18.102 12.249 1.00 57.94 ? 466 LEU A C 1
|
|
ATOM 1818 O O . LEU A 1 264 ? -15.581 18.655 13.305 1.00 56.80 ? 466 LEU A O 1
|
|
ATOM 1819 C CB . LEU A 1 264 ? -15.817 19.598 10.295 1.00 51.39 ? 466 LEU A CB 1
|
|
ATOM 1820 C CG . LEU A 1 264 ? -15.356 20.617 9.228 1.00 54.21 ? 466 LEU A CG 1
|
|
ATOM 1821 C CD1 . LEU A 1 264 ? -16.413 20.768 8.132 1.00 53.00 ? 466 LEU A CD1 1
|
|
ATOM 1822 C CD2 . LEU A 1 264 ? -15.062 21.967 9.849 1.00 52.64 ? 466 LEU A CD2 1
|
|
ATOM 1823 N N . LEU A 1 265 ? -15.611 16.808 12.037 1.00 56.63 ? 467 LEU A N 1
|
|
ATOM 1824 C CA . LEU A 1 265 ? -16.175 15.969 13.083 1.00 55.93 ? 467 LEU A CA 1
|
|
ATOM 1825 C C . LEU A 1 265 ? -15.102 15.343 13.996 1.00 61.15 ? 467 LEU A C 1
|
|
ATOM 1826 O O . LEU A 1 265 ? -15.268 14.219 14.471 1.00 64.83 ? 467 LEU A O 1
|
|
ATOM 1827 C CB . LEU A 1 265 ? -17.210 14.977 12.532 1.00 56.07 ? 467 LEU A CB 1
|
|
ATOM 1828 C CG . LEU A 1 265 ? -18.510 15.620 11.971 1.00 58.23 ? 467 LEU A CG 1
|
|
ATOM 1829 C CD1 . LEU A 1 265 ? -19.504 14.552 11.545 1.00 58.93 ? 467 LEU A CD1 1
|
|
ATOM 1830 C CD2 . LEU A 1 265 ? -19.181 16.584 12.992 1.00 55.94 ? 467 LEU A CD2 1
|
|
ATOM 1831 N N . VAL A 1 266 ? -14.014 16.118 14.264 1.00 54.20 ? 468 VAL A N 1
|
|
ATOM 1832 C CA . VAL A 1 266 ? -12.869 15.806 15.149 1.00 54.10 ? 468 VAL A CA 1
|
|
ATOM 1833 C C . VAL A 1 266 ? -13.296 16.181 16.585 1.00 58.25 ? 468 VAL A C 1
|
|
ATOM 1834 O O . VAL A 1 266 ? -13.821 17.269 16.803 1.00 57.54 ? 468 VAL A O 1
|
|
ATOM 1835 C CB . VAL A 1 266 ? -11.573 16.566 14.693 1.00 56.39 ? 468 VAL A CB 1
|
|
ATOM 1836 C CG1 . VAL A 1 266 ? -10.499 16.622 15.781 1.00 56.86 ? 468 VAL A CG1 1
|
|
ATOM 1837 C CG2 . VAL A 1 266 ? -11.009 15.988 13.399 1.00 56.87 ? 468 VAL A CG2 1
|
|
ATOM 1838 N N . VAL A 1 267 ? -13.110 15.271 17.535 1.00 55.83 ? 469 VAL A N 1
|
|
ATOM 1839 C CA . VAL A 1 267 ? -13.463 15.442 18.954 1.00 54.91 ? 469 VAL A CA 1
|
|
ATOM 1840 C C . VAL A 1 267 ? -12.649 16.528 19.682 1.00 59.49 ? 469 VAL A C 1
|
|
ATOM 1841 O O . VAL A 1 267 ? -13.247 17.322 20.405 1.00 59.42 ? 469 VAL A O 1
|
|
ATOM 1842 C CB . VAL A 1 267 ? -13.447 14.079 19.675 1.00 59.86 ? 469 VAL A CB 1
|
|
ATOM 1843 C CG1 . VAL A 1 267 ? -13.477 14.229 21.189 1.00 60.05 ? 469 VAL A CG1 1
|
|
ATOM 1844 C CG2 . VAL A 1 267 ? -14.599 13.203 19.187 1.00 59.82 ? 469 VAL A CG2 1
|
|
ATOM 1845 N N . ASP A 1 268 ? -11.308 16.568 19.491 1.00 56.48 ? 470 ASP A N 1
|
|
ATOM 1846 C CA . ASP A 1 268 ? -10.406 17.571 20.088 1.00 54.69 ? 470 ASP A CA 1
|
|
ATOM 1847 C C . ASP A 1 268 ? -10.718 18.952 19.477 1.00 56.17 ? 470 ASP A C 1
|
|
ATOM 1848 O O . ASP A 1 268 ? -10.486 19.134 18.277 1.00 55.60 ? 470 ASP A O 1
|
|
ATOM 1849 C CB . ASP A 1 268 ? -8.930 17.182 19.844 1.00 56.57 ? 470 ASP A CB 1
|
|
ATOM 1850 C CG . ASP A 1 268 ? -7.905 18.005 20.601 1.00 60.26 ? 470 ASP A CG 1
|
|
ATOM 1851 O OD1 . ASP A 1 268 ? -8.303 18.963 21.290 1.00 60.84 ? 470 ASP A OD1 1
|
|
ATOM 1852 O OD2 . ASP A 1 268 ? -6.695 17.701 20.488 1.00 64.76 ? 470 ASP A OD2 1
|
|
ATOM 1853 N N . PRO A 1 269 ? -11.278 19.928 20.250 1.00 50.77 ? 471 PRO A N 1
|
|
ATOM 1854 C CA . PRO A 1 269 ? -11.617 21.243 19.634 1.00 47.35 ? 471 PRO A CA 1
|
|
ATOM 1855 C C . PRO A 1 269 ? -10.404 22.017 19.134 1.00 51.51 ? 471 PRO A C 1
|
|
ATOM 1856 O O . PRO A 1 269 ? -10.572 22.821 18.227 1.00 50.48 ? 471 PRO A O 1
|
|
ATOM 1857 C CB . PRO A 1 269 ? -12.406 21.985 20.721 1.00 47.36 ? 471 PRO A CB 1
|
|
ATOM 1858 C CG . PRO A 1 269 ? -12.034 21.303 21.991 1.00 53.88 ? 471 PRO A CG 1
|
|
ATOM 1859 C CD . PRO A 1 269 ? -11.642 19.888 21.683 1.00 51.43 ? 471 PRO A CD 1
|
|
ATOM 1860 N N . LYS A 1 270 ? -9.176 21.685 19.643 1.00 48.74 ? 472 LYS A N 1
|
|
ATOM 1861 C CA . LYS A 1 270 ? -7.890 22.286 19.255 1.00 47.38 ? 472 LYS A CA 1
|
|
ATOM 1862 C C . LYS A 1 270 ? -7.372 21.763 17.925 1.00 52.85 ? 472 LYS A C 1
|
|
ATOM 1863 O O . LYS A 1 270 ? -6.746 22.518 17.173 1.00 53.01 ? 472 LYS A O 1
|
|
ATOM 1864 C CB . LYS A 1 270 ? -6.839 22.116 20.345 1.00 49.06 ? 472 LYS A CB 1
|
|
ATOM 1865 C CG . LYS A 1 270 ? -7.190 22.849 21.637 1.00 43.63 ? 472 LYS A CG 1
|
|
ATOM 1866 C CD . LYS A 1 270 ? -5.980 23.095 22.536 1.00 43.82 ? 472 LYS A CD 1
|
|
ATOM 1867 C CE . LYS A 1 270 ? -5.159 24.285 22.095 1.00 49.50 ? 472 LYS A CE 1
|
|
ATOM 1868 N NZ . LYS A 1 270 ? -3.982 24.464 22.977 1.00 55.39 ? 472 LYS A NZ 1
|
|
ATOM 1869 N N . ALA A 1 271 ? -7.652 20.485 17.629 1.00 50.47 ? 473 ALA A N 1
|
|
ATOM 1870 C CA . ALA A 1 271 ? -7.266 19.800 16.389 1.00 51.40 ? 473 ALA A CA 1
|
|
ATOM 1871 C C . ALA A 1 271 ? -8.317 19.982 15.291 1.00 56.89 ? 473 ALA A C 1
|
|
ATOM 1872 O O . ALA A 1 271 ? -7.950 19.973 14.112 1.00 58.09 ? 473 ALA A O 1
|
|
ATOM 1873 C CB . ALA A 1 271 ? -7.062 18.321 16.653 1.00 53.97 ? 473 ALA A CB 1
|
|
ATOM 1874 N N . ARG A 1 272 ? -9.626 20.142 15.664 1.00 51.10 ? 474 ARG A N 1
|
|
ATOM 1875 C CA . ARG A 1 272 ? -10.736 20.374 14.725 1.00 48.56 ? 474 ARG A CA 1
|
|
ATOM 1876 C C . ARG A 1 272 ? -10.403 21.443 13.668 1.00 51.91 ? 474 ARG A C 1
|
|
ATOM 1877 O O . ARG A 1 272 ? -9.701 22.404 13.979 1.00 52.39 ? 474 ARG A O 1
|
|
ATOM 1878 C CB . ARG A 1 272 ? -11.969 20.813 15.499 1.00 45.01 ? 474 ARG A CB 1
|
|
ATOM 1879 C CG . ARG A 1 272 ? -13.268 20.868 14.700 1.00 38.47 ? 474 ARG A CG 1
|
|
ATOM 1880 C CD . ARG A 1 272 ? -14.276 20.195 15.562 1.00 49.09 ? 474 ARG A CD 1
|
|
ATOM 1881 N NE . ARG A 1 272 ? -14.802 21.057 16.612 1.00 55.91 ? 474 ARG A NE 1
|
|
ATOM 1882 C CZ . ARG A 1 272 ? -15.065 20.657 17.848 1.00 64.36 ? 474 ARG A CZ 1
|
|
ATOM 1883 N NH1 . ARG A 1 272 ? -14.777 19.425 18.229 1.00 49.88 ? 474 ARG A NH1 1
|
|
ATOM 1884 N NH2 . ARG A 1 272 ? -15.610 21.488 18.714 1.00 56.46 ? 474 ARG A NH2 1
|
|
ATOM 1885 N N . PHE A 1 273 ? -10.899 21.265 12.426 1.00 47.30 ? 475 PHE A N 1
|
|
ATOM 1886 C CA . PHE A 1 273 ? -10.666 22.210 11.336 1.00 46.43 ? 475 PHE A CA 1
|
|
ATOM 1887 C C . PHE A 1 273 ? -11.347 23.561 11.616 1.00 50.40 ? 475 PHE A C 1
|
|
ATOM 1888 O O . PHE A 1 273 ? -12.484 23.615 12.118 1.00 48.26 ? 475 PHE A O 1
|
|
ATOM 1889 C CB . PHE A 1 273 ? -11.186 21.631 10.014 1.00 48.51 ? 475 PHE A CB 1
|
|
ATOM 1890 C CG . PHE A 1 273 ? -10.180 21.320 8.924 1.00 52.31 ? 475 PHE A CG 1
|
|
ATOM 1891 C CD1 . PHE A 1 273 ? -8.919 20.823 9.234 1.00 56.70 ? 475 PHE A CD1 1
|
|
ATOM 1892 C CD2 . PHE A 1 273 ? -10.524 21.441 7.587 1.00 55.56 ? 475 PHE A CD2 1
|
|
ATOM 1893 C CE1 . PHE A 1 273 ? -8.004 20.517 8.230 1.00 58.47 ? 475 PHE A CE1 1
|
|
ATOM 1894 C CE2 . PHE A 1 273 ? -9.606 21.130 6.585 1.00 60.67 ? 475 PHE A CE2 1
|
|
ATOM 1895 C CZ . PHE A 1 273 ? -8.354 20.668 6.920 1.00 59.37 ? 475 PHE A CZ 1
|
|
ATOM 1896 N N . THR A 1 274 ? -10.640 24.656 11.299 1.00 47.69 ? 476 THR A N 1
|
|
ATOM 1897 C CA . THR A 1 274 ? -11.189 26.008 11.454 1.00 45.80 ? 476 THR A CA 1
|
|
ATOM 1898 C C . THR A 1 274 ? -11.937 26.328 10.158 1.00 49.68 ? 476 THR A C 1
|
|
ATOM 1899 O O . THR A 1 274 ? -11.893 25.513 9.234 1.00 50.60 ? 476 THR A O 1
|
|
ATOM 1900 C CB . THR A 1 274 ? -10.055 26.986 11.734 1.00 48.26 ? 476 THR A CB 1
|
|
ATOM 1901 O OG1 . THR A 1 274 ? -9.157 26.956 10.616 1.00 57.96 ? 476 THR A OG1 1
|
|
ATOM 1902 C CG2 . THR A 1 274 ? -9.301 26.655 13.014 1.00 37.10 ? 476 THR A CG2 1
|
|
ATOM 1903 N N . THR A 1 275 ? -12.614 27.488 10.070 1.00 45.98 ? 477 THR A N 1
|
|
ATOM 1904 C CA . THR A 1 275 ? -13.294 27.902 8.830 1.00 46.45 ? 477 THR A CA 1
|
|
ATOM 1905 C C . THR A 1 275 ? -12.250 28.155 7.714 1.00 53.12 ? 477 THR A C 1
|
|
ATOM 1906 O O . THR A 1 275 ? -12.453 27.732 6.571 1.00 54.87 ? 477 THR A O 1
|
|
ATOM 1907 C CB . THR A 1 275 ? -14.248 29.071 9.086 1.00 55.02 ? 477 THR A CB 1
|
|
ATOM 1908 O OG1 . THR A 1 275 ? -13.579 30.060 9.862 1.00 56.49 ? 477 THR A OG1 1
|
|
ATOM 1909 C CG2 . THR A 1 275 ? -15.497 28.639 9.819 1.00 51.19 ? 477 THR A CG2 1
|
|
ATOM 1910 N N . GLU A 1 276 ? -11.086 28.731 8.080 1.00 48.21 ? 478 GLU A N 1
|
|
ATOM 1911 C CA . GLU A 1 276 ? -9.961 28.968 7.159 1.00 49.01 ? 478 GLU A CA 1
|
|
ATOM 1912 C C . GLU A 1 276 ? -9.389 27.653 6.572 1.00 53.25 ? 478 GLU A C 1
|
|
ATOM 1913 O O . GLU A 1 276 ? -9.132 27.554 5.353 1.00 55.45 ? 478 GLU A O 1
|
|
ATOM 1914 C CB . GLU A 1 276 ? -8.847 29.820 7.809 1.00 50.70 ? 478 GLU A CB 1
|
|
ATOM 1915 C CG . GLU A 1 276 ? -9.342 31.097 8.487 1.00 68.60 ? 478 GLU A CG 1
|
|
ATOM 1916 C CD . GLU A 1 276 ? -9.955 30.972 9.880 1.00 98.62 ? 478 GLU A CD 1
|
|
ATOM 1917 O OE1 . GLU A 1 276 ? -9.426 30.181 10.698 1.00 103.81 ? 478 GLU A OE1 1
|
|
ATOM 1918 O OE2 . GLU A 1 276 ? -10.938 31.696 10.168 1.00 90.01 ? 478 GLU A OE2 1
|
|
ATOM 1919 N N . GLU A 1 277 ? -9.217 26.644 7.426 1.00 47.24 ? 479 GLU A N 1
|
|
ATOM 1920 C CA . GLU A 1 277 ? -8.700 25.344 6.986 1.00 47.87 ? 479 GLU A CA 1
|
|
ATOM 1921 C C . GLU A 1 277 ? -9.683 24.676 6.034 1.00 52.67 ? 479 GLU A C 1
|
|
ATOM 1922 O O . GLU A 1 277 ? -9.266 24.176 4.978 1.00 54.99 ? 479 GLU A O 1
|
|
ATOM 1923 C CB . GLU A 1 277 ? -8.392 24.428 8.179 1.00 48.44 ? 479 GLU A CB 1
|
|
ATOM 1924 C CG . GLU A 1 277 ? -7.207 24.888 9.006 1.00 50.08 ? 479 GLU A CG 1
|
|
ATOM 1925 C CD . GLU A 1 277 ? -6.856 23.916 10.100 1.00 65.50 ? 479 GLU A CD 1
|
|
ATOM 1926 O OE1 . GLU A 1 277 ? -7.714 23.679 10.977 1.00 55.91 ? 479 GLU A OE1 1
|
|
ATOM 1927 O OE2 . GLU A 1 277 ? -5.774 23.298 10.013 1.00 72.37 ? 479 GLU A OE2 1
|
|
ATOM 1928 N N . ALA A 1 278 ? -10.995 24.713 6.398 1.00 46.18 ? 480 ALA A N 1
|
|
ATOM 1929 C CA . ALA A 1 278 ? -12.104 24.182 5.610 1.00 45.62 ? 480 ALA A CA 1
|
|
ATOM 1930 C C . ALA A 1 278 ? -12.132 24.859 4.228 1.00 52.67 ? 480 ALA A C 1
|
|
ATOM 1931 O O . ALA A 1 278 ? -12.050 24.161 3.231 1.00 54.42 ? 480 ALA A O 1
|
|
ATOM 1932 C CB . ALA A 1 278 ? -13.415 24.391 6.350 1.00 44.17 ? 480 ALA A CB 1
|
|
ATOM 1933 N N . LEU A 1 279 ? -12.104 26.209 4.172 1.00 50.41 ? 481 LEU A N 1
|
|
ATOM 1934 C CA . LEU A 1 279 ? -12.086 26.997 2.932 1.00 51.56 ? 481 LEU A CA 1
|
|
ATOM 1935 C C . LEU A 1 279 ? -10.874 26.704 2.049 1.00 59.63 ? 481 LEU A C 1
|
|
ATOM 1936 O O . LEU A 1 279 ? -10.947 26.936 0.827 1.00 61.87 ? 481 LEU A O 1
|
|
ATOM 1937 C CB . LEU A 1 279 ? -12.185 28.504 3.238 1.00 50.54 ? 481 LEU A CB 1
|
|
ATOM 1938 C CG . LEU A 1 279 ? -13.565 29.041 3.632 1.00 51.22 ? 481 LEU A CG 1
|
|
ATOM 1939 C CD1 . LEU A 1 279 ? -13.432 30.343 4.405 1.00 47.88 ? 481 LEU A CD1 1
|
|
ATOM 1940 C CD2 . LEU A 1 279 ? -14.435 29.235 2.409 1.00 52.42 ? 481 LEU A CD2 1
|
|
ATOM 1941 N N . ARG A 1 280 ? -9.770 26.166 2.659 1.00 57.34 ? 482 ARG A N 1
|
|
ATOM 1942 C CA . ARG A 1 280 ? -8.527 25.766 1.962 1.00 59.90 ? 482 ARG A CA 1
|
|
ATOM 1943 C C . ARG A 1 280 ? -8.572 24.317 1.527 1.00 65.49 ? 482 ARG A C 1
|
|
ATOM 1944 O O . ARG A 1 280 ? -7.722 23.905 0.743 1.00 69.78 ? 482 ARG A O 1
|
|
ATOM 1945 C CB . ARG A 1 280 ? -7.273 25.961 2.828 1.00 59.48 ? 482 ARG A CB 1
|
|
ATOM 1946 C CG . ARG A 1 280 ? -6.792 27.373 2.896 1.00 67.52 ? 482 ARG A CG 1
|
|
ATOM 1947 C CD . ARG A 1 280 ? -5.449 27.434 3.582 1.00 84.08 ? 482 ARG A CD 1
|
|
ATOM 1948 N NE . ARG A 1 280 ? -5.502 27.961 4.952 1.00 100.39 ? 482 ARG A NE 1
|
|
ATOM 1949 C CZ . ARG A 1 280 ? -5.753 29.231 5.281 1.00 117.65 ? 482 ARG A CZ 1
|
|
ATOM 1950 N NH1 . ARG A 1 280 ? -6.072 30.122 4.344 1.00 104.95 ? 482 ARG A NH1 1
|
|
ATOM 1951 N NH2 . ARG A 1 280 ? -5.727 29.610 6.551 1.00 102.90 ? 482 ARG A NH2 1
|
|
ATOM 1952 N N . HIS A 1 281 ? -9.523 23.535 2.052 1.00 59.15 ? 483 HIS A N 1
|
|
ATOM 1953 C CA . HIS A 1 281 ? -9.673 22.127 1.706 1.00 60.61 ? 483 HIS A CA 1
|
|
ATOM 1954 C C . HIS A 1 281 ? -9.868 21.909 0.201 1.00 68.01 ? 483 HIS A C 1
|
|
ATOM 1955 O O . HIS A 1 281 ? -10.603 22.677 -0.431 1.00 68.28 ? 483 HIS A O 1
|
|
ATOM 1956 C CB . HIS A 1 281 ? -10.839 21.504 2.492 1.00 59.77 ? 483 HIS A CB 1
|
|
ATOM 1957 C CG . HIS A 1 281 ? -10.884 20.012 2.417 1.00 64.33 ? 483 HIS A CG 1
|
|
ATOM 1958 N ND1 . HIS A 1 281 ? -11.505 19.366 1.368 1.00 67.34 ? 483 HIS A ND1 1
|
|
ATOM 1959 C CD2 . HIS A 1 281 ? -10.342 19.090 3.246 1.00 65.78 ? 483 HIS A CD2 1
|
|
ATOM 1960 C CE1 . HIS A 1 281 ? -11.332 18.073 1.597 1.00 67.75 ? 483 HIS A CE1 1
|
|
ATOM 1961 N NE2 . HIS A 1 281 ? -10.642 17.861 2.719 1.00 67.24 ? 483 HIS A NE2 1
|
|
ATOM 1962 N N . PRO A 1 282 ? -9.239 20.856 -0.383 1.00 66.89 ? 484 PRO A N 1
|
|
ATOM 1963 C CA . PRO A 1 282 ? -9.424 20.577 -1.819 1.00 68.50 ? 484 PRO A CA 1
|
|
ATOM 1964 C C . PRO A 1 282 ? -10.870 20.529 -2.323 1.00 73.04 ? 484 PRO A C 1
|
|
ATOM 1965 O O . PRO A 1 282 ? -11.089 20.778 -3.504 1.00 75.44 ? 484 PRO A O 1
|
|
ATOM 1966 C CB . PRO A 1 282 ? -8.767 19.205 -1.985 1.00 71.66 ? 484 PRO A CB 1
|
|
ATOM 1967 C CG . PRO A 1 282 ? -7.741 19.160 -0.959 1.00 75.05 ? 484 PRO A CG 1
|
|
ATOM 1968 C CD . PRO A 1 282 ? -8.317 19.868 0.222 1.00 68.52 ? 484 PRO A CD 1
|
|
ATOM 1969 N N . TRP A 1 283 ? -11.848 20.212 -1.451 1.00 67.96 ? 485 TRP A N 1
|
|
ATOM 1970 C CA . TRP A 1 283 ? -13.252 20.124 -1.863 1.00 67.36 ? 485 TRP A CA 1
|
|
ATOM 1971 C C . TRP A 1 283 ? -13.812 21.469 -2.264 1.00 69.02 ? 485 TRP A C 1
|
|
ATOM 1972 O O . TRP A 1 283 ? -14.603 21.558 -3.192 1.00 69.81 ? 485 TRP A O 1
|
|
ATOM 1973 C CB . TRP A 1 283 ? -14.123 19.468 -0.781 1.00 64.18 ? 485 TRP A CB 1
|
|
ATOM 1974 C CG . TRP A 1 283 ? -15.508 19.089 -1.247 1.00 64.86 ? 485 TRP A CG 1
|
|
ATOM 1975 C CD1 . TRP A 1 283 ? -15.834 18.214 -2.247 1.00 70.01 ? 485 TRP A CD1 1
|
|
ATOM 1976 C CD2 . TRP A 1 283 ? -16.750 19.524 -0.670 1.00 62.18 ? 485 TRP A CD2 1
|
|
ATOM 1977 N NE1 . TRP A 1 283 ? -17.200 18.119 -2.366 1.00 68.68 ? 485 TRP A NE1 1
|
|
ATOM 1978 C CE2 . TRP A 1 283 ? -17.791 18.915 -1.412 1.00 67.11 ? 485 TRP A CE2 1
|
|
ATOM 1979 C CE3 . TRP A 1 283 ? -17.085 20.422 0.372 1.00 60.36 ? 485 TRP A CE3 1
|
|
ATOM 1980 C CZ2 . TRP A 1 283 ? -19.147 19.148 -1.132 1.00 64.46 ? 485 TRP A CZ2 1
|
|
ATOM 1981 C CZ3 . TRP A 1 283 ? -18.421 20.664 0.639 1.00 60.38 ? 485 TRP A CZ3 1
|
|
ATOM 1982 C CH2 . TRP A 1 283 ? -19.436 20.017 -0.098 1.00 62.44 ? 485 TRP A CH2 1
|
|
ATOM 1983 N N . LEU A 1 284 ? -13.370 22.516 -1.592 1.00 63.14 ? 486 LEU A N 1
|
|
ATOM 1984 C CA . LEU A 1 284 ? -13.811 23.881 -1.874 1.00 61.09 ? 486 LEU A CA 1
|
|
ATOM 1985 C C . LEU A 1 284 ? -12.951 24.598 -2.944 1.00 63.37 ? 486 LEU A C 1
|
|
ATOM 1986 O O . LEU A 1 284 ? -13.284 25.708 -3.361 1.00 60.78 ? 486 LEU A O 1
|
|
ATOM 1987 C CB . LEU A 1 284 ? -13.929 24.671 -0.553 1.00 57.83 ? 486 LEU A CB 1
|
|
ATOM 1988 C CG . LEU A 1 284 ? -15.018 24.123 0.319 1.00 58.72 ? 486 LEU A CG 1
|
|
ATOM 1989 C CD1 . LEU A 1 284 ? -14.558 23.937 1.664 1.00 56.78 ? 486 LEU A CD1 1
|
|
ATOM 1990 C CD2 . LEU A 1 284 ? -16.275 24.901 0.198 1.00 58.03 ? 486 LEU A CD2 1
|
|
ATOM 1991 N N . GLN A 1 285 ? -11.881 23.937 -3.417 1.00 62.60 ? 487 GLN A N 1
|
|
ATOM 1992 C CA . GLN A 1 285 ? -11.017 24.479 -4.476 1.00 65.85 ? 487 GLN A CA 1
|
|
ATOM 1993 C C . GLN A 1 285 ? -11.685 24.183 -5.822 1.00 71.89 ? 487 GLN A C 1
|
|
ATOM 1994 O O . GLN A 1 285 ? -11.180 23.398 -6.604 1.00 72.79 ? 487 GLN A O 1
|
|
ATOM 1995 C CB . GLN A 1 285 ? -9.565 23.931 -4.383 1.00 68.72 ? 487 GLN A CB 1
|
|
ATOM 1996 C CG . GLN A 1 285 ? -8.840 24.213 -3.048 1.00 75.07 ? 487 GLN A CG 1
|
|
ATOM 1997 C CD . GLN A 1 285 ? -9.141 25.574 -2.461 1.00 85.59 ? 487 GLN A CD 1
|
|
ATOM 1998 O OE1 . GLN A 1 285 ? -8.817 26.617 -3.040 1.00 75.83 ? 487 GLN A OE1 1
|
|
ATOM 1999 N NE2 . GLN A 1 285 ? -9.818 25.585 -1.315 1.00 79.32 ? 487 GLN A NE2 1
|
|
ATOM 2000 N N . ASP A 1 286 ? -12.876 24.790 -6.034 1.00 70.45 ? 488 ASP A N 1
|
|
ATOM 2001 C CA . ASP A 1 286 ? -13.791 24.611 -7.166 1.00 72.95 ? 488 ASP A CA 1
|
|
ATOM 2002 C C . ASP A 1 286 ? -14.119 25.970 -7.771 1.00 78.78 ? 488 ASP A C 1
|
|
ATOM 2003 O O . ASP A 1 286 ? -14.977 26.696 -7.261 1.00 74.61 ? 488 ASP A O 1
|
|
ATOM 2004 C CB . ASP A 1 286 ? -15.073 23.892 -6.671 1.00 73.09 ? 488 ASP A CB 1
|
|
ATOM 2005 C CG . ASP A 1 286 ? -16.068 23.471 -7.739 1.00 82.08 ? 488 ASP A CG 1
|
|
ATOM 2006 O OD1 . ASP A 1 286 ? -16.315 24.272 -8.669 1.00 85.99 ? 488 ASP A OD1 1
|
|
ATOM 2007 O OD2 . ASP A 1 286 ? -16.680 22.379 -7.589 1.00 79.38 ? 488 ASP A OD2 1
|
|
ATOM 2008 N N . GLU A 1 287 ? -13.432 26.299 -8.879 1.00 81.80 ? 489 GLU A N 1
|
|
ATOM 2009 C CA . GLU A 1 287 ? -13.592 27.574 -9.569 1.00 83.28 ? 489 GLU A CA 1
|
|
ATOM 2010 C C . GLU A 1 287 ? -14.954 27.830 -10.184 1.00 87.18 ? 489 GLU A C 1
|
|
ATOM 2011 O O . GLU A 1 287 ? -15.388 28.989 -10.232 1.00 86.20 ? 489 GLU A O 1
|
|
ATOM 2012 C CB . GLU A 1 287 ? -12.413 27.885 -10.490 1.00 88.50 ? 489 GLU A CB 1
|
|
ATOM 2013 C CG . GLU A 1 287 ? -11.213 28.449 -9.727 1.00 101.22 ? 489 GLU A CG 1
|
|
ATOM 2014 C CD . GLU A 1 287 ? -11.480 29.564 -8.721 1.00 118.83 ? 489 GLU A CD 1
|
|
ATOM 2015 O OE1 . GLU A 1 287 ? -12.191 30.536 -9.072 1.00 101.79 ? 489 GLU A OE1 1
|
|
ATOM 2016 O OE2 . GLU A 1 287 ? -10.984 29.457 -7.575 1.00 112.28 ? 489 GLU A OE2 1
|
|
ATOM 2017 N N . ASP A 1 288 ? -15.653 26.739 -10.577 1.00 83.54 ? 490 ASP A N 1
|
|
ATOM 2018 C CA . ASP A 1 288 ? -17.014 26.747 -11.111 1.00 82.79 ? 490 ASP A CA 1
|
|
ATOM 2019 C C . ASP A 1 288 ? -18.006 27.181 -10.019 1.00 81.84 ? 490 ASP A C 1
|
|
ATOM 2020 O O . ASP A 1 288 ? -18.777 28.125 -10.230 1.00 81.28 ? 490 ASP A O 1
|
|
ATOM 2021 C CB . ASP A 1 288 ? -17.387 25.345 -11.622 1.00 85.86 ? 490 ASP A CB 1
|
|
ATOM 2022 C CG . ASP A 1 288 ? -17.077 25.080 -13.081 1.00 95.59 ? 490 ASP A CG 1
|
|
ATOM 2023 O OD1 . ASP A 1 288 ? -16.138 25.718 -13.617 1.00 98.72 ? 490 ASP A OD1 1
|
|
ATOM 2024 O OD2 . ASP A 1 288 ? -17.748 24.206 -13.679 1.00 96.91 ? 490 ASP A OD2 1
|
|
ATOM 2025 N N . MET A 1 289 ? -17.967 26.496 -8.844 1.00 73.56 ? 491 MET A N 1
|
|
ATOM 2026 C CA . MET A 1 289 ? -18.838 26.767 -7.706 1.00 68.15 ? 491 MET A CA 1
|
|
ATOM 2027 C C . MET A 1 289 ? -18.659 28.220 -7.261 1.00 72.25 ? 491 MET A C 1
|
|
ATOM 2028 O O . MET A 1 289 ? -19.654 28.917 -7.068 1.00 71.88 ? 491 MET A O 1
|
|
ATOM 2029 C CB . MET A 1 289 ? -18.589 25.741 -6.581 1.00 67.51 ? 491 MET A CB 1
|
|
ATOM 2030 C CG . MET A 1 289 ? -19.287 26.052 -5.233 1.00 66.03 ? 491 MET A CG 1
|
|
ATOM 2031 S SD . MET A 1 289 ? -18.522 27.392 -4.269 1.00 66.45 ? 491 MET A SD 1
|
|
ATOM 2032 C CE . MET A 1 289 ? -16.945 26.626 -3.775 1.00 62.76 ? 491 MET A CE 1
|
|
ATOM 2033 N N . LYS A 1 290 ? -17.395 28.681 -7.141 1.00 69.34 ? 492 LYS A N 1
|
|
ATOM 2034 C CA . LYS A 1 290 ? -17.047 30.056 -6.761 1.00 67.80 ? 492 LYS A CA 1
|
|
ATOM 2035 C C . LYS A 1 290 ? -17.629 31.086 -7.730 1.00 74.34 ? 492 LYS A C 1
|
|
ATOM 2036 O O . LYS A 1 290 ? -18.215 32.068 -7.272 1.00 73.00 ? 492 LYS A O 1
|
|
ATOM 2037 C CB . LYS A 1 290 ? -15.531 30.222 -6.562 1.00 69.34 ? 492 LYS A CB 1
|
|
ATOM 2038 C CG . LYS A 1 290 ? -15.064 29.667 -5.219 1.00 72.63 ? 492 LYS A CG 1
|
|
ATOM 2039 C CD . LYS A 1 290 ? -13.558 29.506 -5.178 1.00 89.83 ? 492 LYS A CD 1
|
|
ATOM 2040 C CE . LYS A 1 290 ? -13.027 29.010 -3.847 1.00 94.78 ? 492 LYS A CE 1
|
|
ATOM 2041 N NZ . LYS A 1 290 ? -11.567 28.703 -3.918 1.00 97.55 ? 492 LYS A NZ 1
|
|
ATOM 2042 N N . ARG A 1 291 ? -17.556 30.808 -9.058 1.00 74.73 ? 493 ARG A N 1
|
|
ATOM 2043 C CA . ARG A 1 291 ? -18.097 31.651 -10.133 1.00 76.72 ? 493 ARG A CA 1
|
|
ATOM 2044 C C . ARG A 1 291 ? -19.607 31.835 -9.957 1.00 79.57 ? 493 ARG A C 1
|
|
ATOM 2045 O O . ARG A 1 291 ? -20.062 32.973 -9.868 1.00 78.35 ? 493 ARG A O 1
|
|
ATOM 2046 C CB . ARG A 1 291 ? -17.778 31.048 -11.505 1.00 80.97 ? 493 ARG A CB 1
|
|
ATOM 2047 C CG . ARG A 1 291 ? -17.410 32.082 -12.562 1.00 95.72 ? 493 ARG A CG 1
|
|
ATOM 2048 C CD . ARG A 1 291 ? -17.013 31.455 -13.895 1.00 108.51 ? 493 ARG A CD 1
|
|
ATOM 2049 N NE . ARG A 1 291 ? -15.759 30.686 -13.851 1.00 113.58 ? 493 ARG A NE 1
|
|
ATOM 2050 C CZ . ARG A 1 291 ? -15.686 29.355 -13.887 1.00 125.55 ? 493 ARG A CZ 1
|
|
ATOM 2051 N NH1 . ARG A 1 291 ? -16.792 28.621 -13.957 1.00 113.47 ? 493 ARG A NH1 1
|
|
ATOM 2052 N NH2 . ARG A 1 291 ? -14.506 28.748 -13.849 1.00 107.74 ? 493 ARG A NH2 1
|
|
ATOM 2053 N N . LYS A 1 292 ? -20.366 30.716 -9.811 1.00 76.56 ? 494 LYS A N 1
|
|
ATOM 2054 C CA . LYS A 1 292 ? -21.821 30.695 -9.590 1.00 75.55 ? 494 LYS A CA 1
|
|
ATOM 2055 C C . LYS A 1 292 ? -22.236 31.549 -8.388 1.00 79.76 ? 494 LYS A C 1
|
|
ATOM 2056 O O . LYS A 1 292 ? -23.242 32.246 -8.484 1.00 81.69 ? 494 LYS A O 1
|
|
ATOM 2057 C CB . LYS A 1 292 ? -22.335 29.258 -9.410 1.00 76.98 ? 494 LYS A CB 1
|
|
ATOM 2058 C CG . LYS A 1 292 ? -23.834 29.098 -9.659 1.00 86.80 ? 494 LYS A CG 1
|
|
ATOM 2059 N N . PHE A 1 293 ? -21.464 31.519 -7.285 1.00 73.01 ? 495 PHE A N 1
|
|
ATOM 2060 C CA . PHE A 1 293 ? -21.756 32.317 -6.097 1.00 70.87 ? 495 PHE A CA 1
|
|
ATOM 2061 C C . PHE A 1 293 ? -21.588 33.824 -6.387 1.00 75.61 ? 495 PHE A C 1
|
|
ATOM 2062 O O . PHE A 1 293 ? -22.458 34.625 -6.025 1.00 73.20 ? 495 PHE A O 1
|
|
ATOM 2063 C CB . PHE A 1 293 ? -20.872 31.858 -4.919 1.00 71.11 ? 495 PHE A CB 1
|
|
ATOM 2064 C CG . PHE A 1 293 ? -20.731 32.843 -3.785 1.00 70.62 ? 495 PHE A CG 1
|
|
ATOM 2065 C CD1 . PHE A 1 293 ? -21.764 33.031 -2.875 1.00 71.71 ? 495 PHE A CD1 1
|
|
ATOM 2066 C CD2 . PHE A 1 293 ? -19.565 33.584 -3.629 1.00 73.31 ? 495 PHE A CD2 1
|
|
ATOM 2067 C CE1 . PHE A 1 293 ? -21.633 33.943 -1.821 1.00 71.21 ? 495 PHE A CE1 1
|
|
ATOM 2068 C CE2 . PHE A 1 293 ? -19.441 34.508 -2.591 1.00 74.83 ? 495 PHE A CE2 1
|
|
ATOM 2069 C CZ . PHE A 1 293 ? -20.474 34.677 -1.689 1.00 71.17 ? 495 PHE A CZ 1
|
|
ATOM 2070 N N . GLN A 1 294 ? -20.469 34.194 -7.062 1.00 74.11 ? 496 GLN A N 1
|
|
ATOM 2071 C CA . GLN A 1 294 ? -20.144 35.565 -7.459 1.00 74.39 ? 496 GLN A CA 1
|
|
ATOM 2072 C C . GLN A 1 294 ? -21.210 36.123 -8.374 1.00 79.97 ? 496 GLN A C 1
|
|
ATOM 2073 O O . GLN A 1 294 ? -21.492 37.322 -8.322 1.00 80.46 ? 496 GLN A O 1
|
|
ATOM 2074 C CB . GLN A 1 294 ? -18.785 35.619 -8.164 1.00 77.87 ? 496 GLN A CB 1
|
|
ATOM 2075 C CG . GLN A 1 294 ? -17.596 35.565 -7.221 1.00 87.53 ? 496 GLN A CG 1
|
|
ATOM 2076 C CD . GLN A 1 294 ? -17.594 36.674 -6.191 1.00 102.03 ? 496 GLN A CD 1
|
|
ATOM 2077 O OE1 . GLN A 1 294 ? -17.849 37.845 -6.493 1.00 103.59 ? 496 GLN A OE1 1
|
|
ATOM 2078 N NE2 . GLN A 1 294 ? -17.304 36.324 -4.948 1.00 83.59 ? 496 GLN A NE2 1
|
|
ATOM 2079 N N . ASP A 1 295 ? -21.801 35.238 -9.201 1.00 77.50 ? 497 ASP A N 1
|
|
ATOM 2080 C CA . ASP A 1 295 ? -22.858 35.529 -10.160 1.00 79.80 ? 497 ASP A CA 1
|
|
ATOM 2081 C C . ASP A 1 295 ? -24.184 35.805 -9.461 1.00 84.03 ? 497 ASP A C 1
|
|
ATOM 2082 O O . ASP A 1 295 ? -24.894 36.736 -9.852 1.00 85.78 ? 497 ASP A O 1
|
|
ATOM 2083 C CB . ASP A 1 295 ? -23.004 34.368 -11.157 1.00 83.35 ? 497 ASP A CB 1
|
|
ATOM 2084 C CG . ASP A 1 295 ? -21.884 34.235 -12.181 1.00 90.99 ? 497 ASP A CG 1
|
|
ATOM 2085 O OD1 . ASP A 1 295 ? -20.960 35.106 -12.186 1.00 90.40 ? 497 ASP A OD1 1
|
|
ATOM 2086 O OD2 . ASP A 1 295 ? -21.914 33.254 -12.966 1.00 96.04 ? 497 ASP A OD2 1
|
|
ATOM 2087 N N . LEU A 1 296 ? -24.514 35.004 -8.426 1.00 78.13 ? 498 LEU A N 1
|
|
ATOM 2088 C CA . LEU A 1 296 ? -25.734 35.153 -7.618 1.00 75.48 ? 498 LEU A CA 1
|
|
ATOM 2089 C C . LEU A 1 296 ? -25.668 36.451 -6.807 1.00 79.13 ? 498 LEU A C 1
|
|
ATOM 2090 O O . LEU A 1 296 ? -26.697 37.108 -6.592 1.00 78.58 ? 498 LEU A O 1
|
|
ATOM 2091 C CB . LEU A 1 296 ? -25.909 33.958 -6.655 1.00 72.32 ? 498 LEU A CB 1
|
|
ATOM 2092 C CG . LEU A 1 296 ? -26.082 32.580 -7.278 1.00 76.80 ? 498 LEU A CG 1
|
|
ATOM 2093 C CD1 . LEU A 1 296 ? -25.762 31.489 -6.266 1.00 74.37 ? 498 LEU A CD1 1
|
|
ATOM 2094 C CD2 . LEU A 1 296 ? -27.457 32.413 -7.899 1.00 77.80 ? 498 LEU A CD2 1
|
|
ATOM 2095 N N . LEU A 1 297 ? -24.444 36.798 -6.362 1.00 75.12 ? 499 LEU A N 1
|
|
ATOM 2096 C CA . LEU A 1 297 ? -24.121 37.977 -5.585 1.00 74.56 ? 499 LEU A CA 1
|
|
ATOM 2097 C C . LEU A 1 297 ? -24.404 39.230 -6.400 1.00 84.32 ? 499 LEU A C 1
|
|
ATOM 2098 O O . LEU A 1 297 ? -25.205 40.060 -5.969 1.00 84.14 ? 499 LEU A O 1
|
|
ATOM 2099 C CB . LEU A 1 297 ? -22.637 37.933 -5.195 1.00 74.47 ? 499 LEU A CB 1
|
|
ATOM 2100 C CG . LEU A 1 297 ? -22.295 37.798 -3.729 1.00 76.50 ? 499 LEU A CG 1
|
|
ATOM 2101 C CD1 . LEU A 1 297 ? -20.792 37.911 -3.532 1.00 76.79 ? 499 LEU A CD1 1
|
|
ATOM 2102 C CD2 . LEU A 1 297 ? -23.012 38.853 -2.888 1.00 78.83 ? 499 LEU A CD2 1
|
|
ATOM 2103 N N . SER A 1 298 ? -23.774 39.358 -7.589 1.00 85.39 ? 500 SER A N 1
|
|
ATOM 2104 C CA . SER A 1 298 ? -23.966 40.513 -8.470 1.00 89.06 ? 500 SER A CA 1
|
|
ATOM 2105 C C . SER A 1 298 ? -25.400 40.641 -8.974 1.00 94.99 ? 500 SER A C 1
|
|
ATOM 2106 O O . SER A 1 298 ? -25.842 41.759 -9.241 1.00 96.52 ? 500 SER A O 1
|
|
ATOM 2107 C CB . SER A 1 298 ? -22.954 40.532 -9.614 1.00 96.51 ? 500 SER A CB 1
|
|
ATOM 2108 O OG . SER A 1 298 ? -22.800 39.262 -10.225 1.00 108.87 ? 500 SER A OG 1
|
|
ATOM 2109 N N . GLU A 1 299 ? -26.135 39.508 -9.060 1.00 91.33 ? 501 GLU A N 1
|
|
ATOM 2110 C CA . GLU A 1 299 ? -27.546 39.467 -9.440 1.00 92.09 ? 501 GLU A CA 1
|
|
ATOM 2111 C C . GLU A 1 299 ? -28.366 40.155 -8.330 1.00 96.67 ? 501 GLU A C 1
|
|
ATOM 2112 O O . GLU A 1 299 ? -29.203 41.002 -8.647 1.00 98.14 ? 501 GLU A O 1
|
|
ATOM 2113 C CB . GLU A 1 299 ? -28.013 38.020 -9.665 1.00 92.81 ? 501 GLU A CB 1
|
|
ATOM 2114 N N . GLU A 1 300 ? -28.077 39.832 -7.034 1.00 91.56 ? 502 GLU A N 1
|
|
ATOM 2115 C CA . GLU A 1 300 ? -28.705 40.422 -5.837 1.00 89.94 ? 502 GLU A CA 1
|
|
ATOM 2116 C C . GLU A 1 300 ? -28.324 41.917 -5.751 1.00 97.43 ? 502 GLU A C 1
|
|
ATOM 2117 O O . GLU A 1 300 ? -29.196 42.776 -5.577 1.00 97.85 ? 502 GLU A O 1
|
|
ATOM 2118 C CB . GLU A 1 300 ? -28.243 39.675 -4.553 1.00 88.19 ? 502 GLU A CB 1
|
|
ATOM 2119 C CG . GLU A 1 300 ? -28.660 40.326 -3.232 1.00 99.11 ? 502 GLU A CG 1
|
|
ATOM 2120 C CD . GLU A 1 300 ? -27.790 40.088 -1.999 1.00 123.13 ? 502 GLU A CD 1
|
|
ATOM 2121 O OE1 . GLU A 1 300 ? -26.563 40.330 -2.079 1.00 128.54 ? 502 GLU A OE1 1
|
|
ATOM 2122 O OE2 . GLU A 1 300 ? -28.345 39.737 -0.929 1.00 93.61 ? 502 GLU A OE2 1
|
|
ATOM 2123 N N . ASN A 1 301 ? -27.015 42.207 -5.900 1.00 95.38 ? 503 ASN A N 1
|
|
ATOM 2124 C CA . ASN A 1 301 ? -26.429 43.540 -5.807 1.00 96.53 ? 503 ASN A CA 1
|
|
ATOM 2125 C C . ASN A 1 301 ? -26.756 44.505 -6.957 1.00 103.92 ? 503 ASN A C 1
|
|
ATOM 2126 O O . ASN A 1 301 ? -26.565 45.710 -6.783 1.00 104.69 ? 503 ASN A O 1
|
|
ATOM 2127 C CB . ASN A 1 301 ? -24.921 43.450 -5.530 1.00 97.27 ? 503 ASN A CB 1
|
|
ATOM 2128 C CG . ASN A 1 301 ? -24.562 42.825 -4.195 1.00 117.39 ? 503 ASN A CG 1
|
|
ATOM 2129 O OD1 . ASN A 1 301 ? -25.237 43.015 -3.175 1.00 106.01 ? 503 ASN A OD1 1
|
|
ATOM 2130 N ND2 . ASN A 1 301 ? -23.456 42.101 -4.157 1.00 113.13 ? 503 ASN A ND2 1
|
|
ATOM 2131 N N . GLU A 1 302 ? -27.273 43.993 -8.108 1.00 102.43 ? 504 GLU A N 1
|
|
ATOM 2132 C CA . GLU A 1 302 ? -27.668 44.782 -9.292 1.00 105.82 ? 504 GLU A CA 1
|
|
ATOM 2133 C C . GLU A 1 302 ? -28.698 45.876 -8.954 1.00 110.60 ? 504 GLU A C 1
|
|
ATOM 2134 O O . GLU A 1 302 ? -28.684 46.942 -9.569 1.00 112.93 ? 504 GLU A O 1
|
|
ATOM 2135 C CB . GLU A 1 302 ? -28.205 43.874 -10.412 1.00 108.68 ? 504 GLU A CB 1
|
|
ATOM 2136 N N . SER A 1 303 ? -29.563 45.608 -7.956 1.00 104.97 ? 505 SER A N 1
|
|
ATOM 2137 C CA . SER A 1 303 ? -30.599 46.508 -7.439 1.00 104.21 ? 505 SER A CA 1
|
|
ATOM 2138 C C . SER A 1 303 ? -29.991 47.702 -6.656 1.00 105.92 ? 505 SER A C 1
|
|
ATOM 2139 O O . SER A 1 303 ? -30.326 48.855 -6.948 1.00 107.54 ? 505 SER A O 1
|
|
ATOM 2140 C CB . SER A 1 303 ? -31.570 45.726 -6.552 1.00 105.13 ? 505 SER A CB 1
|
|
ATOM 2141 N N . THR A 1 304 ? -29.100 47.408 -5.670 1.00 98.25 ? 506 THR A N 1
|
|
ATOM 2142 C CA . THR A 1 304 ? -28.408 48.373 -4.804 1.00 96.65 ? 506 THR A CA 1
|
|
ATOM 2143 C C . THR A 1 304 ? -27.415 49.280 -5.555 1.00 101.38 ? 506 THR A C 1
|
|
ATOM 2144 O O . THR A 1 304 ? -27.093 50.364 -5.062 1.00 102.23 ? 506 THR A O 1
|
|
ATOM 2145 C CB . THR A 1 304 ? -27.680 47.620 -3.681 1.00 99.15 ? 506 THR A CB 1
|
|
ATOM 2146 N N . ALA A 1 305 ? -26.936 48.824 -6.733 1.00 97.36 ? 507 ALA A N 1
|
|
ATOM 2147 C CA . ALA A 1 305 ? -25.939 49.448 -7.608 1.00 99.31 ? 507 ALA A CA 1
|
|
ATOM 2148 C C . ALA A 1 305 ? -26.054 50.950 -7.893 1.00 103.75 ? 507 ALA A C 1
|
|
ATOM 2149 O O . ALA A 1 305 ? -26.945 51.393 -8.622 1.00 105.44 ? 507 ALA A O 1
|
|
ATOM 2150 C CB . ALA A 1 305 ? -25.816 48.664 -8.906 1.00 102.11 ? 507 ALA A CB 1
|
|
ATOM 2151 N N . LEU A 1 306 ? -25.113 51.721 -7.326 1.00 99.04 ? 508 LEU A N 1
|
|
ATOM 2152 C CA . LEU A 1 306 ? -24.973 53.172 -7.517 1.00 101.10 ? 508 LEU A CA 1
|
|
ATOM 2153 C C . LEU A 1 306 ? -23.884 53.397 -8.588 1.00 105.30 ? 508 LEU A C 1
|
|
ATOM 2154 O O . LEU A 1 306 ? -22.966 52.572 -8.666 1.00 103.95 ? 508 LEU A O 1
|
|
ATOM 2155 C CB . LEU A 1 306 ? -24.638 53.881 -6.185 1.00 109.20 ? 508 LEU A CB 1
|
|
ATOM 2156 C CG . LEU A 1 306 ? -25.829 53.966 -5.240 1.00 104.52 ? 508 LEU A CG 1
|
|
ATOM 2157 N N . PRO A 1 307 ? -23.969 54.458 -9.438 1.00 104.27 ? 509 PRO A N 1
|
|
ATOM 2158 C CA . PRO A 1 307 ? -22.947 54.654 -10.490 1.00 107.10 ? 509 PRO A CA 1
|
|
ATOM 2159 C C . PRO A 1 307 ? -21.521 54.770 -9.984 1.00 109.55 ? 509 PRO A C 1
|
|
ATOM 2160 O O . PRO A 1 307 ? -21.278 55.284 -8.889 1.00 107.14 ? 509 PRO A O 1
|
|
ATOM 2161 C CB . PRO A 1 307 ? -23.409 55.907 -11.226 1.00 113.13 ? 509 PRO A CB 1
|
|
ATOM 2162 C CG . PRO A 1 307 ? -24.333 56.574 -10.297 1.00 116.23 ? 509 PRO A CG 1
|
|
ATOM 2163 C CD . PRO A 1 307 ? -25.004 55.508 -9.513 1.00 107.28 ? 509 PRO A CD 1
|
|
ATOM 2164 N N . GLN A 1 308 ? -20.588 54.214 -10.760 1.00 106.91 ? 510 GLN A N 1
|
|
ATOM 2165 C CA . GLN A 1 308 ? -19.184 54.173 -10.383 1.00 106.33 ? 510 GLN A CA 1
|
|
ATOM 2166 C C . GLN A 1 308 ? -18.410 55.389 -10.828 1.00 112.98 ? 510 GLN A C 1
|
|
ATOM 2167 O O . GLN A 1 308 ? -18.779 56.029 -11.810 1.00 115.90 ? 510 GLN A O 1
|
|
ATOM 2168 C CB . GLN A 1 308 ? -18.518 52.861 -10.830 1.00 106.85 ? 510 GLN A CB 1
|
|
ATOM 2169 C CG . GLN A 1 308 ? -18.864 51.660 -9.941 1.00 112.99 ? 510 GLN A CG 1
|
|
ATOM 2170 C CD . GLN A 1 308 ? -18.340 51.767 -8.523 1.00 119.67 ? 510 GLN A CD 1
|
|
ATOM 2171 O OE1 . GLN A 1 308 ? -17.309 52.402 -8.247 1.00 113.55 ? 510 GLN A OE1 1
|
|
ATOM 2172 N NE2 . GLN A 1 308 ? -19.044 51.132 -7.594 1.00 104.70 ? 510 GLN A NE2 1
|
|
ATOM 2173 N N . VAL A 1 309 ? -17.331 55.698 -10.096 1.00 108.79 ? 511 VAL A N 1
|
|
ATOM 2174 C CA . VAL A 1 309 ? -16.478 56.859 -10.318 1.00 112.90 ? 511 VAL A CA 1
|
|
ATOM 2175 C C . VAL A 1 309 ? -15.612 56.742 -11.578 1.00 122.49 ? 511 VAL A C 1
|
|
ATOM 2176 O O . VAL A 1 309 ? -15.652 57.653 -12.419 1.00 127.31 ? 511 VAL A O 1
|
|
ATOM 2177 C CB . VAL A 1 309 ? -15.668 57.229 -9.055 1.00 114.71 ? 511 VAL A CB 1
|
|
ATOM 2178 C CG1 . VAL A 1 309 ? -15.410 58.729 -8.997 1.00 117.72 ? 511 VAL A CG1 1
|
|
ATOM 2179 C CG2 . VAL A 1 309 ? -16.387 56.756 -7.789 1.00 109.57 ? 511 VAL A CG2 1
|
|
ATOM 2180 N N . LEU A 1 310 ? -14.849 55.625 -11.716 1.00 117.36 ? 512 LEU A N 1
|
|
ATOM 2181 C CA . LEU A 1 310 ? -13.950 55.333 -12.848 1.00 146.03 ? 512 LEU A CA 1
|
|
ATOM 2182 C C . LEU A 1 310 ? -12.911 56.430 -13.094 1.00 164.05 ? 512 LEU A C 1
|
|
ATOM 2183 O O . LEU A 1 310 ? -11.844 56.162 -13.641 1.00 131.12 ? 512 LEU A O 1
|
|
ATOM 2184 C CB . LEU A 1 310 ? -14.734 55.034 -14.136 1.00 148.34 ? 512 LEU A CB 1
|
|
HETATM 2185 C C1 . H3R B 2 . ? -36.572 34.999 7.740 1.00 79.83 ? 1513 H3R A C1 1
|
|
HETATM 2186 C C2 . H3R B 2 . ? -35.850 35.671 8.863 1.00 78.20 ? 1513 H3R A C2 1
|
|
HETATM 2187 C C3 . H3R B 2 . ? -37.411 33.914 7.721 1.00 81.36 ? 1513 H3R A C3 1
|
|
HETATM 2188 C C7 . H3R B 2 . ? -39.219 32.808 4.570 1.00 86.46 ? 1513 H3R A C7 1
|
|
HETATM 2189 C C8 . H3R B 2 . ? -38.694 31.398 6.441 1.00 83.15 ? 1513 H3R A C8 1
|
|
HETATM 2190 C C9 . H3R B 2 . ? -40.010 31.801 4.038 1.00 85.61 ? 1513 H3R A C9 1
|
|
HETATM 2191 C C10 . H3R B 2 . ? -39.493 30.399 5.907 1.00 83.63 ? 1513 H3R A C10 1
|
|
HETATM 2192 C C11 . H3R B 2 . ? -40.154 30.601 4.709 1.00 85.21 ? 1513 H3R A C11 1
|
|
HETATM 2193 C C12 . H3R B 2 . ? -37.737 33.699 6.370 1.00 80.74 ? 1513 H3R A C12 1
|
|
HETATM 2194 N N13 . H3R B 2 . ? -37.145 34.619 5.596 1.00 78.20 ? 1513 H3R A N13 1
|
|
HETATM 2195 C C4 . H3R B 2 . ? -38.552 32.619 5.781 1.00 84.44 ? 1513 H3R A C4 1
|
|
HETATM 2196 N N3 . H3R B 2 . ? -36.437 35.400 6.466 1.00 78.97 ? 1513 H3R A N3 1
|
|
HETATM 2197 N N . NO3 C 3 . ? -12.647 31.763 20.980 1.00 71.37 ? 1514 NO3 A N 1
|
|
HETATM 2198 O O1 . NO3 C 3 . ? -13.096 31.585 22.197 1.00 68.84 ? 1514 NO3 A O1 1
|
|
HETATM 2199 O O2 . NO3 C 3 . ? -12.881 30.915 20.148 1.00 72.11 ? 1514 NO3 A O2 1
|
|
HETATM 2200 O O3 . NO3 C 3 . ? -12.018 32.762 20.750 1.00 72.60 ? 1514 NO3 A O3 1
|
|
HETATM 2201 C C1 . EDO D 4 . ? -39.267 52.291 14.546 1.00 91.36 ? 1515 EDO A C1 1
|
|
HETATM 2202 O O1 . EDO D 4 . ? -38.542 51.504 15.486 1.00 91.59 ? 1515 EDO A O1 1
|
|
HETATM 2203 C C2 . EDO D 4 . ? -38.299 53.068 13.607 1.00 90.42 ? 1515 EDO A C2 1
|
|
HETATM 2204 O O2 . EDO D 4 . ? -39.026 53.679 12.544 1.00 88.40 ? 1515 EDO A O2 1
|
|
HETATM 2205 C C1 . EDO E 4 . ? -6.359 20.031 4.141 1.00 85.43 ? 1516 EDO A C1 1
|
|
HETATM 2206 O O1 . EDO E 4 . ? -6.929 19.013 3.338 1.00 85.07 ? 1516 EDO A O1 1
|
|
HETATM 2207 C C2 . EDO E 4 . ? -6.538 21.432 3.473 1.00 85.31 ? 1516 EDO A C2 1
|
|
HETATM 2208 O O2 . EDO E 4 . ? -6.788 22.468 4.443 1.00 83.46 ? 1516 EDO A O2 1
|
|
HETATM 2209 O O . HOH F 5 . ? -53.993 43.296 14.598 1.00 47.61 ? 2001 HOH A O 1
|
|
HETATM 2210 O O . HOH F 5 . ? -50.049 50.081 20.825 1.00 57.07 ? 2002 HOH A O 1
|
|
HETATM 2211 O O . HOH F 5 . ? -47.029 50.839 19.140 1.00 70.00 ? 2003 HOH A O 1
|
|
HETATM 2212 O O . HOH F 5 . ? -50.265 54.456 13.180 1.00 46.57 ? 2004 HOH A O 1
|
|
HETATM 2213 O O . HOH F 5 . ? -47.049 57.237 8.525 1.00 65.44 ? 2005 HOH A O 1
|
|
HETATM 2214 O O . HOH F 5 . ? -43.248 51.770 5.920 1.00 53.69 ? 2006 HOH A O 1
|
|
HETATM 2215 O O . HOH F 5 . ? -40.560 52.061 6.820 1.00 65.52 ? 2007 HOH A O 1
|
|
HETATM 2216 O O . HOH F 5 . ? -38.122 47.954 6.715 1.00 57.35 ? 2008 HOH A O 1
|
|
HETATM 2217 O O . HOH F 5 . ? -36.575 41.707 2.402 1.00 65.28 ? 2009 HOH A O 1
|
|
HETATM 2218 O O . HOH F 5 . ? -31.944 36.603 14.202 1.00 65.17 ? 2010 HOH A O 1
|
|
HETATM 2219 O O . HOH F 5 . ? -25.938 41.557 9.648 1.00 64.91 ? 2011 HOH A O 1
|
|
HETATM 2220 O O . HOH F 5 . ? -27.969 44.427 9.931 1.00 68.65 ? 2012 HOH A O 1
|
|
HETATM 2221 O O . HOH F 5 . ? -25.836 45.556 8.752 1.00 66.74 ? 2013 HOH A O 1
|
|
HETATM 2222 O O . HOH F 5 . ? -25.239 41.007 6.935 1.00 60.45 ? 2014 HOH A O 1
|
|
HETATM 2223 O O . HOH F 5 . ? -27.328 39.969 4.129 1.00 60.66 ? 2015 HOH A O 1
|
|
HETATM 2224 O O . HOH F 5 . ? -37.755 45.666 1.372 1.00 82.83 ? 2016 HOH A O 1
|
|
HETATM 2225 O O . HOH F 5 . ? -39.147 49.980 20.046 1.00 80.80 ? 2017 HOH A O 1
|
|
HETATM 2226 O O . HOH F 5 . ? -47.613 42.570 20.889 1.00 81.81 ? 2018 HOH A O 1
|
|
HETATM 2227 O O . HOH F 5 . ? -31.347 44.291 3.087 1.00 74.42 ? 2019 HOH A O 1
|
|
HETATM 2228 O O . HOH F 5 . ? -35.523 36.534 -0.996 1.00 59.32 ? 2020 HOH A O 1
|
|
HETATM 2229 O O . HOH F 5 . ? -37.497 25.608 1.969 1.00 74.17 ? 2021 HOH A O 1
|
|
HETATM 2230 O O . HOH F 5 . ? -44.546 54.479 6.633 1.00 52.18 ? 2022 HOH A O 1
|
|
HETATM 2231 O O . HOH F 5 . ? -34.441 43.342 2.072 1.00 76.16 ? 2023 HOH A O 1
|
|
HETATM 2232 O O . HOH F 5 . ? -42.364 50.407 19.537 1.00 71.86 ? 2024 HOH A O 1
|
|
HETATM 2233 O O . HOH F 5 . ? -13.088 29.403 12.496 1.00 60.82 ? 2025 HOH A O 1
|
|
HETATM 2234 O O . HOH F 5 . ? -10.901 36.879 16.535 1.00 70.91 ? 2026 HOH A O 1
|
|
HETATM 2235 O O . HOH F 5 . ? -23.048 26.253 16.250 1.00 51.63 ? 2027 HOH A O 1
|
|
HETATM 2236 O O . HOH F 5 . ? -26.232 23.648 16.772 1.00 69.51 ? 2028 HOH A O 1
|
|
HETATM 2237 O O . HOH F 5 . ? -34.584 29.160 14.298 1.00 68.57 ? 2029 HOH A O 1
|
|
HETATM 2238 O O . HOH F 5 . ? -37.010 31.936 -8.204 1.00 76.86 ? 2030 HOH A O 1
|
|
HETATM 2239 O O . HOH F 5 . ? -31.870 25.571 -10.171 1.00 68.81 ? 2031 HOH A O 1
|
|
HETATM 2240 O O . HOH F 5 . ? -34.886 33.754 11.465 1.00 69.38 ? 2032 HOH A O 1
|
|
HETATM 2241 O O . HOH F 5 . ? -10.635 22.862 31.165 1.00 68.32 ? 2033 HOH A O 1
|
|
HETATM 2242 O O . HOH F 5 . ? -9.052 36.778 39.947 1.00 58.55 ? 2034 HOH A O 1
|
|
HETATM 2243 O O . HOH F 5 . ? -2.773 28.481 44.298 1.00 51.16 ? 2035 HOH A O 1
|
|
HETATM 2244 O O . HOH F 5 . ? -10.086 23.084 34.234 1.00 56.76 ? 2036 HOH A O 1
|
|
HETATM 2245 O O . HOH F 5 . ? -13.844 25.327 40.331 1.00 39.88 ? 2037 HOH A O 1
|
|
HETATM 2246 O O . HOH F 5 . ? -1.635 24.123 26.090 1.00 63.05 ? 2038 HOH A O 1
|
|
HETATM 2247 O O . HOH F 5 . ? -27.573 8.031 12.487 1.00 67.08 ? 2039 HOH A O 1
|
|
HETATM 2248 O O . HOH F 5 . ? -27.751 10.154 24.487 1.00 63.00 ? 2040 HOH A O 1
|
|
HETATM 2249 O O . HOH F 5 . ? -20.163 14.292 30.808 1.00 53.48 ? 2041 HOH A O 1
|
|
HETATM 2250 O O . HOH F 5 . ? -16.737 8.898 24.895 1.00 57.42 ? 2042 HOH A O 1
|
|
HETATM 2251 O O . HOH F 5 . ? -17.204 6.215 12.913 1.00 56.88 ? 2043 HOH A O 1
|
|
HETATM 2252 O O . HOH F 5 . ? -17.790 8.716 0.475 1.00 69.69 ? 2044 HOH A O 1
|
|
HETATM 2253 O O . HOH F 5 . ? -14.922 6.033 7.493 1.00 69.17 ? 2045 HOH A O 1
|
|
HETATM 2254 O O . HOH F 5 . ? -11.767 12.992 16.923 1.00 52.68 ? 2046 HOH A O 1
|
|
HETATM 2255 O O . HOH F 5 . ? -5.851 15.486 18.902 1.00 62.67 ? 2047 HOH A O 1
|
|
HETATM 2256 O O . HOH F 5 . ? -10.020 24.176 16.068 1.00 39.51 ? 2048 HOH A O 1
|
|
HETATM 2257 O O . HOH F 5 . ? -19.360 37.631 -11.283 1.00 71.04 ? 2049 HOH A O 1
|
|
HETATM 2258 O O . HOH F 5 . ? -29.299 50.553 -9.565 1.00 67.66 ? 2050 HOH A O 1
|
|
#
|
|
loop_
|
|
_atom_site_anisotrop.id
|
|
_atom_site_anisotrop.type_symbol
|
|
_atom_site_anisotrop.pdbx_label_atom_id
|
|
_atom_site_anisotrop.pdbx_label_alt_id
|
|
_atom_site_anisotrop.pdbx_label_comp_id
|
|
_atom_site_anisotrop.pdbx_label_asym_id
|
|
_atom_site_anisotrop.pdbx_label_seq_id
|
|
_atom_site_anisotrop.pdbx_PDB_ins_code
|
|
_atom_site_anisotrop.U[1][1]
|
|
_atom_site_anisotrop.U[2][2]
|
|
_atom_site_anisotrop.U[3][3]
|
|
_atom_site_anisotrop.U[1][2]
|
|
_atom_site_anisotrop.U[1][3]
|
|
_atom_site_anisotrop.U[2][3]
|
|
_atom_site_anisotrop.pdbx_auth_seq_id
|
|
_atom_site_anisotrop.pdbx_auth_comp_id
|
|
_atom_site_anisotrop.pdbx_auth_asym_id
|
|
_atom_site_anisotrop.pdbx_auth_atom_id
|
|
6 N N . SER A 8 ? 1.4362 1.4596 1.4094 0.1824 0.3413 0.3046 210 SER A N
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7 C CA . SER A 8 ? 1.4099 1.4556 1.2984 0.2029 0.3005 0.2846 210 SER A CA
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|
8 C C . SER A 8 ? 1.3474 1.3859 1.2276 0.1664 0.2544 0.2321 210 SER A C
|
|
9 O O . SER A 8 ? 1.3384 1.3576 1.2697 0.1293 0.2538 0.2127 210 SER A O
|
|
10 C CB . SER A 8 ? 1.4928 1.5451 1.3432 0.2381 0.3047 0.3067 210 SER A CB
|
|
11 O OG . SER A 8 ? 1.6287 1.7174 1.4068 0.2794 0.2837 0.3037 210 SER A OG
|
|
12 N N . VAL A 9 ? 1.2140 1.2722 1.0368 0.1800 0.2169 0.2086 211 VAL A N
|
|
13 C CA . VAL A 9 ? 1.1342 1.1883 0.9546 0.1507 0.1774 0.1657 211 VAL A CA
|
|
14 C C . VAL A 9 ? 1.1217 1.1756 0.9135 0.1586 0.1493 0.1496 211 VAL A C
|
|
15 O O . VAL A 9 ? 1.1434 1.2103 0.9010 0.1937 0.1508 0.1634 211 VAL A O
|
|
16 C CB . VAL A 9 ? 1.1424 1.2149 0.9519 0.1441 0.1565 0.1429 211 VAL A CB
|
|
17 C CG1 . VAL A 9 ? 1.1324 1.2005 0.9806 0.1248 0.1788 0.1491 211 VAL A CG1
|
|
18 C CG2 . VAL A 9 ? 1.1529 1.2568 0.9137 0.1832 0.1431 0.1431 211 VAL A CG2
|
|
19 N N . TYR A 10 ? 0.9954 1.0388 0.8027 0.1290 0.1242 0.1205 212 TYR A N
|
|
20 C CA . TYR A 10 ? 0.9607 1.0027 0.7527 0.1315 0.0961 0.1021 212 TYR A CA
|
|
21 C C . TYR A 10 ? 0.9797 1.0467 0.7496 0.1483 0.0672 0.0801 212 TYR A C
|
|
22 O O . TYR A 10 ? 0.9587 1.0386 0.7327 0.1434 0.0641 0.0724 212 TYR A O
|
|
23 C CB . TYR A 10 ? 0.9342 0.9605 0.7568 0.0976 0.0846 0.0842 212 TYR A CB
|
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24 C CG . TYR A 10 ? 0.9640 0.9695 0.8158 0.0813 0.1062 0.0954 212 TYR A CG
|
|
25 C CD1 . TYR A 10 ? 1.0120 1.0042 0.8569 0.0932 0.1158 0.1109 212 TYR A CD1
|
|
26 C CD2 . TYR A 10 ? 0.9625 0.9650 0.8541 0.0555 0.1156 0.0867 212 TYR A CD2
|
|
27 C CE1 . TYR A 10 ? 1.0302 1.0037 0.9113 0.0782 0.1364 0.1197 212 TYR A CE1
|
|
28 C CE2 . TYR A 10 ? 0.9815 0.9691 0.9120 0.0417 0.1336 0.0899 212 TYR A CE2
|
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29 C CZ . TYR A 10 ? 1.1133 1.0851 1.0406 0.0519 0.1441 0.1068 212 TYR A CZ
|
|
30 O OH . TYR A 10 ? 1.1542 1.1121 1.1287 0.0375 0.1612 0.1072 212 TYR A OH
|
|
31 N N . PRO A 11 ? 0.9199 0.9952 0.6741 0.1674 0.0446 0.0658 213 PRO A N
|
|
32 C CA . PRO A 11 ? 0.8960 0.9984 0.6450 0.1847 0.0160 0.0384 213 PRO A CA
|
|
33 C C . PRO A 11 ? 0.8694 0.9677 0.6541 0.1555 -0.0008 0.0179 213 PRO A C
|
|
34 O O . PRO A 11 ? 0.8301 0.9079 0.6381 0.1284 0.0010 0.0195 213 PRO A O
|
|
35 C CB . PRO A 11 ? 0.9348 1.0465 0.6706 0.2115 -0.0022 0.0255 213 PRO A CB
|
|
36 C CG . PRO A 11 ? 1.0147 1.1065 0.7355 0.2138 0.0217 0.0540 213 PRO A CG
|
|
37 C CD . PRO A 11 ? 0.9443 1.0074 0.6907 0.1760 0.0436 0.0708 213 PRO A CD
|
|
38 N N . LYS A 12 ? 0.7902 0.9118 0.5798 0.1644 -0.0155 0.0002 214 LYS A N
|
|
39 C CA . LYS A 12 ? 0.7400 0.8637 0.5666 0.1429 -0.0293 -0.0165 214 LYS A CA
|
|
40 C C . LYS A 12 ? 0.7446 0.8578 0.6069 0.1325 -0.0452 -0.0286 214 LYS A C
|
|
41 O O . LYS A 12 ? 0.7008 0.8043 0.5897 0.1081 -0.0416 -0.0239 214 LYS A O
|
|
42 C CB . LYS A 12 ? 0.7603 0.9143 0.5894 0.1623 -0.0456 -0.0372 214 LYS A CB
|
|
43 C CG . LYS A 12 ? 0.6763 0.8341 0.5363 0.1408 -0.0487 -0.0440 214 LYS A CG
|
|
44 C CD . LYS A 12 ? 0.5829 0.7700 0.4658 0.1601 -0.0732 -0.0742 214 LYS A CD
|
|
45 C CE . LYS A 12 ? 0.5862 0.7793 0.4971 0.1419 -0.0733 -0.0776 214 LYS A CE
|
|
46 N NZ . LYS A 12 ? 0.7630 0.9836 0.7120 0.1588 -0.0982 -0.1103 214 LYS A NZ
|
|
47 N N . ALA A 13 ? 0.7089 0.8272 0.5722 0.1540 -0.0612 -0.0428 215 ALA A N
|
|
48 C CA . ALA A 13 ? 0.6903 0.7982 0.5922 0.1477 -0.0751 -0.0535 215 ALA A CA
|
|
49 C C . ALA A 13 ? 0.7573 0.8370 0.6554 0.1253 -0.0591 -0.0308 215 ALA A C
|
|
50 O O . ALA A 13 ? 0.7388 0.8106 0.6738 0.1107 -0.0628 -0.0305 215 ALA A O
|
|
51 C CB . ALA A 13 ? 0.7123 0.8352 0.6140 0.1786 -0.0952 -0.0768 215 ALA A CB
|
|
52 N N . LEU A 14 ? 0.7304 0.7978 0.5892 0.1252 -0.0402 -0.0113 216 LEU A N
|
|
53 C CA . LEU A 14 ? 0.7270 0.7714 0.5861 0.1049 -0.0256 0.0057 216 LEU A CA
|
|
54 C C . LEU A 14 ? 0.7549 0.8004 0.6330 0.0808 -0.0171 0.0102 216 LEU A C
|
|
55 O O . LEU A 14 ? 0.7291 0.7713 0.6308 0.0682 -0.0198 0.0109 216 LEU A O
|
|
56 C CB . LEU A 14 ? 0.7622 0.7959 0.5882 0.1116 -0.0044 0.0250 216 LEU A CB
|
|
57 C CG . LEU A 14 ? 0.8060 0.8180 0.6395 0.0911 0.0119 0.0388 216 LEU A CG
|
|
58 C CD1 . LEU A 14 ? 0.8009 0.8016 0.6430 0.0899 -0.0002 0.0342 216 LEU A CD1
|
|
59 C CD2 . LEU A 14 ? 0.8372 0.8403 0.6542 0.0977 0.0377 0.0598 216 LEU A CD2
|
|
60 N N . ARG A 15 ? 0.7258 0.7807 0.5937 0.0786 -0.0071 0.0130 217 ARG A N
|
|
61 C CA . ARG A 15 ? 0.6998 0.7623 0.5820 0.0602 0.0007 0.0138 217 ARG A CA
|
|
62 C C . ARG A 15 ? 0.7335 0.8087 0.6468 0.0552 -0.0127 0.0056 217 ARG A C
|
|
63 O O . ARG A 15 ? 0.7506 0.8313 0.6783 0.0425 -0.0073 0.0094 217 ARG A O
|
|
64 C CB . ARG A 15 ? 0.6793 0.7520 0.5466 0.0651 0.0094 0.0154 217 ARG A CB
|
|
65 C CG . ARG A 15 ? 0.6304 0.6921 0.4847 0.0635 0.0336 0.0310 217 ARG A CG
|
|
66 C CD . ARG A 15 ? 0.6188 0.6917 0.4626 0.0707 0.0438 0.0358 217 ARG A CD
|
|
67 N NE . ARG A 15 ? 0.5445 0.6279 0.4067 0.0530 0.0439 0.0271 217 ARG A NE
|
|
68 C CZ . ARG A 15 ? 0.8068 0.9067 0.6649 0.0579 0.0360 0.0201 217 ARG A CZ
|
|
69 N NH1 . ARG A 15 ? 0.7592 0.8701 0.5987 0.0807 0.0248 0.0166 217 ARG A NH1
|
|
70 N NH2 . ARG A 15 ? 0.7709 0.8804 0.6449 0.0422 0.0382 0.0137 217 ARG A NH2
|
|
71 N N . ASP A 16 ? 0.6617 0.7453 0.5912 0.0684 -0.0293 -0.0058 218 ASP A N
|
|
72 C CA . ASP A 16 ? 0.6407 0.7356 0.6152 0.0664 -0.0388 -0.0102 218 ASP A CA
|
|
73 C C . ASP A 16 ? 0.6771 0.7657 0.6732 0.0599 -0.0354 0.0011 218 ASP A C
|
|
74 O O . ASP A 16 ? 0.6740 0.7758 0.6973 0.0552 -0.0308 0.0096 218 ASP A O
|
|
75 C CB . ASP A 16 ? 0.6689 0.7721 0.6723 0.0838 -0.0584 -0.0299 218 ASP A CB
|
|
76 C CG . ASP A 16 ? 0.8018 0.9182 0.8658 0.0818 -0.0639 -0.0333 218 ASP A CG
|
|
77 O OD1 . ASP A 16 ? 0.8156 0.9463 0.8857 0.0788 -0.0620 -0.0354 218 ASP A OD1
|
|
78 O OD2 . ASP A 16 ? 0.8776 0.9898 0.9861 0.0826 -0.0663 -0.0292 218 ASP A OD2
|
|
79 N N . GLU A 17 ? 0.6395 0.7112 0.6230 0.0628 -0.0368 0.0030 219 GLU A N
|
|
80 C CA . GLU A 17 ? 0.6302 0.6954 0.6312 0.0596 -0.0346 0.0133 219 GLU A CA
|
|
81 C C . GLU A 17 ? 0.6809 0.7416 0.6570 0.0491 -0.0218 0.0233 219 GLU A C
|
|
82 O O . GLU A 17 ? 0.6647 0.7318 0.6574 0.0485 -0.0188 0.0326 219 GLU A O
|
|
83 C CB . GLU A 17 ? 0.6584 0.7096 0.6692 0.0706 -0.0468 0.0055 219 GLU A CB
|
|
84 C CG . GLU A 17 ? 0.7288 0.7876 0.8002 0.0792 -0.0584 -0.0020 219 GLU A CG
|
|
85 C CD . GLU A 17 ? 0.8491 0.8953 0.9323 0.0901 -0.0711 -0.0137 219 GLU A CD
|
|
86 O OE1 . GLU A 17 ? 0.6130 0.6474 0.7036 0.0865 -0.0665 -0.0011 219 GLU A OE1
|
|
87 O OE2 . GLU A 17 ? 0.8610 0.9119 0.9391 0.1046 -0.0856 -0.0364 219 GLU A OE2
|
|
88 N N . TYR A 18 ? 0.6557 0.7076 0.5991 0.0438 -0.0135 0.0211 220 TYR A N
|
|
89 C CA . TYR A 18 ? 0.6607 0.7092 0.5938 0.0340 -0.0021 0.0241 220 TYR A CA
|
|
90 C C . TYR A 18 ? 0.7564 0.8138 0.6832 0.0248 0.0099 0.0192 220 TYR A C
|
|
91 O O . TYR A 18 ? 0.7533 0.8086 0.6695 0.0270 0.0130 0.0186 220 TYR A O
|
|
92 C CB . TYR A 18 ? 0.6913 0.7154 0.6079 0.0365 0.0002 0.0273 220 TYR A CB
|
|
93 C CG . TYR A 18 ? 0.7153 0.7297 0.6397 0.0459 -0.0124 0.0287 220 TYR A CG
|
|
94 C CD1 . TYR A 18 ? 0.7223 0.7358 0.6602 0.0434 -0.0138 0.0337 220 TYR A CD1
|
|
95 C CD2 . TYR A 18 ? 0.7348 0.7453 0.6573 0.0600 -0.0239 0.0224 220 TYR A CD2
|
|
96 C CE1 . TYR A 18 ? 0.7236 0.7281 0.6770 0.0518 -0.0241 0.0355 220 TYR A CE1
|
|
97 C CE2 . TYR A 18 ? 0.7402 0.7446 0.6817 0.0691 -0.0369 0.0183 220 TYR A CE2
|
|
98 C CZ . TYR A 18 ? 0.8124 0.8110 0.7706 0.0635 -0.0359 0.0265 220 TYR A CZ
|
|
99 O OH . TYR A 18 ? 0.7908 0.7816 0.7735 0.0720 -0.0469 0.0234 220 TYR A OH
|
|
100 N N . ILE A 19 ? 0.7320 0.8030 0.6691 0.0170 0.0161 0.0134 221 ILE A N
|
|
101 C CA . ILE A 19 ? 0.7391 0.8202 0.6839 0.0078 0.0272 0.0026 221 ILE A CA
|
|
102 C C . ILE A 19 ? 0.8681 0.9294 0.8194 0.0019 0.0382 0.0013 221 ILE A C
|
|
103 O O . ILE A 19 ? 0.8686 0.9356 0.8326 -0.0003 0.0369 -0.0067 221 ILE A O
|
|
104 C CB . ILE A 19 ? 0.7541 0.8718 0.7145 0.0074 0.0253 -0.0107 221 ILE A CB
|
|
105 C CG1 . ILE A 19 ? 0.7331 0.8724 0.6929 0.0172 0.0173 -0.0023 221 ILE A CG1
|
|
106 C CG2 . ILE A 19 ? 0.7702 0.8981 0.7456 -0.0016 0.0350 -0.0268 221 ILE A CG2
|
|
107 C CD1 . ILE A 19 ? 0.7174 0.8998 0.6872 0.0230 0.0178 -0.0126 221 ILE A CD1
|
|
108 N N . MET A 20 ? 0.8994 0.9399 0.8443 0.0024 0.0503 0.0110 222 MET A N
|
|
109 C CA . MET A 20 ? 0.9398 0.9594 0.8968 -0.0001 0.0665 0.0175 222 MET A CA
|
|
110 C C . MET A 20 ? 1.0050 1.0337 1.0069 -0.0130 0.0787 0.0004 222 MET A C
|
|
111 O O . MET A 20 ? 0.9889 1.0342 1.0100 -0.0187 0.0829 -0.0116 222 MET A O
|
|
112 C CB . MET A 20 ? 1.0039 1.0073 0.9437 0.0110 0.0800 0.0377 222 MET A CB
|
|
113 C CG . MET A 20 ? 1.0745 1.0724 0.9767 0.0283 0.0662 0.0473 222 MET A CG
|
|
114 S SD . MET A 20 ? 1.1588 1.1380 1.0517 0.0341 0.0609 0.0534 222 MET A SD
|
|
115 C CE . MET A 20 ? 1.1438 1.1046 1.0553 0.0340 0.0919 0.0712 222 MET A CE
|
|
116 N N . SER A 21 ? 0.9762 0.9959 0.9999 -0.0170 0.0830 -0.0042 223 SER A N
|
|
117 C CA . SER A 21 ? 0.9791 1.0104 1.0581 -0.0277 0.0911 -0.0281 223 SER A CA
|
|
118 C C . SER A 21 ? 1.0963 1.1004 1.2137 -0.0315 0.1146 -0.0170 223 SER A C
|
|
119 O O . SER A 21 ? 1.1246 1.1036 1.2210 -0.0233 0.1288 0.0139 223 SER A O
|
|
120 C CB . SER A 21 ? 0.9797 1.0386 1.0607 -0.0262 0.0716 -0.0519 223 SER A CB
|
|
121 O OG . SER A 21 ? 1.0305 1.1164 1.1658 -0.0320 0.0728 -0.0866 223 SER A OG
|
|
122 N N . LYS A 22 ? 1.0674 1.0817 1.2457 -0.0408 0.1190 -0.0434 224 LYS A N
|
|
123 C CA . LYS A 22 ? 1.0857 1.0795 1.3248 -0.0466 0.1427 -0.0395 224 LYS A CA
|
|
124 C C . LYS A 22 ? 1.1621 1.1253 1.3743 -0.0397 0.1500 -0.0091 224 LYS A C
|
|
125 O O . LYS A 22 ? 1.1493 1.1129 1.3128 -0.0346 0.1297 -0.0082 224 LYS A O
|
|
126 C CB . LYS A 22 ? 1.1041 1.1247 1.4144 -0.0557 0.1360 -0.0856 224 LYS A CB
|
|
127 N N . THR A 23 ? 1.1480 1.0865 1.3986 -0.0378 0.1815 0.0166 225 THR A N
|
|
128 C CA . THR A 23 ? 1.1640 1.0753 1.3986 -0.0282 0.1949 0.0483 225 THR A CA
|
|
129 C C . THR A 23 ? 1.1919 1.1022 1.4523 -0.0366 0.1842 0.0268 225 THR A C
|
|
130 O O . THR A 23 ? 1.1741 1.0983 1.5076 -0.0493 0.1854 -0.0064 225 THR A O
|
|
131 C CB . THR A 23 ? 1.2973 1.1892 1.5759 -0.0197 0.2371 0.0854 225 THR A CB
|
|
132 O OG1 . THR A 23 ? 1.2924 1.1624 1.5622 -0.0082 0.2519 0.1151 225 THR A OG1
|
|
133 C CG2 . THR A 23 ? 1.2831 1.1796 1.6715 -0.0348 0.2600 0.0664 225 THR A CG2
|
|
134 N N . LEU A 24 ? 1.1454 1.0424 1.3491 -0.0278 0.1725 0.0426 226 LEU A N
|
|
135 C CA . LEU A 24 ? 1.1326 1.0269 1.3501 -0.0335 0.1618 0.0270 226 LEU A CA
|
|
136 C C . LEU A 24 ? 1.2243 1.0900 1.4724 -0.0294 0.1896 0.0550 226 LEU A C
|
|
137 O O . LEU A 24 ? 1.2157 1.0795 1.5192 -0.0389 0.1930 0.0377 226 LEU A O
|
|
138 C CB . LEU A 24 ? 1.1123 1.0114 1.2555 -0.0268 0.1311 0.0253 226 LEU A CB
|
|
139 C CG . LEU A 24 ? 1.1356 1.0641 1.2485 -0.0268 0.1056 0.0046 226 LEU A CG
|
|
140 C CD1 . LEU A 24 ? 1.1283 1.0519 1.1750 -0.0160 0.0862 0.0189 226 LEU A CD1
|
|
141 C CD2 . LEU A 24 ? 1.1216 1.0828 1.2731 -0.0340 0.0914 -0.0352 226 LEU A CD2
|
|
142 N N . GLY A 25 ? 1.2150 1.0632 1.4270 -0.0120 0.2090 0.0972 227 GLY A N
|
|
143 C CA . GLY A 25 ? 1.6262 1.4512 1.8570 0.0000 0.2398 0.1339 227 GLY A CA
|
|
144 C C . GLY A 25 ? 1.8250 1.6444 1.9843 0.0287 0.2485 0.1752 227 GLY A C
|
|
145 O O . GLY A 25 ? 1.2672 1.0874 1.4387 0.0438 0.2774 0.2052 227 GLY A O
|
|
146 N N . GLY A 30 ? 1.5133 1.3761 1.3925 0.2286 0.3078 0.3543 232 GLY A N
|
|
147 C CA . GLY A 30 ? 1.4708 1.3382 1.3286 0.2036 0.2643 0.3070 232 GLY A CA
|
|
148 C C . GLY A 30 ? 1.4793 1.3316 1.4012 0.1591 0.2642 0.2839 232 GLY A C
|
|
149 O O . GLY A 30 ? 1.4711 1.3028 1.4502 0.1336 0.2747 0.2789 232 GLY A O
|
|
150 N N . GLU A 31 ? 1.3913 1.2581 1.3057 0.1519 0.2510 0.2665 233 GLU A N
|
|
151 C CA . GLU A 31 ? 1.3337 1.1954 1.3014 0.1151 0.2471 0.2402 233 GLU A CA
|
|
152 C C . GLU A 31 ? 1.2933 1.1585 1.2363 0.0932 0.2027 0.1971 233 GLU A C
|
|
153 O O . GLU A 31 ? 1.2833 1.1622 1.1722 0.1074 0.1772 0.1876 233 GLU A O
|
|
154 C CB . GLU A 31 ? 1.3564 1.2327 1.3345 0.1229 0.2645 0.2525 233 GLU A CB
|
|
155 N N . VAL A 32 ? 1.1784 1.0353 1.1662 0.0624 0.1945 0.1712 234 VAL A N
|
|
156 C CA . VAL A 32 ? 1.1153 0.9793 1.0862 0.0453 0.1580 0.1363 234 VAL A CA
|
|
157 C C . VAL A 32 ? 1.0990 0.9773 1.1093 0.0234 0.1535 0.1103 234 VAL A C
|
|
158 O O . VAL A 32 ? 1.0936 0.9700 1.1654 0.0086 0.1694 0.1015 234 VAL A O
|
|
159 C CB . VAL A 32 ? 1.1445 0.9956 1.1173 0.0379 0.1467 0.1280 234 VAL A CB
|
|
160 C CG1 . VAL A 32 ? 1.1066 0.9694 1.0763 0.0217 0.1164 0.0964 234 VAL A CG1
|
|
161 C CG2 . VAL A 32 ? 1.1595 1.0023 1.0825 0.0618 0.1424 0.1470 234 VAL A CG2
|
|
162 N N . LYS A 33 ? 1.0076 0.9027 0.9883 0.0232 0.1321 0.0964 235 LYS A N
|
|
163 C CA . LYS A 33 ? 0.9714 0.8850 0.9821 0.0067 0.1264 0.0720 235 LYS A CA
|
|
164 C C . LYS A 33 ? 0.9498 0.8799 0.9443 0.0001 0.0971 0.0484 235 LYS A C
|
|
165 O O . LYS A 33 ? 0.9378 0.8651 0.8936 0.0093 0.0801 0.0533 235 LYS A O
|
|
166 C CB . LYS A 33 ? 1.0093 0.9330 1.0090 0.0134 0.1334 0.0800 235 LYS A CB
|
|
167 C CG . LYS A 33 ? 1.2157 1.1296 1.2459 0.0205 0.1683 0.1051 235 LYS A CG
|
|
168 C CD . LYS A 33 ? 1.3072 1.2342 1.3701 0.0117 0.1780 0.0964 235 LYS A CD
|
|
169 N N . LEU A 34 ? 0.8701 0.8212 0.8994 -0.0125 0.0924 0.0226 236 LEU A N
|
|
170 C CA . LEU A 34 ? 0.8375 0.8145 0.8557 -0.0134 0.0694 0.0032 236 LEU A CA
|
|
171 C C . LEU A 34 ? 0.8665 0.8572 0.8594 -0.0084 0.0614 0.0064 236 LEU A C
|
|
172 O O . LEU A 34 ? 0.8692 0.8581 0.8683 -0.0097 0.0732 0.0108 236 LEU A O
|
|
173 C CB . LEU A 34 ? 0.8255 0.8297 0.8926 -0.0221 0.0688 -0.0287 236 LEU A CB
|
|
174 C CG . LEU A 34 ? 0.8544 0.8998 0.9149 -0.0165 0.0491 -0.0501 236 LEU A CG
|
|
175 C CD1 . LEU A 34 ? 0.8541 0.9035 0.8944 -0.0084 0.0357 -0.0470 236 LEU A CD1
|
|
176 C CD2 . LEU A 34 ? 0.8573 0.9365 0.9685 -0.0205 0.0497 -0.0866 236 LEU A CD2
|
|
177 N N . ALA A 35 ? 0.7996 0.8033 0.7691 -0.0017 0.0434 0.0066 237 ALA A N
|
|
178 C CA . ALA A 35 ? 0.7858 0.8039 0.7403 0.0032 0.0356 0.0092 237 ALA A CA
|
|
179 C C . ALA A 35 ? 0.8158 0.8591 0.7699 0.0095 0.0217 0.0056 237 ALA A C
|
|
180 O O . ALA A 35 ? 0.8274 0.8719 0.7841 0.0124 0.0173 0.0052 237 ALA A O
|
|
181 C CB . ALA A 35 ? 0.8046 0.8025 0.7326 0.0126 0.0330 0.0257 237 ALA A CB
|
|
182 N N . PHE A 36 ? 0.7420 0.8068 0.6949 0.0140 0.0171 0.0060 238 PHE A N
|
|
183 C CA . PHE A 36 ? 0.7247 0.8173 0.6821 0.0250 0.0093 0.0105 238 PHE A CA
|
|
184 C C . PHE A 36 ? 0.7714 0.8584 0.7287 0.0319 0.0039 0.0257 238 PHE A C
|
|
185 O O . PHE A 36 ? 0.7636 0.8530 0.7200 0.0299 0.0046 0.0242 238 PHE A O
|
|
186 C CB . PHE A 36 ? 0.7449 0.8802 0.7127 0.0288 0.0107 -0.0043 238 PHE A CB
|
|
187 C CG . PHE A 36 ? 0.7806 0.9282 0.7633 0.0229 0.0139 -0.0293 238 PHE A CG
|
|
188 C CD1 . PHE A 36 ? 0.8193 0.9889 0.8091 0.0317 0.0092 -0.0394 238 PHE A CD1
|
|
189 C CD2 . PHE A 36 ? 0.8225 0.9625 0.8202 0.0102 0.0220 -0.0443 238 PHE A CD2
|
|
190 C CE1 . PHE A 36 ? 0.8392 1.0247 0.8548 0.0273 0.0100 -0.0699 238 PHE A CE1
|
|
191 C CE2 . PHE A 36 ? 0.8656 1.0174 0.8953 0.0044 0.0257 -0.0713 238 PHE A CE2
|
|
192 C CZ . PHE A 36 ? 0.8352 1.0104 0.8756 0.0127 0.0184 -0.0867 238 PHE A CZ
|
|
193 N N . GLU A 37 ? 0.7160 0.7971 0.6818 0.0404 -0.0014 0.0387 239 GLU A N
|
|
194 C CA . GLU A 37 ? 0.6955 0.7742 0.6805 0.0480 -0.0064 0.0494 239 GLU A CA
|
|
195 C C . GLU A 37 ? 0.7027 0.8167 0.7034 0.0549 -0.0015 0.0555 239 GLU A C
|
|
196 O O . GLU A 37 ? 0.7004 0.8440 0.7039 0.0643 0.0036 0.0614 239 GLU A O
|
|
197 C CB . GLU A 37 ? 0.7108 0.7787 0.7148 0.0562 -0.0104 0.0616 239 GLU A CB
|
|
198 C CG . GLU A 37 ? 0.8487 0.9056 0.8854 0.0623 -0.0177 0.0644 239 GLU A CG
|
|
199 C CD . GLU A 37 ? 1.1772 1.2280 1.2503 0.0716 -0.0193 0.0773 239 GLU A CD
|
|
200 O OE1 . GLU A 37 ? 1.2077 1.2535 1.2675 0.0722 -0.0172 0.0830 239 GLU A OE1
|
|
201 O OE2 . GLU A 37 ? 1.0932 1.1448 1.2150 0.0788 -0.0224 0.0805 239 GLU A OE2
|
|
202 N N . ARG A 38 ? 0.6354 0.7509 0.6432 0.0529 -0.0028 0.0528 240 ARG A N
|
|
203 C CA . ARG A 38 ? 0.6129 0.7607 0.6353 0.0592 0.0027 0.0589 240 ARG A CA
|
|
204 C C . ARG A 38 ? 0.6823 0.8516 0.7424 0.0764 0.0088 0.0831 240 ARG A C
|
|
205 O O . ARG A 38 ? 0.7071 0.9139 0.7721 0.0886 0.0177 0.0937 240 ARG A O
|
|
206 C CB . ARG A 38 ? 0.5632 0.7036 0.5902 0.0537 -0.0011 0.0513 240 ARG A CB
|
|
207 C CG . ARG A 38 ? 0.5870 0.7135 0.5809 0.0414 -0.0018 0.0343 240 ARG A CG
|
|
208 C CD . ARG A 38 ? 0.5981 0.7251 0.5961 0.0403 -0.0052 0.0287 240 ARG A CD
|
|
209 N NE . ARG A 38 ? 0.6709 0.7840 0.6390 0.0328 -0.0029 0.0179 240 ARG A NE
|
|
210 C CZ . ARG A 38 ? 0.7484 0.8716 0.7047 0.0248 0.0058 0.0119 240 ARG A CZ
|
|
211 N NH1 . ARG A 38 ? 0.5655 0.7163 0.5313 0.0244 0.0097 0.0107 240 ARG A NH1
|
|
212 N NH2 . ARG A 38 ? 0.5657 0.6747 0.5041 0.0201 0.0118 0.0075 240 ARG A NH2
|
|
213 N N . LYS A 39 ? 0.6022 0.7505 0.6941 0.0802 0.0054 0.0925 241 LYS A N
|
|
214 C CA . LYS A 39 ? 0.5776 0.7400 0.7216 0.0968 0.0145 0.1191 241 LYS A CA
|
|
215 C C . LYS A 39 ? 0.6273 0.8168 0.7609 0.1123 0.0250 0.1380 241 LYS A C
|
|
216 O O . LYS A 39 ? 0.6061 0.8306 0.7661 0.1330 0.0398 0.1648 241 LYS A O
|
|
217 C CB . LYS A 39 ? 0.6102 0.7403 0.7937 0.0948 0.0056 0.1155 241 LYS A CB
|
|
218 C CG . LYS A 39 ? 0.7511 0.8899 1.0136 0.1101 0.0161 0.1410 241 LYS A CG
|
|
219 N N . THR A 40 ? 0.6042 0.7805 0.7008 0.1053 0.0184 0.1247 242 THR A N
|
|
220 C CA . THR A 40 ? 0.6027 0.8017 0.6883 0.1200 0.0242 0.1360 242 THR A CA
|
|
221 C C . THR A 40 ? 0.6835 0.9135 0.7276 0.1218 0.0227 0.1168 242 THR A C
|
|
222 O O . THR A 40 ? 0.6891 0.9559 0.7267 0.1422 0.0276 0.1249 242 THR A O
|
|
223 C CB . THR A 40 ? 0.6970 0.8589 0.7827 0.1122 0.0169 0.1332 242 THR A CB
|
|
224 O OG1 . THR A 40 ? 0.7252 0.8582 0.7732 0.0915 0.0058 0.1050 242 THR A OG1
|
|
225 C CG2 . THR A 40 ? 0.6070 0.7426 0.7441 0.1128 0.0161 0.1453 242 THR A CG2
|
|
226 N N . CYS A 41 ? 0.6616 0.8794 0.6826 0.1028 0.0158 0.0895 243 CYS A N
|
|
227 C CA . CYS A 41 ? 0.6676 0.9098 0.6637 0.1001 0.0131 0.0625 243 CYS A CA
|
|
228 C C . CYS A 41 ? 0.7999 1.0306 0.7844 0.0955 0.0081 0.0488 243 CYS A C
|
|
229 O O . CYS A 41 ? 0.8418 1.1029 0.8191 0.1004 0.0055 0.0260 243 CYS A O
|
|
230 C CB . CYS A 41 ? 0.6539 0.9585 0.6502 0.1253 0.0189 0.0658 243 CYS A CB
|
|
231 S SG . CYS A 41 ? 0.6935 1.0126 0.6991 0.1257 0.0243 0.0720 243 CYS A SG
|
|
232 N N . LYS A 42 ? 0.7502 0.9399 0.7381 0.0876 0.0058 0.0600 244 LYS A N
|
|
233 C CA . LYS A 42 ? 0.7520 0.9258 0.7311 0.0831 0.0020 0.0516 244 LYS A CA
|
|
234 C C . LYS A 42 ? 0.7786 0.9116 0.7474 0.0602 -0.0004 0.0340 244 LYS A C
|
|
235 O O . LYS A 42 ? 0.7664 0.8742 0.7331 0.0504 -0.0002 0.0361 244 LYS A O
|
|
236 C CB . LYS A 42 ? 0.7947 0.9529 0.7859 0.0923 0.0025 0.0766 244 LYS A CB
|
|
237 C CG . LYS A 42 ? 0.9405 1.1432 0.9482 0.1205 0.0108 0.1017 244 LYS A CG
|
|
238 C CD . LYS A 42 ? 0.9575 1.1936 0.9538 0.1383 0.0107 0.0996 244 LYS A CD
|
|
239 C CE . LYS A 42 ? 0.9397 1.2020 0.9567 0.1671 0.0219 0.1370 244 LYS A CE
|
|
240 N NZ . LYS A 42 ? 0.8893 1.1058 0.9387 0.1589 0.0250 0.1603 244 LYS A NZ
|
|
241 N N . LYS A 43 ? 0.7322 0.8633 0.6984 0.0548 -0.0014 0.0171 245 LYS A N
|
|
242 C CA . LYS A 43 ? 0.7379 0.8346 0.7030 0.0365 0.0016 0.0043 245 LYS A CA
|
|
243 C C . LYS A 43 ? 0.8271 0.8796 0.7812 0.0320 0.0006 0.0207 245 LYS A C
|
|
244 O O . LYS A 43 ? 0.8287 0.8765 0.7818 0.0398 -0.0040 0.0328 245 LYS A O
|
|
245 C CB . LYS A 43 ? 0.7562 0.8696 0.7360 0.0346 0.0016 -0.0199 245 LYS A CB
|
|
246 C CG . LYS A 43 ? 0.7940 0.9433 0.7945 0.0338 0.0029 -0.0487 245 LYS A CG
|
|
247 C CD . LYS A 43 ? 0.8097 0.9931 0.8348 0.0398 -0.0021 -0.0804 245 LYS A CD
|
|
248 N N . VAL A 44 ? 0.7876 0.8115 0.7345 0.0227 0.0056 0.0215 246 VAL A N
|
|
249 C CA . VAL A 44 ? 0.7861 0.7739 0.7190 0.0231 0.0046 0.0329 246 VAL A CA
|
|
250 C C . VAL A 44 ? 0.8222 0.7897 0.7533 0.0152 0.0174 0.0305 246 VAL A C
|
|
251 O O . VAL A 44 ? 0.8279 0.8064 0.7753 0.0076 0.0269 0.0201 246 VAL A O
|
|
252 C CB . VAL A 44 ? 0.8371 0.8185 0.7642 0.0312 -0.0030 0.0412 246 VAL A CB
|
|
253 C CG1 . VAL A 44 ? 0.8139 0.8113 0.7593 0.0400 -0.0112 0.0486 246 VAL A CG1
|
|
254 C CG2 . VAL A 44 ? 0.8375 0.8261 0.7607 0.0292 0.0014 0.0372 246 VAL A CG2
|
|
255 N N . ALA A 45 ? 0.7874 0.7280 0.7045 0.0191 0.0195 0.0409 247 ALA A N
|
|
256 C CA . ALA A 45 ? 0.8053 0.7273 0.7223 0.0176 0.0367 0.0478 247 ALA A CA
|
|
257 C C . ALA A 45 ? 0.8769 0.7904 0.7666 0.0326 0.0359 0.0597 247 ALA A C
|
|
258 O O . ALA A 45 ? 0.8734 0.7835 0.7474 0.0434 0.0209 0.0602 247 ALA A O
|
|
259 C CB . ALA A 45 ? 0.8184 0.7223 0.7404 0.0156 0.0416 0.0517 247 ALA A CB
|
|
260 N N . ILE A 46 ? 0.8386 0.7538 0.7271 0.0356 0.0507 0.0663 248 ILE A N
|
|
261 C CA . ILE A 46 ? 0.8613 0.7774 0.7212 0.0559 0.0498 0.0758 248 ILE A CA
|
|
262 C C . ILE A 46 ? 0.9672 0.8714 0.8195 0.0686 0.0731 0.0970 248 ILE A C
|
|
263 O O . ILE A 46 ? 0.9920 0.8944 0.8681 0.0619 0.0963 0.1065 248 ILE A O
|
|
264 C CB . ILE A 46 ? 0.8955 0.8304 0.7527 0.0579 0.0449 0.0692 248 ILE A CB
|
|
265 C CG1 . ILE A 46 ? 0.8623 0.8103 0.7320 0.0491 0.0245 0.0535 248 ILE A CG1
|
|
266 C CG2 . ILE A 46 ? 0.9218 0.8643 0.7485 0.0848 0.0421 0.0754 248 ILE A CG2
|
|
267 C CD1 . ILE A 46 ? 0.8981 0.8638 0.7694 0.0504 0.0191 0.0470 248 ILE A CD1
|
|
268 N N . LYS A 47 ? 0.9319 0.8301 0.7570 0.0890 0.0684 0.1052 249 LYS A N
|
|
269 C CA . LYS A 47 ? 0.9537 0.8456 0.7655 0.1098 0.0915 0.1306 249 LYS A CA
|
|
270 C C . LYS A 47 ? 1.0316 0.9449 0.8122 0.1404 0.0945 0.1397 249 LYS A C
|
|
271 O O . LYS A 47 ? 1.0180 0.9479 0.7728 0.1581 0.0701 0.1233 249 LYS A O
|
|
272 C CB . LYS A 47 ? 0.9841 0.8640 0.7799 0.1200 0.0844 0.1335 249 LYS A CB
|
|
273 C CG . LYS A 47 ? 1.1167 0.9912 0.9017 0.1432 0.1121 0.1644 249 LYS A CG
|
|
274 N N . ILE A 48 ? 1.0257 0.9415 0.8164 0.1475 0.1252 0.1642 250 ILE A N
|
|
275 C CA . ILE A 48 ? 1.0519 0.9915 0.8147 0.1805 0.1361 0.1804 250 ILE A CA
|
|
276 C C . ILE A 48 ? 1.1647 1.1098 0.9032 0.2182 0.1586 0.2128 250 ILE A C
|
|
277 O O . ILE A 48 ? 1.1641 1.0893 0.9308 0.2113 0.1862 0.2369 250 ILE A O
|
|
278 C CB . ILE A 48 ? 1.0769 1.0179 0.8711 0.1674 0.1597 0.1916 250 ILE A CB
|
|
279 C CG1 . ILE A 48 ? 1.0368 0.9750 0.8556 0.1316 0.1387 0.1599 250 ILE A CG1
|
|
280 C CG2 . ILE A 48 ? 1.0901 1.0593 0.8529 0.2041 0.1708 0.2096 250 ILE A CG2
|
|
281 C CD1 . ILE A 48 ? 1.0726 0.9923 0.9447 0.0978 0.1504 0.1541 250 ILE A CD1
|
|
282 N N . ILE A 49 ? 1.1586 1.1349 0.8484 0.2602 0.1455 0.2106 251 ILE A N
|
|
283 C CA . ILE A 49 ? 1.2025 1.1985 0.8573 0.3083 0.1635 0.2395 251 ILE A CA
|
|
284 C C . ILE A 49 ? 1.2771 1.3136 0.9010 0.3494 0.1722 0.2522 251 ILE A C
|
|
285 O O . ILE A 49 ? 1.2620 1.3244 0.8634 0.3601 0.1397 0.2185 251 ILE A O
|
|
286 C CB . ILE A 49 ? 1.2407 1.2466 0.8626 0.3280 0.1321 0.2152 251 ILE A CB
|
|
287 C CG1 . ILE A 49 ? 1.2143 1.1816 0.8651 0.2882 0.1219 0.2025 251 ILE A CG1
|
|
288 C CG2 . ILE A 49 ? 1.2884 1.3240 0.8688 0.3845 0.1497 0.2436 251 ILE A CG2
|
|
289 C CD1 . ILE A 49 ? 1.2550 1.2178 0.9158 0.2636 0.0820 0.1590 251 ILE A CD1
|
|
290 N N . SER A 50 ? 1.2718 1.3154 0.9007 0.3738 0.2173 0.3011 252 SER A N
|
|
291 C CA . SER A 50 ? 1.2967 1.3831 0.8945 0.4198 0.2319 0.3216 252 SER A CA
|
|
292 C C . SER A 50 ? 1.3564 1.4931 0.8897 0.4830 0.2153 0.3162 252 SER A C
|
|
293 O O . SER A 50 ? 1.3583 1.4935 0.8771 0.4991 0.2157 0.3226 252 SER A O
|
|
294 C CB . SER A 50 ? 1.3749 1.4540 1.0071 0.4296 0.2902 0.3812 252 SER A CB
|
|
295 N N . LYS A 51 ? 1.3203 1.5047 0.8168 0.5198 0.1985 0.3000 253 LYS A N
|
|
296 C CA . LYS A 51 ? 1.5051 1.7507 0.9421 0.5868 0.1775 0.2848 253 LYS A CA
|
|
297 C C . LYS A 51 ? 1.8579 2.1461 1.2601 0.6538 0.2230 0.3445 253 LYS A C
|
|
298 O O . LYS A 51 ? 1.4054 1.6874 0.8040 0.6724 0.2512 0.3820 253 LYS A O
|
|
299 C CB . LYS A 51 ? 1.5115 1.7944 0.9327 0.5971 0.1334 0.2310 253 LYS A CB
|
|
300 C CG . LYS A 51 ? 1.5156 1.7654 0.9729 0.5424 0.0887 0.1739 253 LYS A CG
|
|
301 C CD . LYS A 51 ? 1.5973 1.8846 1.0515 0.5543 0.0503 0.1247 253 LYS A CD
|
|
302 C CE . LYS A 51 ? 1.6624 1.9475 1.1406 0.5386 0.0016 0.0644 253 LYS A CE
|
|
303 N NZ . LYS A 51 ? 1.7304 2.0539 1.2194 0.5513 -0.0348 0.0144 253 LYS A NZ
|
|
304 N N . ASN A 67 ? 1.5018 1.7836 0.8989 0.6559 -0.0517 0.0254 269 ASN A N
|
|
305 C CA . ASN A 67 ? 1.4811 1.6971 0.8963 0.6073 -0.0272 0.0614 269 ASN A CA
|
|
306 C C . ASN A 67 ? 1.4941 1.6480 0.9661 0.5306 -0.0294 0.0572 269 ASN A C
|
|
307 O O . ASN A 67 ? 1.4690 1.5759 0.9688 0.4892 -0.0306 0.0586 269 ASN A O
|
|
308 C CB . ASN A 67 ? 1.5121 1.7240 0.8941 0.6266 0.0266 0.1324 269 ASN A CB
|
|
309 C CG . ASN A 67 ? 1.8084 1.9749 1.1990 0.6029 0.0475 0.1626 269 ASN A CG
|
|
310 O OD1 . ASN A 67 ? 1.7152 1.8985 1.0837 0.6327 0.0355 0.1513 269 ASN A OD1
|
|
311 N ND2 . ASN A 67 ? 1.7247 1.8362 1.1500 0.5512 0.0793 0.1996 269 ASN A ND2
|
|
312 N N . VAL A 68 ? 1.4302 1.5879 0.9169 0.5154 -0.0287 0.0538 270 VAL A N
|
|
313 C CA . VAL A 68 ? 1.3694 1.4795 0.9057 0.4511 -0.0310 0.0490 270 VAL A CA
|
|
314 C C . VAL A 68 ? 1.4015 1.5162 0.9789 0.4393 -0.0759 -0.0087 270 VAL A C
|
|
315 O O . VAL A 68 ? 1.3641 1.4372 0.9829 0.3932 -0.0824 -0.0147 270 VAL A O
|
|
316 C CB . VAL A 68 ? 1.4029 1.5132 0.9411 0.4387 -0.0090 0.0717 270 VAL A CB
|
|
317 C CG1 . VAL A 68 ? 1.3487 1.4163 0.9359 0.3771 -0.0130 0.0642 270 VAL A CG1
|
|
318 C CG2 . VAL A 68 ? 1.4312 1.5356 0.9452 0.4515 0.0394 0.1309 270 VAL A CG2
|
|
319 N N . GLU A 69 ? 1.3750 1.5440 0.9455 0.4858 -0.1062 -0.0514 271 GLU A N
|
|
320 C CA . GLU A 69 ? 1.3467 1.5272 0.9709 0.4823 -0.1491 -0.1112 271 GLU A CA
|
|
321 C C . GLU A 69 ? 1.3631 1.5176 1.0081 0.4704 -0.1601 -0.1216 271 GLU A C
|
|
322 O O . GLU A 69 ? 1.3273 1.4512 1.0324 0.4323 -0.1750 -0.1408 271 GLU A O
|
|
323 C CB . GLU A 69 ? 1.3957 1.6480 1.0101 0.5423 -0.1789 -0.1587 271 GLU A CB
|
|
324 N N . THR A 70 ? 1.3132 1.4795 0.9092 0.5036 -0.1489 -0.1035 272 THR A N
|
|
325 C CA . THR A 70 ? 1.2855 1.4281 0.8914 0.4959 -0.1557 -0.1082 272 THR A CA
|
|
326 C C . THR A 70 ? 1.2460 1.3208 0.8768 0.4331 -0.1344 -0.0734 272 THR A C
|
|
327 O O . THR A 70 ? 1.2213 1.2695 0.8926 0.4086 -0.1495 -0.0903 272 THR A O
|
|
328 C CB . THR A 70 ? 1.4233 1.5947 0.9648 0.5467 -0.1414 -0.0869 272 THR A CB
|
|
329 N N . GLU A 71 ? 1.1495 1.2007 0.7609 0.4098 -0.0996 -0.0270 273 GLU A N
|
|
330 C CA . GLU A 71 ? 1.0880 1.0848 0.7230 0.3551 -0.0797 0.0019 273 GLU A CA
|
|
331 C C . GLU A 71 ? 1.0609 1.0413 0.7538 0.3178 -0.0998 -0.0239 273 GLU A C
|
|
332 O O . GLU A 71 ? 1.0277 0.9746 0.7501 0.2853 -0.1010 -0.0209 273 GLU A O
|
|
333 C CB . GLU A 71 ? 1.1138 1.0988 0.7268 0.3446 -0.0407 0.0482 273 GLU A CB
|
|
334 C CG . GLU A 71 ? 1.2185 1.1553 0.8579 0.2942 -0.0212 0.0725 273 GLU A CG
|
|
335 C CD . GLU A 71 ? 1.5707 1.4938 1.2099 0.2781 0.0155 0.1104 273 GLU A CD
|
|
336 O OE1 . GLU A 71 ? 1.5219 1.4676 1.1333 0.3100 0.0367 0.1335 273 GLU A OE1
|
|
337 O OE2 . GLU A 71 ? 1.4200 1.3128 1.0911 0.2363 0.0237 0.1165 273 GLU A OE2
|
|
338 N N . ILE A 72 ? 0.9959 1.0028 0.7064 0.3257 -0.1142 -0.0475 274 ILE A N
|
|
339 C CA . ILE A 72 ? 0.9458 0.9433 0.7167 0.2963 -0.1306 -0.0694 274 ILE A CA
|
|
340 C C . ILE A 72 ? 0.9643 0.9632 0.7861 0.3005 -0.1593 -0.1061 274 ILE A C
|
|
341 O O . ILE A 72 ? 0.9079 0.8795 0.7781 0.2686 -0.1607 -0.1039 274 ILE A O
|
|
342 C CB . ILE A 72 ? 0.9904 1.0174 0.7671 0.3061 -0.1360 -0.0831 274 ILE A CB
|
|
343 C CG1 . ILE A 72 ? 0.9957 1.0038 0.7524 0.2791 -0.1061 -0.0449 274 ILE A CG1
|
|
344 C CG2 . ILE A 72 ? 0.9610 0.9951 0.8093 0.2951 -0.1616 -0.1198 274 ILE A CG2
|
|
345 C CD1 . ILE A 72 ? 1.1512 1.1758 0.8555 0.3042 -0.0856 -0.0215 274 ILE A CD1
|
|
346 N N . GLU A 73 ? 0.9888 1.0231 0.8015 0.3433 -0.1806 -0.1388 275 GLU A N
|
|
347 C CA . GLU A 73 ? 0.9908 1.0339 0.8561 0.3556 -0.2103 -0.1815 275 GLU A CA
|
|
348 C C . GLU A 73 ? 1.0443 1.0453 0.9162 0.3302 -0.2012 -0.1603 275 GLU A C
|
|
349 O O . GLU A 73 ? 1.0163 1.0012 0.9565 0.3119 -0.2138 -0.1770 275 GLU A O
|
|
350 C CB . GLU A 73 ? 1.0454 1.1430 0.8845 0.4139 -0.2330 -0.2200 275 GLU A CB
|
|
351 N N . ILE A 74 ? 1.0311 1.0138 0.8390 0.3284 -0.1766 -0.1210 276 ILE A N
|
|
352 C CA . ILE A 74 ? 1.0247 0.9680 0.8348 0.3038 -0.1665 -0.0994 276 ILE A CA
|
|
353 C C . ILE A 74 ? 1.0693 0.9769 0.9170 0.2561 -0.1536 -0.0772 276 ILE A C
|
|
354 O O . ILE A 74 ? 1.0532 0.9449 0.9540 0.2399 -0.1637 -0.0869 276 ILE A O
|
|
355 C CB . ILE A 74 ? 1.0901 1.0258 0.8317 0.3157 -0.1426 -0.0645 276 ILE A CB
|
|
356 N N . LEU A 75 ? 1.0394 0.9406 0.8650 0.2382 -0.1320 -0.0499 277 LEU A N
|
|
357 C CA . LEU A 75 ? 1.0253 0.9030 0.8769 0.1998 -0.1188 -0.0294 277 LEU A CA
|
|
358 C C . LEU A 75 ? 1.0466 0.9281 0.9659 0.1883 -0.1333 -0.0473 277 LEU A C
|
|
359 O O . LEU A 75 ? 1.0225 0.8857 0.9696 0.1631 -0.1249 -0.0305 277 LEU A O
|
|
360 C CB . LEU A 75 ? 1.0443 0.9216 0.8618 0.1889 -0.0950 -0.0037 277 LEU A CB
|
|
361 C CG . LEU A 75 ? 1.1445 1.0031 0.9220 0.1823 -0.0696 0.0273 277 LEU A CG
|
|
362 C CD1 . LEU A 75 ? 1.1704 1.0397 0.9180 0.1895 -0.0481 0.0458 277 LEU A CD1
|
|
363 C CD2 . LEU A 75 ? 1.1570 0.9893 0.9542 0.1488 -0.0596 0.0425 277 LEU A CD2
|
|
364 N N . LYS A 76 ? 0.9973 0.9063 0.9481 0.2098 -0.1539 -0.0808 278 LYS A N
|
|
365 C CA . LYS A 76 ? 0.9644 0.8796 0.9958 0.2027 -0.1667 -0.0999 278 LYS A CA
|
|
366 C C . LYS A 76 ? 1.0263 0.9274 1.1164 0.2004 -0.1770 -0.1101 278 LYS A C
|
|
367 O O . LYS A 76 ? 1.0160 0.9073 1.1702 0.1836 -0.1726 -0.1011 278 LYS A O
|
|
368 C CB . LYS A 76 ? 0.9875 0.9394 1.0437 0.2293 -0.1879 -0.1396 278 LYS A CB
|
|
369 C CG . LYS A 76 ? 1.0521 1.0164 1.0901 0.2229 -0.1780 -0.1296 278 LYS A CG
|
|
370 N N . LYS A 77 ? 0.9904 0.8925 1.0599 0.2197 -0.1888 -0.1264 279 LYS A N
|
|
371 C CA . LYS A 77 ? 0.9779 0.8685 1.1016 0.2214 -0.2006 -0.1407 279 LYS A CA
|
|
372 C C . LYS A 77 ? 1.0374 0.8933 1.1389 0.1985 -0.1824 -0.1036 279 LYS A C
|
|
373 O O . LYS A 77 ? 1.0363 0.8789 1.1938 0.1936 -0.1869 -0.1064 279 LYS A O
|
|
374 C CB . LYS A 77 ? 1.0329 0.9485 1.1493 0.2579 -0.2256 -0.1833 279 LYS A CB
|
|
375 N N . LEU A 78 ? 0.9894 0.8326 1.0165 0.1862 -0.1622 -0.0710 280 LEU A N
|
|
376 C CA . LEU A 78 ? 0.9755 0.7907 0.9836 0.1663 -0.1469 -0.0409 280 LEU A CA
|
|
377 C C . LEU A 78 ? 0.9872 0.7951 1.0327 0.1427 -0.1334 -0.0171 280 LEU A C
|
|
378 O O . LEU A 78 ? 0.9796 0.8009 1.0384 0.1376 -0.1285 -0.0140 280 LEU A O
|
|
379 C CB . LEU A 78 ? 0.9967 0.8031 0.9271 0.1636 -0.1302 -0.0190 280 LEU A CB
|
|
380 C CG . LEU A 78 ? 1.0903 0.9074 0.9735 0.1920 -0.1360 -0.0310 280 LEU A CG
|
|
381 C CD1 . LEU A 78 ? 1.1125 0.9224 0.9361 0.1878 -0.1118 -0.0017 280 LEU A CD1
|
|
382 C CD2 . LEU A 78 ? 1.1279 0.9352 1.0188 0.2028 -0.1483 -0.0430 280 LEU A CD2
|
|
383 N N . ASN A 79 ? 0.9073 0.6980 0.9703 0.1320 -0.1273 0.0000 281 ASN A N
|
|
384 C CA . ASN A 79 ? 0.8663 0.6576 0.9630 0.1178 -0.1133 0.0254 281 ASN A CA
|
|
385 C C . ASN A 79 ? 0.8689 0.6448 0.9437 0.1079 -0.1030 0.0482 281 ASN A C
|
|
386 O O . ASN A 79 ? 0.8451 0.6108 0.9568 0.1111 -0.1060 0.0512 281 ASN A O
|
|
387 C CB . ASN A 79 ? 0.8430 0.6424 1.0309 0.1249 -0.1191 0.0180 281 ASN A CB
|
|
388 C CG . ASN A 79 ? 1.1286 0.9366 1.3527 0.1174 -0.1007 0.0497 281 ASN A CG
|
|
389 O OD1 . ASN A 79 ? 1.0994 0.9169 1.2815 0.1087 -0.0878 0.0681 281 ASN A OD1
|
|
390 N ND2 . ASN A 79 ? 1.0211 0.8296 1.3294 0.1237 -0.0977 0.0570 281 ASN A ND2
|
|
391 N N . HIS A 80 ? 0.8073 0.5829 0.8271 0.0967 -0.0909 0.0618 282 HIS A N
|
|
392 C CA . HIS A 80 ? 0.7976 0.5640 0.7959 0.0880 -0.0822 0.0785 282 HIS A CA
|
|
393 C C . HIS A 80 ? 0.8472 0.6291 0.8209 0.0774 -0.0688 0.0903 282 HIS A C
|
|
394 O O . HIS A 80 ? 0.8220 0.6114 0.7753 0.0742 -0.0655 0.0840 282 HIS A O
|
|
395 C CB . HIS A 80 ? 0.8298 0.5758 0.7891 0.0893 -0.0863 0.0709 282 HIS A CB
|
|
396 C CG . HIS A 80 ? 0.8779 0.6117 0.8277 0.0825 -0.0816 0.0834 282 HIS A CG
|
|
397 N ND1 . HIS A 80 ? 0.9072 0.6422 0.8254 0.0711 -0.0703 0.0917 282 HIS A ND1
|
|
398 C CD2 . HIS A 80 ? 0.9023 0.6233 0.8734 0.0867 -0.0877 0.0855 282 HIS A CD2
|
|
399 C CE1 . HIS A 80 ? 0.8993 0.6235 0.8172 0.0692 -0.0706 0.0982 282 HIS A CE1
|
|
400 N NE2 . HIS A 80 ? 0.8996 0.6141 0.8457 0.0780 -0.0802 0.0969 282 HIS A NE2
|
|
401 N N . PRO A 81 ? 0.8359 0.6278 0.8142 0.0749 -0.0613 0.1054 283 PRO A N
|
|
402 C CA . PRO A 81 ? 0.8351 0.6505 0.7951 0.0689 -0.0517 0.1087 283 PRO A CA
|
|
403 C C . PRO A 81 ? 0.9046 0.7109 0.8280 0.0574 -0.0477 0.0974 283 PRO A C
|
|
404 O O . PRO A 81 ? 0.9148 0.7408 0.8323 0.0521 -0.0411 0.0927 283 PRO A O
|
|
405 C CB . PRO A 81 ? 0.8458 0.6793 0.8197 0.0763 -0.0472 0.1243 283 PRO A CB
|
|
406 C CG . PRO A 81 ? 0.9050 0.7123 0.8870 0.0784 -0.0530 0.1278 283 PRO A CG
|
|
407 C CD . PRO A 81 ? 0.8493 0.6372 0.8522 0.0808 -0.0615 0.1185 283 PRO A CD
|
|
408 N N . CYS A 82 ? 0.8505 0.6291 0.7559 0.0555 -0.0503 0.0934 284 CYS A N
|
|
409 C CA . CYS A 82 ? 0.8454 0.6130 0.7269 0.0470 -0.0416 0.0887 284 CYS A CA
|
|
410 C C . CYS A 82 ? 0.8460 0.6023 0.7101 0.0523 -0.0393 0.0862 284 CYS A C
|
|
411 O O . CYS A 82 ? 0.8464 0.5900 0.6938 0.0511 -0.0292 0.0890 284 CYS A O
|
|
412 C CB . CYS A 82 ? 0.8589 0.6098 0.7332 0.0435 -0.0409 0.0910 284 CYS A CB
|
|
413 S SG . CYS A 82 ? 0.8955 0.6683 0.7866 0.0433 -0.0437 0.0935 284 CYS A SG
|
|
414 N N . ILE A 83 ? 0.7875 0.5527 0.6595 0.0610 -0.0471 0.0819 285 ILE A N
|
|
415 C CA . ILE A 83 ? 0.8083 0.5735 0.6639 0.0716 -0.0472 0.0768 285 ILE A CA
|
|
416 C C . ILE A 83 ? 0.8624 0.6479 0.7303 0.0693 -0.0462 0.0734 285 ILE A C
|
|
417 O O . ILE A 83 ? 0.8669 0.6635 0.7628 0.0704 -0.0544 0.0712 285 ILE A O
|
|
418 C CB . ILE A 83 ? 0.8516 0.6106 0.7060 0.0905 -0.0626 0.0666 285 ILE A CB
|
|
419 C CG1 . ILE A 83 ? 0.8615 0.6013 0.6947 0.0948 -0.0609 0.0711 285 ILE A CG1
|
|
420 C CG2 . ILE A 83 ? 0.8748 0.6473 0.7142 0.1078 -0.0656 0.0570 285 ILE A CG2
|
|
421 C CD1 . ILE A 83 ? 0.9219 0.6570 0.7668 0.1083 -0.0778 0.0592 285 ILE A CD1
|
|
422 N N . ILE A 84 ? 0.8202 0.6110 0.6725 0.0672 -0.0340 0.0753 286 ILE A N
|
|
423 C CA . ILE A 84 ? 0.8118 0.6214 0.6721 0.0652 -0.0323 0.0716 286 ILE A CA
|
|
424 C C . ILE A 84 ? 0.8815 0.7013 0.7549 0.0789 -0.0479 0.0610 286 ILE A C
|
|
425 O O . ILE A 84 ? 0.9031 0.7183 0.7702 0.0950 -0.0584 0.0526 286 ILE A O
|
|
426 C CB . ILE A 84 ? 0.8561 0.6663 0.7000 0.0634 -0.0145 0.0772 286 ILE A CB
|
|
427 C CG1 . ILE A 84 ? 0.8424 0.6709 0.7005 0.0528 -0.0087 0.0737 286 ILE A CG1
|
|
428 C CG2 . ILE A 84 ? 0.8753 0.6837 0.6931 0.0844 -0.0130 0.0800 286 ILE A CG2
|
|
429 C CD1 . ILE A 84 ? 0.9065 0.7429 0.7840 0.0374 -0.0036 0.0705 286 ILE A CD1
|
|
430 N N . LYS A 85 ? 0.8229 0.6598 0.7197 0.0744 -0.0499 0.0590 287 LYS A N
|
|
431 C CA . LYS A 85 ? 0.8131 0.6611 0.7372 0.0856 -0.0633 0.0474 287 LYS A CA
|
|
432 C C . LYS A 85 ? 0.8562 0.7195 0.7715 0.0884 -0.0611 0.0417 287 LYS A C
|
|
433 O O . LYS A 85 ? 0.8404 0.7113 0.7478 0.0767 -0.0490 0.0493 287 LYS A O
|
|
434 C CB . LYS A 85 ? 0.8220 0.6786 0.7925 0.0818 -0.0655 0.0538 287 LYS A CB
|
|
435 C CG . LYS A 85 ? 1.0120 0.8560 1.0092 0.0868 -0.0728 0.0552 287 LYS A CG
|
|
436 C CD . LYS A 85 ? 1.0265 0.8809 1.0613 0.0841 -0.0655 0.0736 287 LYS A CD
|
|
437 C CE . LYS A 85 ? 1.0902 0.9318 1.1557 0.0895 -0.0696 0.0790 287 LYS A CE
|
|
438 N NZ . LYS A 85 ? 1.2103 1.0393 1.2373 0.0833 -0.0655 0.0862 287 LYS A NZ
|
|
439 N N . ILE A 86 ? 0.8386 0.7100 0.7582 0.1059 -0.0740 0.0249 288 ILE A N
|
|
440 C CA . ILE A 86 ? 0.8495 0.7390 0.7630 0.1126 -0.0747 0.0168 288 ILE A CA
|
|
441 C C . ILE A 86 ? 0.8631 0.7643 0.8244 0.1043 -0.0783 0.0150 288 ILE A C
|
|
442 O O . ILE A 86 ? 0.8398 0.7399 0.8477 0.1066 -0.0873 0.0106 288 ILE A O
|
|
443 C CB . ILE A 86 ? 0.9151 0.8184 0.8201 0.1406 -0.0907 -0.0059 288 ILE A CB
|
|
444 C CG1 . ILE A 86 ? 0.9757 0.8705 0.8401 0.1556 -0.0881 -0.0021 288 ILE A CG1
|
|
445 C CG2 . ILE A 86 ? 0.9058 0.8307 0.7951 0.1507 -0.0896 -0.0123 288 ILE A CG2
|
|
446 C CD1 . ILE A 86 ? 1.2029 1.1006 1.0150 0.1642 -0.0676 0.0166 288 ILE A CD1
|
|
447 N N . LYS A 87 ? 0.8106 0.7235 0.7651 0.0959 -0.0691 0.0207 289 LYS A N
|
|
448 C CA . LYS A 87 ? 0.7814 0.7092 0.7776 0.0905 -0.0692 0.0227 289 LYS A CA
|
|
449 C C . LYS A 87 ? 0.8288 0.7727 0.8366 0.1012 -0.0789 0.0048 289 LYS A C
|
|
450 O O . LYS A 87 ? 0.8151 0.7701 0.8755 0.1038 -0.0855 -0.0017 289 LYS A O
|
|
451 C CB . LYS A 87 ? 0.7934 0.7285 0.7752 0.0752 -0.0530 0.0394 289 LYS A CB
|
|
452 C CG . LYS A 87 ? 0.7742 0.7054 0.7595 0.0686 -0.0460 0.0537 289 LYS A CG
|
|
453 C CD . LYS A 87 ? 0.9548 0.9045 0.9303 0.0597 -0.0339 0.0614 289 LYS A CD
|
|
454 C CE . LYS A 87 ? 1.1547 1.1250 1.1610 0.0649 -0.0298 0.0761 289 LYS A CE
|
|
455 N NZ . LYS A 87 ? 1.3228 1.3098 1.3669 0.0718 -0.0297 0.0812 289 LYS A NZ
|
|
456 N N . ASN A 88 ? 0.8051 0.7521 0.7678 0.1095 -0.0780 -0.0014 290 ASN A N
|
|
457 C CA . ASN A 88 ? 0.8064 0.7733 0.7682 0.1241 -0.0871 -0.0192 290 ASN A CA
|
|
458 C C . ASN A 88 ? 0.8722 0.8436 0.7802 0.1430 -0.0848 -0.0213 290 ASN A C
|
|
459 O O . ASN A 88 ? 0.8846 0.8409 0.7578 0.1404 -0.0710 -0.0041 290 ASN A O
|
|
460 C CB . ASN A 88 ? 0.8022 0.7801 0.7709 0.1107 -0.0776 -0.0113 290 ASN A CB
|
|
461 C CG . ASN A 88 ? 1.0251 1.0234 1.0338 0.1199 -0.0912 -0.0310 290 ASN A CG
|
|
462 O OD1 . ASN A 88 ? 1.1044 1.1148 1.1303 0.1402 -0.1095 -0.0568 290 ASN A OD1
|
|
463 N ND2 . ASN A 88 ? 0.8148 0.8214 0.8417 0.1071 -0.0831 -0.0220 290 ASN A ND2
|
|
464 N N . PHE A 89 ? 0.8365 0.8323 0.7410 0.1653 -0.0968 -0.0413 291 PHE A N
|
|
465 C CA . PHE A 89 ? 0.8514 0.8623 0.7048 0.1927 -0.0935 -0.0411 291 PHE A CA
|
|
466 C C . PHE A 89 ? 0.8604 0.9006 0.7082 0.2085 -0.0987 -0.0541 291 PHE A C
|
|
467 O O . PHE A 89 ? 0.8133 0.8707 0.7044 0.2126 -0.1187 -0.0816 291 PHE A O
|
|
468 C CB . PHE A 89 ? 0.8966 0.9164 0.7436 0.2213 -0.1101 -0.0599 291 PHE A CB
|
|
469 C CG . PHE A 89 ? 0.9710 1.0193 0.7665 0.2610 -0.1088 -0.0618 291 PHE A CG
|
|
470 C CD1 . PHE A 89 ? 1.0417 1.0801 0.7869 0.2665 -0.0817 -0.0268 291 PHE A CD1
|
|
471 C CD2 . PHE A 89 ? 1.0187 1.1086 0.8207 0.2964 -0.1330 -0.0980 291 PHE A CD2
|
|
472 C CE1 . PHE A 89 ? 1.0939 1.1638 0.7919 0.3091 -0.0751 -0.0207 291 PHE A CE1
|
|
473 C CE2 . PHE A 89 ? 1.0930 1.2187 0.8420 0.3405 -0.1305 -0.0976 291 PHE A CE2
|
|
474 C CZ . PHE A 89 ? 1.0966 1.2122 0.7919 0.3479 -0.0999 -0.0555 291 PHE A CZ
|
|
475 N N . PHE A 90 ? 0.8432 0.8898 0.6433 0.2187 -0.0792 -0.0333 292 PHE A N
|
|
476 C CA . PHE A 90 ? 0.8526 0.9282 0.6367 0.2371 -0.0795 -0.0393 292 PHE A CA
|
|
477 C C . PHE A 90 ? 0.9972 1.0985 0.7283 0.2796 -0.0713 -0.0302 292 PHE A C
|
|
478 O O . PHE A 90 ? 1.0025 1.0894 0.7022 0.2808 -0.0439 0.0043 292 PHE A O
|
|
479 C CB . PHE A 90 ? 0.8500 0.9122 0.6364 0.2078 -0.0586 -0.0174 292 PHE A CB
|
|
480 C CG . PHE A 90 ? 0.8281 0.8759 0.6624 0.1744 -0.0656 -0.0246 292 PHE A CG
|
|
481 C CD1 . PHE A 90 ? 0.8278 0.8939 0.6980 0.1747 -0.0827 -0.0472 292 PHE A CD1
|
|
482 C CD2 . PHE A 90 ? 0.8173 0.8380 0.6634 0.1464 -0.0537 -0.0077 292 PHE A CD2
|
|
483 C CE1 . PHE A 90 ? 0.7940 0.8504 0.7107 0.1491 -0.0845 -0.0472 292 PHE A CE1
|
|
484 C CE2 . PHE A 90 ? 0.8114 0.8273 0.6983 0.1236 -0.0578 -0.0102 292 PHE A CE2
|
|
485 C CZ . PHE A 90 ? 0.7631 0.7963 0.6851 0.1259 -0.0716 -0.0272 292 PHE A CZ
|
|
486 N N . ASP A 91 ? 1.0136 1.1571 0.7407 0.3181 -0.0952 -0.0625 293 ASP A N
|
|
487 C CA . ASP A 91 ? 1.0768 1.2605 0.7523 0.3702 -0.0917 -0.0591 293 ASP A CA
|
|
488 C C . ASP A 91 ? 1.1760 1.3848 0.8336 0.3823 -0.0824 -0.0518 293 ASP A C
|
|
489 O O . ASP A 91 ? 1.1908 1.4367 0.8627 0.4028 -0.1083 -0.0892 293 ASP A O
|
|
490 C CB . ASP A 91 ? 1.1166 1.3401 0.8032 0.4099 -0.1285 -0.1081 293 ASP A CB
|
|
491 C CG . ASP A 91 ? 1.3101 1.5868 0.9406 0.4742 -0.1297 -0.1105 293 ASP A CG
|
|
492 O OD1 . ASP A 91 ? 1.3362 1.6180 0.9164 0.4910 -0.0968 -0.0659 293 ASP A OD1
|
|
493 O OD2 . ASP A 91 ? 1.3927 1.7094 1.0342 0.5108 -0.1626 -0.1572 293 ASP A OD2
|
|
494 N N . ALA A 92 ? 1.1334 1.3206 0.7695 0.3666 -0.0452 -0.0055 294 ALA A N
|
|
495 C CA . ALA A 92 ? 1.1336 1.3363 0.7544 0.3726 -0.0280 0.0115 294 ALA A CA
|
|
496 C C . ALA A 92 ? 1.2195 1.4464 0.7897 0.4175 0.0033 0.0514 294 ALA A C
|
|
497 O O . ALA A 92 ? 1.2439 1.4967 0.7851 0.4589 -0.0018 0.0492 294 ALA A O
|
|
498 C CB . ALA A 92 ? 1.1102 1.2695 0.7606 0.3189 -0.0080 0.0323 294 ALA A CB
|
|
499 N N . GLU A 93 ? 1.1720 1.3921 0.7358 0.4117 0.0379 0.0899 295 GLU A N
|
|
500 C CA . GLU A 93 ? 1.2137 1.4540 0.7415 0.4538 0.0764 0.1381 295 GLU A CA
|
|
501 C C . GLU A 93 ? 1.2750 1.4829 0.8077 0.4457 0.1017 0.1705 295 GLU A C
|
|
502 O O . GLU A 93 ? 1.3176 1.5430 0.8240 0.4860 0.1326 0.2110 295 GLU A O
|
|
503 C CB . GLU A 93 ? 1.2332 1.4682 0.7701 0.4436 0.1089 0.1710 295 GLU A CB
|
|
504 N N . ASP A 94 ? 1.1816 1.3453 0.7501 0.3956 0.0882 0.1526 296 ASP A N
|
|
505 C CA . ASP A 94 ? 1.1592 1.2878 0.7415 0.3772 0.1013 0.1693 296 ASP A CA
|
|
506 C C . ASP A 94 ? 1.1260 1.2395 0.7260 0.3513 0.0616 0.1252 296 ASP A C
|
|
507 O O . ASP A 94 ? 1.0815 1.2012 0.6986 0.3357 0.0332 0.0902 296 ASP A O
|
|
508 C CB . ASP A 94 ? 1.1683 1.2531 0.7943 0.3324 0.1351 0.1988 296 ASP A CB
|
|
509 C CG . ASP A 94 ? 1.3711 1.4630 1.0012 0.3511 0.1807 0.2462 296 ASP A CG
|
|
510 O OD1 . ASP A 94 ? 1.4475 1.5665 1.0461 0.4010 0.2026 0.2785 296 ASP A OD1
|
|
511 O OD2 . ASP A 94 ? 1.4057 1.4780 1.0749 0.3181 0.1966 0.2528 296 ASP A OD2
|
|
512 N N . TYR A 95 ? 1.0810 1.1752 0.6820 0.3475 0.0617 0.1293 297 TYR A N
|
|
513 C CA . TYR A 95 ? 1.0510 1.1269 0.6754 0.3216 0.0298 0.0944 297 TYR A CA
|
|
514 C C . TYR A 95 ? 1.0543 1.0868 0.7198 0.2661 0.0395 0.1008 297 TYR A C
|
|
515 O O . TYR A 95 ? 1.0477 1.0598 0.7232 0.2519 0.0717 0.1325 297 TYR A O
|
|
516 C CB . TYR A 95 ? 1.0911 1.1666 0.6973 0.3433 0.0260 0.0962 297 TYR A CB
|
|
517 C CG . TYR A 95 ? 1.1618 1.2885 0.7293 0.4024 0.0086 0.0789 297 TYR A CG
|
|
518 C CD1 . TYR A 95 ? 1.1751 1.3302 0.7542 0.4154 -0.0328 0.0276 297 TYR A CD1
|
|
519 C CD2 . TYR A 95 ? 1.2272 1.3785 0.7522 0.4491 0.0339 0.1124 297 TYR A CD2
|
|
520 C CE1 . TYR A 95 ? 1.2233 1.4337 0.7719 0.4740 -0.0529 0.0025 297 TYR A CE1
|
|
521 C CE2 . TYR A 95 ? 1.2798 1.4889 0.7647 0.5114 0.0165 0.0937 297 TYR A CE2
|
|
522 C CZ . TYR A 95 ? 1.3700 1.6100 0.8664 0.5238 -0.0294 0.0347 297 TYR A CZ
|
|
523 O OH . TYR A 95 ? 1.4117 1.7161 0.8740 0.5886 -0.0508 0.0071 297 TYR A OH
|
|
524 N N . TYR A 96 ? 0.9762 0.9996 0.6715 0.2382 0.0129 0.0705 298 TYR A N
|
|
525 C CA . TYR A 96 ? 0.9408 0.9337 0.6716 0.1929 0.0181 0.0726 298 TYR A CA
|
|
526 C C . TYR A 96 ? 0.9830 0.9630 0.7332 0.1805 -0.0043 0.0533 298 TYR A C
|
|
527 O O . TYR A 96 ? 0.9683 0.9621 0.7332 0.1874 -0.0307 0.0264 298 TYR A O
|
|
528 C CB . TYR A 96 ? 0.9279 0.9274 0.6785 0.1734 0.0153 0.0635 298 TYR A CB
|
|
529 C CG . TYR A 96 ? 0.9585 0.9663 0.6976 0.1803 0.0409 0.0850 298 TYR A CG
|
|
530 C CD1 . TYR A 96 ? 0.9945 1.0326 0.7047 0.2159 0.0400 0.0860 298 TYR A CD1
|
|
531 C CD2 . TYR A 96 ? 0.9600 0.9495 0.7231 0.1533 0.0654 0.1016 298 TYR A CD2
|
|
532 C CE1 . TYR A 96 ? 1.0157 1.0622 0.7178 0.2246 0.0667 0.1102 298 TYR A CE1
|
|
533 C CE2 . TYR A 96 ? 0.9886 0.9848 0.7526 0.1588 0.0907 0.1212 298 TYR A CE2
|
|
534 C CZ . TYR A 96 ? 1.1006 1.1237 0.8327 0.1945 0.0931 0.1290 298 TYR A CZ
|
|
535 O OH . TYR A 96 ? 1.0975 1.1281 0.8319 0.2032 0.1214 0.1535 298 TYR A OH
|
|
536 N N . ILE A 97 ? 0.9455 0.9003 0.7016 0.1643 0.0071 0.0670 299 ILE A N
|
|
537 C CA . ILE A 97 ? 0.9227 0.8636 0.6969 0.1527 -0.0103 0.0540 299 ILE A CA
|
|
538 C C . ILE A 97 ? 0.9154 0.8401 0.7195 0.1179 -0.0055 0.0565 299 ILE A C
|
|
539 O O . ILE A 97 ? 0.9032 0.8143 0.7106 0.1032 0.0143 0.0715 299 ILE A O
|
|
540 C CB . ILE A 97 ? 0.9860 0.9177 0.7397 0.1698 -0.0077 0.0619 299 ILE A CB
|
|
541 C CG1 . ILE A 97 ? 1.0291 0.9889 0.7504 0.2132 -0.0162 0.0546 299 ILE A CG1
|
|
542 C CG2 . ILE A 97 ? 0.9611 0.8781 0.7376 0.1566 -0.0257 0.0482 299 ILE A CG2
|
|
543 C CD1 . ILE A 97 ? 1.1965 1.1534 0.8884 0.2370 -0.0048 0.0714 299 ILE A CD1
|
|
544 N N . VAL A 98 ? 0.8375 0.7684 0.6688 0.1083 -0.0232 0.0409 300 VAL A N
|
|
545 C CA . VAL A 98 ? 0.7953 0.7226 0.6535 0.0839 -0.0213 0.0425 300 VAL A CA
|
|
546 C C . VAL A 98 ? 0.8509 0.7635 0.7188 0.0795 -0.0266 0.0442 300 VAL A C
|
|
547 O O . VAL A 98 ? 0.8376 0.7492 0.7186 0.0897 -0.0424 0.0353 300 VAL A O
|
|
548 C CB . VAL A 98 ? 0.7967 0.7417 0.6814 0.0806 -0.0318 0.0325 300 VAL A CB
|
|
549 C CG1 . VAL A 98 ? 0.7649 0.7153 0.6713 0.0626 -0.0263 0.0381 300 VAL A CG1
|
|
550 C CG2 . VAL A 98 ? 0.7952 0.7545 0.6665 0.0874 -0.0280 0.0294 300 VAL A CG2
|
|
551 N N . LEU A 99 ? 0.8100 0.7125 0.6759 0.0655 -0.0131 0.0536 301 LEU A N
|
|
552 C CA . LEU A 99 ? 0.8077 0.6968 0.6788 0.0607 -0.0153 0.0567 301 LEU A CA
|
|
553 C C . LEU A 99 ? 0.8601 0.7598 0.7515 0.0460 -0.0126 0.0565 301 LEU A C
|
|
554 O O . LEU A 99 ? 0.8700 0.7862 0.7690 0.0388 -0.0066 0.0532 301 LEU A O
|
|
555 C CB . LEU A 99 ? 0.8261 0.6975 0.6779 0.0628 -0.0013 0.0664 301 LEU A CB
|
|
556 C CG . LEU A 99 ? 0.8877 0.7566 0.7125 0.0855 -0.0005 0.0707 301 LEU A CG
|
|
557 C CD1 . LEU A 99 ? 0.9063 0.7687 0.7205 0.0879 0.0249 0.0881 301 LEU A CD1
|
|
558 C CD2 . LEU A 99 ? 0.8577 0.7186 0.6747 0.0997 -0.0159 0.0651 301 LEU A CD2
|
|
559 N N . GLU A 100 ? 0.9681 0.8614 0.8727 0.2144 -0.1496 -0.0816 302 GLU A N
|
|
560 C CA . GLU A 100 ? 0.9796 0.8671 0.8607 0.2177 -0.1649 -0.0718 302 GLU A CA
|
|
561 C C . GLU A 100 ? 0.9400 0.8830 0.8459 0.2061 -0.1647 -0.0832 302 GLU A C
|
|
562 O O . GLU A 100 ? 0.9025 0.8683 0.8290 0.1848 -0.1468 -0.0897 302 GLU A O
|
|
563 C CB . GLU A 100 ? 1.0300 0.8624 0.8648 0.2042 -0.1605 -0.0502 302 GLU A CB
|
|
564 C CG . GLU A 100 ? 1.1339 0.9617 0.9649 0.1738 -0.1376 -0.0463 302 GLU A CG
|
|
565 C CD . GLU A 100 ? 1.4137 1.1874 1.2108 0.1623 -0.1292 -0.0270 302 GLU A CD
|
|
566 O OE1 . GLU A 100 ? 1.3849 1.1180 1.1530 0.1746 -0.1412 -0.0124 302 GLU A OE1
|
|
567 O OE2 . GLU A 100 ? 1.2990 1.0719 1.1001 0.1405 -0.1106 -0.0256 302 GLU A OE2
|
|
568 N N . LEU A 101 ? 0.8703 0.8363 0.7772 0.2212 -0.1859 -0.0866 303 LEU A N
|
|
569 C CA . LEU A 101 ? 0.8255 0.8442 0.7578 0.2112 -0.1909 -0.0998 303 LEU A CA
|
|
570 C C . LEU A 101 ? 0.8806 0.8839 0.7831 0.1897 -0.1867 -0.0938 303 LEU A C
|
|
571 O O . LEU A 101 ? 0.9142 0.8818 0.7718 0.1953 -0.1956 -0.0801 303 LEU A O
|
|
572 C CB . LEU A 101 ? 0.8448 0.8992 0.7928 0.2369 -0.2178 -0.1082 303 LEU A CB
|
|
573 C CG . LEU A 101 ? 0.8822 0.9939 0.8600 0.2252 -0.2265 -0.1239 303 LEU A CG
|
|
574 C CD1 . LEU A 101 ? 0.8486 1.0136 0.8842 0.2131 -0.2120 -0.1395 303 LEU A CD1
|
|
575 C CD2 . LEU A 101 ? 0.9223 1.0587 0.9000 0.2500 -0.2574 -0.1279 303 LEU A CD2
|
|
576 N N . MET A 102 ? 0.8064 0.8383 0.7341 0.1660 -0.1732 -0.1045 304 MET A N
|
|
577 C CA . MET A 102 ? 0.7894 0.8115 0.6969 0.1446 -0.1664 -0.1041 304 MET A CA
|
|
578 C C . MET A 102 ? 0.8785 0.9451 0.8093 0.1393 -0.1809 -0.1217 304 MET A C
|
|
579 O O . MET A 102 ? 0.8572 0.9574 0.8295 0.1230 -0.1721 -0.1340 304 MET A O
|
|
580 C CB . MET A 102 ? 0.7643 0.7758 0.6820 0.1219 -0.1392 -0.1018 304 MET A CB
|
|
581 C CG . MET A 102 ? 0.7941 0.7637 0.6892 0.1245 -0.1269 -0.0861 304 MET A CG
|
|
582 S SD . MET A 102 ? 0.8765 0.7948 0.7109 0.1263 -0.1297 -0.0671 304 MET A SD
|
|
583 C CE . MET A 102 ? 0.8063 0.7234 0.6356 0.1002 -0.1095 -0.0691 304 MET A CE
|
|
584 N N . GLU A 103 ? 0.8798 0.9466 0.7836 0.1526 -0.2041 -0.1224 305 GLU A N
|
|
585 C CA . GLU A 103 ? 0.8928 1.0027 0.8159 0.1498 -0.2238 -0.1410 305 GLU A CA
|
|
586 C C . GLU A 103 ? 0.9436 1.0644 0.8788 0.1217 -0.2152 -0.1556 305 GLU A C
|
|
587 O O . GLU A 103 ? 0.9350 1.0985 0.9058 0.1138 -0.2278 -0.1740 305 GLU A O
|
|
588 C CB . GLU A 103 ? 0.9651 1.0717 0.8514 0.1728 -0.2523 -0.1375 305 GLU A CB
|
|
589 C CG . GLU A 103 ? 1.1418 1.2687 1.0479 0.2015 -0.2700 -0.1351 305 GLU A CG
|
|
590 C CD . GLU A 103 ? 1.5092 1.6048 1.3643 0.2287 -0.2905 -0.1185 305 GLU A CD
|
|
591 O OE1 . GLU A 103 ? 1.5219 1.6393 1.3630 0.2393 -0.3165 -0.1249 305 GLU A OE1
|
|
592 O OE2 . GLU A 103 ? 1.4312 1.4797 1.2598 0.2390 -0.2813 -0.0986 305 GLU A OE2
|
|
593 N N . GLY A 104 ? 0.9163 0.9994 0.8265 0.1066 -0.1938 -0.1479 306 GLY A N
|
|
594 C CA . GLY A 104 ? 0.9085 0.9930 0.8281 0.0822 -0.1839 -0.1608 306 GLY A CA
|
|
595 C C . GLY A 104 ? 0.9075 1.0165 0.8825 0.0636 -0.1683 -0.1672 306 GLY A C
|
|
596 O O . GLY A 104 ? 0.9039 1.0204 0.8978 0.0431 -0.1647 -0.1803 306 GLY A O
|
|
597 N N . GLY A 105 ? 0.8067 0.9260 0.8055 0.0709 -0.1589 -0.1579 307 GLY A N
|
|
598 C CA . GLY A 105 ? 0.7562 0.9020 0.8041 0.0560 -0.1426 -0.1606 307 GLY A CA
|
|
599 C C . GLY A 105 ? 0.7812 0.8951 0.8204 0.0405 -0.1168 -0.1504 307 GLY A C
|
|
600 O O . GLY A 105 ? 0.8004 0.8747 0.7999 0.0460 -0.1094 -0.1385 307 GLY A O
|
|
601 N N . GLU A 106 ? 0.7085 0.8408 0.7857 0.0209 -0.1030 -0.1537 308 GLU A N
|
|
602 C CA . GLU A 106 ? 0.6836 0.7894 0.7568 0.0069 -0.0794 -0.1433 308 GLU A CA
|
|
603 C C . GLU A 106 ? 0.7828 0.8616 0.8395 -0.0072 -0.0784 -0.1497 308 GLU A C
|
|
604 O O . GLU A 106 ? 0.8100 0.9017 0.8774 -0.0151 -0.0928 -0.1657 308 GLU A O
|
|
605 C CB . GLU A 106 ? 0.6731 0.8097 0.7925 -0.0073 -0.0647 -0.1415 308 GLU A CB
|
|
606 C CG . GLU A 106 ? 0.7240 0.8933 0.8641 0.0061 -0.0618 -0.1377 308 GLU A CG
|
|
607 C CD . GLU A 106 ? 1.0101 1.2192 1.1968 -0.0088 -0.0477 -0.1370 308 GLU A CD
|
|
608 O OE1 . GLU A 106 ? 0.7353 0.9419 0.9393 -0.0319 -0.0395 -0.1367 308 GLU A OE1
|
|
609 O OE2 . GLU A 106 ? 1.0565 1.2983 1.2617 0.0030 -0.0439 -0.1361 308 GLU A OE2
|
|
610 N N . LEU A 107 ? 0.7336 0.7769 0.7673 -0.0106 -0.0614 -0.1389 309 LEU A N
|
|
611 C CA . LEU A 107 ? 0.7427 0.7578 0.7610 -0.0211 -0.0567 -0.1447 309 LEU A CA
|
|
612 C C . LEU A 107 ? 0.8313 0.8572 0.8901 -0.0424 -0.0518 -0.1522 309 LEU A C
|
|
613 O O . LEU A 107 ? 0.8562 0.8679 0.9134 -0.0526 -0.0570 -0.1660 309 LEU A O
|
|
614 C CB . LEU A 107 ? 0.7261 0.7094 0.7188 -0.0177 -0.0385 -0.1296 309 LEU A CB
|
|
615 C CG . LEU A 107 ? 0.7870 0.7409 0.7633 -0.0242 -0.0305 -0.1342 309 LEU A CG
|
|
616 C CD1 . LEU A 107 ? 0.8219 0.7653 0.7637 -0.0171 -0.0445 -0.1479 309 LEU A CD1
|
|
617 C CD2 . LEU A 107 ? 0.7724 0.7059 0.7351 -0.0209 -0.0118 -0.1178 309 LEU A CD2
|
|
618 N N . PHE A 108 ? 0.7699 0.8207 0.8641 -0.0492 -0.0418 -0.1433 310 PHE A N
|
|
619 C CA . PHE A 108 ? 0.7584 0.8229 0.8943 -0.0710 -0.0348 -0.1452 310 PHE A CA
|
|
620 C C . PHE A 108 ? 0.8400 0.9210 0.9976 -0.0835 -0.0533 -0.1662 310 PHE A C
|
|
621 O O . PHE A 108 ? 0.8557 0.9204 1.0285 -0.1026 -0.0509 -0.1729 310 PHE A O
|
|
622 C CB . PHE A 108 ? 0.7422 0.8429 0.9091 -0.0720 -0.0238 -0.1332 310 PHE A CB
|
|
623 C CG . PHE A 108 ? 0.7478 0.8697 0.9599 -0.0956 -0.0150 -0.1316 310 PHE A CG
|
|
624 C CD1 . PHE A 108 ? 0.7741 0.8697 0.9897 -0.1096 0.0026 -0.1187 310 PHE A CD1
|
|
625 C CD2 . PHE A 108 ? 0.7756 0.9458 1.0285 -0.1037 -0.0241 -0.1413 310 PHE A CD2
|
|
626 C CE1 . PHE A 108 ? 0.7897 0.9021 1.0462 -0.1329 0.0120 -0.1134 310 PHE A CE1
|
|
627 C CE2 . PHE A 108 ? 0.8038 0.9963 1.1013 -0.1284 -0.0138 -0.1372 310 PHE A CE2
|
|
628 C CZ . PHE A 108 ? 0.7780 0.9390 1.0757 -0.1437 0.0046 -0.1223 310 PHE A CZ
|
|
629 N N . ASP A 109 ? 0.8048 0.9154 0.9625 -0.0720 -0.0734 -0.1772 311 ASP A N
|
|
630 C CA . ASP A 109 ? 0.8218 0.9561 1.0001 -0.0815 -0.0956 -0.1991 311 ASP A CA
|
|
631 C C . ASP A 109 ? 0.8843 0.9820 1.0295 -0.0842 -0.1071 -0.2158 311 ASP A C
|
|
632 O O . ASP A 109 ? 0.9124 1.0235 1.0756 -0.0968 -0.1247 -0.2365 311 ASP A O
|
|
633 C CB . ASP A 109 ? 0.8497 1.0278 1.0353 -0.0639 -0.1150 -0.2046 311 ASP A CB
|
|
634 C CG . ASP A 109 ? 1.0255 1.2422 1.2429 -0.0576 -0.1042 -0.1919 311 ASP A CG
|
|
635 O OD1 . ASP A 109 ? 1.0313 1.2837 1.2985 -0.0758 -0.0975 -0.1931 311 ASP A OD1
|
|
636 O OD2 . ASP A 109 ? 1.1317 1.3432 1.3241 -0.0345 -0.1024 -0.1814 311 ASP A OD2
|
|
637 N N . LYS A 110 ? 0.8233 0.8776 0.9219 -0.0727 -0.0968 -0.2081 312 LYS A N
|
|
638 C CA . LYS A 110 ? 0.8386 0.8569 0.9000 -0.0713 -0.1026 -0.2227 312 LYS A CA
|
|
639 C C . LYS A 110 ? 0.9231 0.9048 0.9931 -0.0871 -0.0856 -0.2228 312 LYS A C
|
|
640 O O . LYS A 110 ? 0.9467 0.8998 0.9966 -0.0896 -0.0907 -0.2400 312 LYS A O
|
|
641 C CB . LYS A 110 ? 0.8412 0.8398 0.8469 -0.0477 -0.1009 -0.2135 312 LYS A CB
|
|
642 C CG . LYS A 110 ? 0.9029 0.9283 0.8945 -0.0295 -0.1176 -0.2098 312 LYS A CG
|
|
643 C CD . LYS A 110 ? 0.9214 0.9607 0.8944 -0.0237 -0.1454 -0.2307 312 LYS A CD
|
|
644 N N . VAL A 111 ? 0.8839 0.8661 0.9824 -0.0963 -0.0663 -0.2041 313 VAL A N
|
|
645 C CA . VAL A 111 ? 0.9000 0.8462 1.0071 -0.1086 -0.0496 -0.1988 313 VAL A CA
|
|
646 C C . VAL A 111 ? 0.9884 0.9432 1.1471 -0.1352 -0.0461 -0.1983 313 VAL A C
|
|
647 O O . VAL A 111 ? 1.0004 0.9188 1.1655 -0.1465 -0.0365 -0.1971 313 VAL A O
|
|
648 C CB . VAL A 111 ? 0.9168 0.8433 1.0026 -0.0955 -0.0281 -0.1753 313 VAL A CB
|
|
649 C CG1 . VAL A 111 ? 0.9217 0.8298 0.9580 -0.0749 -0.0294 -0.1780 313 VAL A CG1
|
|
650 C CG2 . VAL A 111 ? 0.8732 0.8312 0.9759 -0.0922 -0.0191 -0.1547 313 VAL A CG2
|
|
651 N N . VAL A 112 ? 0.9545 0.9571 1.1506 -0.1448 -0.0535 -0.1986 314 VAL A N
|
|
652 C CA . VAL A 112 ? 0.9718 0.9916 1.2212 -0.1727 -0.0494 -0.1966 314 VAL A CA
|
|
653 C C . VAL A 112 ? 1.1112 1.1079 1.3767 -0.1944 -0.0628 -0.2199 314 VAL A C
|
|
654 O O . VAL A 112 ? 1.1311 1.1209 1.3741 -0.1878 -0.0830 -0.2444 314 VAL A O
|
|
655 C CB . VAL A 112 ? 0.9925 1.0764 1.2818 -0.1772 -0.0529 -0.1926 314 VAL A CB
|
|
656 C CG1 . VAL A 112 ? 0.9509 1.0523 1.2308 -0.1601 -0.0358 -0.1690 314 VAL A CG1
|
|
657 C CG2 . VAL A 112 ? 0.9973 1.1157 1.2866 -0.1690 -0.0800 -0.2153 314 VAL A CG2
|
|
658 N N . GLY A 113 ? 1.1096 1.0960 1.4139 -0.2208 -0.0522 -0.2120 315 GLY A N
|
|
659 C CA . GLY A 113 ? 1.1632 1.1243 1.4915 -0.2469 -0.0637 -0.2326 315 GLY A CA
|
|
660 C C . GLY A 113 ? 1.2699 1.1695 1.5578 -0.2377 -0.0696 -0.2510 315 GLY A C
|
|
661 O O . GLY A 113 ? 1.3122 1.2022 1.5991 -0.2457 -0.0910 -0.2817 315 GLY A O
|
|
662 N N . ASN A 114 ? 1.2100 1.0708 1.4643 -0.2196 -0.0511 -0.2337 316 ASN A N
|
|
663 C CA . ASN A 114 ? 1.2364 1.0404 1.4517 -0.2062 -0.0513 -0.2475 316 ASN A CA
|
|
664 C C . ASN A 114 ? 1.2858 1.0947 1.4567 -0.1851 -0.0690 -0.2733 316 ASN A C
|
|
665 O O . ASN A 114 ? 1.3201 1.0886 1.4638 -0.1787 -0.0749 -0.2954 316 ASN A O
|
|
666 C CB . ASN A 114 ? 1.2914 1.0447 1.5300 -0.2293 -0.0523 -0.2588 316 ASN A CB
|
|
667 C CG . ASN A 114 ? 1.6451 1.3889 1.9222 -0.2494 -0.0333 -0.2287 316 ASN A CG
|
|
668 O OD1 . ASN A 114 ? 1.5112 1.2536 1.7781 -0.2365 -0.0132 -0.1989 316 ASN A OD1
|
|
669 N ND2 . ASN A 114 ? 1.6023 1.3395 1.9238 -0.2823 -0.0396 -0.2357 316 ASN A ND2
|
|
670 N N . LYS A 115 ? 1.1917 1.0494 1.3532 -0.1727 -0.0767 -0.2694 317 LYS A N
|
|
671 C CA . LYS A 115 ? 1.1892 1.0555 1.3058 -0.1515 -0.0923 -0.2870 317 LYS A CA
|
|
672 C C . LYS A 115 ? 1.2323 1.0697 1.3013 -0.1265 -0.0758 -0.2751 317 LYS A C
|
|
673 O O . LYS A 115 ? 1.1781 1.0204 1.2465 -0.1180 -0.0574 -0.2478 317 LYS A O
|
|
674 C CB . LYS A 115 ? 1.1822 1.1049 1.3051 -0.1448 -0.1051 -0.2828 317 LYS A CB
|
|
675 C CG . LYS A 115 ? 1.1678 1.1265 1.3297 -0.1643 -0.1286 -0.3035 317 LYS A CG
|
|
676 C CD . LYS A 115 ? 1.1865 1.1904 1.3326 -0.1474 -0.1499 -0.3107 317 LYS A CD
|
|
677 C CE . LYS A 115 ? 1.1300 1.1726 1.2866 -0.1345 -0.1414 -0.2852 317 LYS A CE
|
|
678 N NZ . LYS A 115 ? 1.1475 1.2294 1.3670 -0.1552 -0.1368 -0.2773 317 LYS A NZ
|
|
679 N N . ARG A 116 ? 1.2467 1.0550 1.2778 -0.1159 -0.0821 -0.2975 318 ARG A N
|
|
680 C CA . ARG A 116 ? 1.2533 1.0354 1.2410 -0.0934 -0.0667 -0.2913 318 ARG A CA
|
|
681 C C . ARG A 116 ? 1.2891 1.0918 1.2295 -0.0727 -0.0748 -0.2950 318 ARG A C
|
|
682 O O . ARG A 116 ? 1.3280 1.1353 1.2464 -0.0706 -0.0946 -0.3207 318 ARG A O
|
|
683 C CB . ARG A 116 ? 1.3155 1.0482 1.2931 -0.0940 -0.0647 -0.3138 318 ARG A CB
|
|
684 C CG . ARG A 116 ? 1.4172 1.1243 1.3630 -0.0721 -0.0438 -0.3040 318 ARG A CG
|
|
685 C CD . ARG A 116 ? 1.5329 1.2054 1.4464 -0.0614 -0.0478 -0.3355 318 ARG A CD
|
|
686 N NE . ARG A 116 ? 1.7202 1.3478 1.6611 -0.0743 -0.0473 -0.3488 318 ARG A NE
|
|
687 C CZ . ARG A 116 ? 1.9700 1.5631 1.9183 -0.0668 -0.0288 -0.3370 318 ARG A CZ
|
|
688 N NH1 . ARG A 116 ? 1.8392 1.4430 1.7723 -0.0475 -0.0093 -0.3127 318 ARG A NH1
|
|
689 N NH2 . ARG A 116 ? 1.8437 1.3909 1.8160 -0.0786 -0.0305 -0.3492 318 ARG A NH2
|
|
690 N N . LEU A 117 ? 1.1698 0.9834 1.0934 -0.0579 -0.0597 -0.2686 319 LEU A N
|
|
691 C CA . LEU A 117 ? 1.1399 0.9672 1.0174 -0.0384 -0.0620 -0.2638 319 LEU A CA
|
|
692 C C . LEU A 117 ? 1.1872 0.9868 1.0213 -0.0242 -0.0537 -0.2776 319 LEU A C
|
|
693 O O . LEU A 117 ? 1.1871 0.9589 1.0294 -0.0240 -0.0380 -0.2780 319 LEU A O
|
|
694 C CB . LEU A 117 ? 1.0913 0.9310 0.9722 -0.0313 -0.0456 -0.2313 319 LEU A CB
|
|
695 C CG . LEU A 117 ? 1.1156 0.9886 1.0037 -0.0291 -0.0553 -0.2172 319 LEU A CG
|
|
696 C CD1 . LEU A 117 ? 1.0978 0.9928 1.0355 -0.0458 -0.0647 -0.2199 319 LEU A CD1
|
|
697 C CD2 . LEU A 117 ? 1.0893 0.9640 0.9741 -0.0212 -0.0375 -0.1890 319 LEU A CD2
|
|
698 N N . LYS A 118 ? 1.1300 0.9384 0.9174 -0.0109 -0.0644 -0.2890 320 LYS A N
|
|
699 C CA . LYS A 118 ? 1.1407 0.9321 0.8788 0.0055 -0.0562 -0.3018 320 LYS A CA
|
|
700 C C . LYS A 118 ? 1.1175 0.9038 0.8508 0.0154 -0.0285 -0.2753 320 LYS A C
|
|
701 O O . LYS A 118 ? 1.0777 0.8814 0.8199 0.0151 -0.0229 -0.2479 320 LYS A O
|
|
702 C CB . LYS A 118 ? 1.1899 1.0020 0.8792 0.0178 -0.0706 -0.3050 320 LYS A CB
|
|
703 C CG . LYS A 118 ? 1.1622 0.9666 0.8109 0.0248 -0.0850 -0.3392 320 LYS A CG
|
|
704 C CD . LYS A 118 ? 1.2315 1.0617 0.8391 0.0345 -0.1044 -0.3377 320 LYS A CD
|
|
705 C CE . LYS A 118 ? 1.4385 1.2847 1.0652 0.0234 -0.1368 -0.3608 320 LYS A CE
|
|
706 N NZ . LYS A 118 ? 1.6283 1.4994 1.2105 0.0364 -0.1581 -0.3608 320 LYS A NZ
|
|
707 N N . GLU A 119 ? 1.0474 0.8113 0.7686 0.0246 -0.0119 -0.2842 321 GLU A N
|
|
708 C CA . GLU A 119 ? 1.0051 0.7700 0.7265 0.0339 0.0135 -0.2601 321 GLU A CA
|
|
709 C C . GLU A 119 ? 1.0670 0.8567 0.7595 0.0416 0.0197 -0.2360 321 GLU A C
|
|
710 O O . GLU A 119 ? 1.0428 0.8417 0.7540 0.0394 0.0320 -0.2093 321 GLU A O
|
|
711 C CB . GLU A 119 ? 1.0429 0.7858 0.7526 0.0470 0.0297 -0.2752 321 GLU A CB
|
|
712 C CG . GLU A 119 ? 1.0594 0.8104 0.7763 0.0561 0.0546 -0.2500 321 GLU A CG
|
|
713 C CD . GLU A 119 ? 1.2375 0.9692 0.9630 0.0687 0.0718 -0.2584 321 GLU A CD
|
|
714 O OE1 . GLU A 119 ? 1.2465 0.9475 0.9854 0.0674 0.0654 -0.2808 321 GLU A OE1
|
|
715 O OE2 . GLU A 119 ? 1.1924 0.9399 0.9155 0.0792 0.0915 -0.2410 321 GLU A OE2
|
|
716 N N . ALA A 120 ? 1.0614 0.8606 0.7089 0.0493 0.0093 -0.2452 322 ALA A N
|
|
717 C CA . ALA A 120 ? 1.0582 0.8756 0.6725 0.0562 0.0135 -0.2223 322 ALA A CA
|
|
718 C C . ALA A 120 ? 1.0736 0.9032 0.7116 0.0473 0.0028 -0.2000 322 ALA A C
|
|
719 O O . ALA A 120 ? 1.0473 0.8836 0.6846 0.0481 0.0147 -0.1731 322 ALA A O
|
|
720 C CB . ALA A 120 ? 1.1197 0.9420 0.6777 0.0672 0.0028 -0.2380 322 ALA A CB
|
|
721 N N . THR A 121 ? 1.0248 0.8581 0.6878 0.0382 -0.0191 -0.2122 323 THR A N
|
|
722 C CA . THR A 121 ? 0.9824 0.8304 0.6730 0.0314 -0.0305 -0.1962 323 THR A CA
|
|
723 C C . THR A 121 ? 0.9790 0.8247 0.7097 0.0239 -0.0136 -0.1764 323 THR A C
|
|
724 O O . THR A 121 ? 0.9614 0.8158 0.6976 0.0244 -0.0120 -0.1550 323 THR A O
|
|
725 C CB . THR A 121 ? 1.1118 0.9693 0.8251 0.0229 -0.0553 -0.2176 323 THR A CB
|
|
726 O OG1 . THR A 121 ? 1.1766 1.0382 0.8493 0.0309 -0.0732 -0.2370 323 THR A OG1
|
|
727 C CG2 . THR A 121 ? 1.0182 0.8959 0.7650 0.0176 -0.0661 -0.2039 323 THR A CG2
|
|
728 N N . CYS A 122 ? 0.9299 0.7621 0.6859 0.0184 -0.0018 -0.1840 324 CYS A N
|
|
729 C CA . CYS A 122 ? 0.8976 0.7270 0.6884 0.0128 0.0143 -0.1667 324 CYS A CA
|
|
730 C C . CYS A 122 ? 0.9312 0.7654 0.7048 0.0203 0.0301 -0.1446 324 CYS A C
|
|
731 O O . CYS A 122 ? 0.9116 0.7542 0.7043 0.0164 0.0339 -0.1253 324 CYS A O
|
|
732 C CB . CYS A 122 ? 0.9218 0.7309 0.7303 0.0105 0.0237 -0.1790 324 CYS A CB
|
|
733 S SG . CYS A 122 ? 0.9879 0.7875 0.8328 -0.0057 0.0080 -0.1988 324 CYS A SG
|
|
734 N N . LYS A 123 ? 0.8673 0.6976 0.6052 0.0306 0.0399 -0.1486 325 LYS A N
|
|
735 C CA . LYS A 123 ? 0.8420 0.6795 0.5629 0.0360 0.0567 -0.1286 325 LYS A CA
|
|
736 C C . LYS A 123 ? 0.9013 0.7471 0.6081 0.0344 0.0492 -0.1097 325 LYS A C
|
|
737 O O . LYS A 123 ? 0.8749 0.7251 0.5953 0.0305 0.0578 -0.0893 325 LYS A O
|
|
738 C CB . LYS A 123 ? 0.9001 0.7365 0.5840 0.0475 0.0684 -0.1391 325 LYS A CB
|
|
739 C CG . LYS A 123 ? 0.8716 0.7192 0.5529 0.0510 0.0914 -0.1198 325 LYS A CG
|
|
740 C CD . LYS A 123 ? 0.8602 0.7130 0.5040 0.0633 0.1054 -0.1290 325 LYS A CD
|
|
741 C CE . LYS A 123 ? 0.9439 0.7864 0.5958 0.0725 0.1115 -0.1538 325 LYS A CE
|
|
742 N NZ . LYS A 123 ? 1.0909 0.9456 0.7133 0.0867 0.1320 -0.1590 325 LYS A NZ
|
|
743 N N . LEU A 124 ? 0.8974 0.7440 0.5771 0.0380 0.0319 -0.1167 326 LEU A N
|
|
744 C CA . LEU A 124 ? 0.8901 0.7396 0.5534 0.0395 0.0230 -0.0982 326 LEU A CA
|
|
745 C C . LEU A 124 ? 0.8808 0.7333 0.5827 0.0326 0.0169 -0.0874 326 LEU A C
|
|
746 O O . LEU A 124 ? 0.8599 0.7099 0.5592 0.0321 0.0196 -0.0674 326 LEU A O
|
|
747 C CB . LEU A 124 ? 0.9239 0.7752 0.5518 0.0473 0.0025 -0.1091 326 LEU A CB
|
|
748 C CG . LEU A 124 ? 0.9937 0.8440 0.6005 0.0523 -0.0095 -0.0896 326 LEU A CG
|
|
749 C CD1 . LEU A 124 ? 1.0103 0.8528 0.5863 0.0538 0.0080 -0.0646 326 LEU A CD1
|
|
750 C CD2 . LEU A 124 ? 1.0704 0.9262 0.6485 0.0614 -0.0335 -0.1024 326 LEU A CD2
|
|
751 N N . TYR A 125 ? 0.8225 0.6798 0.5595 0.0269 0.0094 -0.1009 327 TYR A N
|
|
752 C CA . TYR A 125 ? 0.7879 0.6527 0.5616 0.0213 0.0048 -0.0936 327 TYR A CA
|
|
753 C C . TYR A 125 ? 0.8357 0.6985 0.6305 0.0161 0.0231 -0.0798 327 TYR A C
|
|
754 O O . TYR A 125 ? 0.8183 0.6829 0.6214 0.0152 0.0237 -0.0656 327 TYR A O
|
|
755 C CB . TYR A 125 ? 0.7759 0.6499 0.5808 0.0148 -0.0063 -0.1116 327 TYR A CB
|
|
756 C CG . TYR A 125 ? 0.8037 0.6870 0.5972 0.0185 -0.0282 -0.1266 327 TYR A CG
|
|
757 C CD1 . TYR A 125 ? 0.8537 0.7359 0.6083 0.0297 -0.0385 -0.1216 327 TYR A CD1
|
|
758 C CD2 . TYR A 125 ? 0.8084 0.7033 0.6316 0.0102 -0.0396 -0.1444 327 TYR A CD2
|
|
759 C CE1 . TYR A 125 ? 0.8803 0.7743 0.6242 0.0350 -0.0613 -0.1351 327 TYR A CE1
|
|
760 C CE2 . TYR A 125 ? 0.8353 0.7448 0.6529 0.0130 -0.0622 -0.1592 327 TYR A CE2
|
|
761 C CZ . TYR A 125 ? 0.9148 0.8244 0.6916 0.0267 -0.0737 -0.1551 327 TYR A CZ
|
|
762 O OH . TYR A 125 ? 0.9299 0.8561 0.6996 0.0313 -0.0980 -0.1697 327 TYR A OH
|
|
763 N N . PHE A 126 ? 0.7966 0.6551 0.5993 0.0141 0.0365 -0.0852 328 PHE A N
|
|
764 C CA . PHE A 126 ? 0.7730 0.6329 0.5969 0.0108 0.0521 -0.0734 328 PHE A CA
|
|
765 C C . PHE A 126 ? 0.8343 0.6960 0.6435 0.0121 0.0617 -0.0558 328 PHE A C
|
|
766 O O . PHE A 126 ? 0.8320 0.6985 0.6599 0.0077 0.0654 -0.0434 328 PHE A O
|
|
767 C CB . PHE A 126 ? 0.8001 0.6533 0.6342 0.0119 0.0627 -0.0831 328 PHE A CB
|
|
768 C CG . PHE A 126 ? 0.7770 0.6338 0.6402 0.0090 0.0737 -0.0717 328 PHE A CG
|
|
769 C CD1 . PHE A 126 ? 0.7795 0.6404 0.6709 0.0021 0.0689 -0.0680 328 PHE A CD1
|
|
770 C CD2 . PHE A 126 ? 0.7873 0.6472 0.6497 0.0139 0.0889 -0.0642 328 PHE A CD2
|
|
771 C CE1 . PHE A 126 ? 0.7716 0.6371 0.6849 0.0006 0.0780 -0.0560 328 PHE A CE1
|
|
772 C CE2 . PHE A 126 ? 0.8000 0.6661 0.6886 0.0128 0.0965 -0.0532 328 PHE A CE2
|
|
773 C CZ . PHE A 126 ? 0.7571 0.6247 0.6687 0.0063 0.0904 -0.0488 328 PHE A CZ
|
|
774 N N . TYR A 127 ? 0.8040 0.6626 0.5792 0.0171 0.0653 -0.0545 329 TYR A N
|
|
775 C CA . TYR A 127 ? 0.8090 0.6692 0.5681 0.0157 0.0753 -0.0361 329 TYR A CA
|
|
776 C C . TYR A 127 ? 0.8701 0.7251 0.6335 0.0114 0.0651 -0.0230 329 TYR A C
|
|
777 O O . TYR A 127 ? 0.8708 0.7276 0.6472 0.0051 0.0722 -0.0095 329 TYR A O
|
|
778 C CB . TYR A 127 ? 0.8601 0.7183 0.5766 0.0220 0.0794 -0.0369 329 TYR A CB
|
|
779 C CG . TYR A 127 ? 0.8947 0.7536 0.5912 0.0184 0.0899 -0.0153 329 TYR A CG
|
|
780 C CD1 . TYR A 127 ? 0.9009 0.7725 0.6123 0.0131 0.1090 -0.0047 329 TYR A CD1
|
|
781 C CD2 . TYR A 127 ? 0.9422 0.7900 0.6052 0.0200 0.0806 -0.0045 329 TYR A CD2
|
|
782 C CE1 . TYR A 127 ? 0.9263 0.8003 0.6237 0.0061 0.1193 0.0162 329 TYR A CE1
|
|
783 C CE2 . TYR A 127 ? 0.9767 0.8214 0.6210 0.0143 0.0912 0.0181 329 TYR A CE2
|
|
784 C CZ . TYR A 127 ? 1.0442 0.9023 0.7074 0.0057 0.1110 0.0284 329 TYR A CZ
|
|
785 O OH . TYR A 127 ? 1.0930 0.9499 0.7417 -0.0034 0.1222 0.0515 329 TYR A OH
|
|
786 N N . GLN A 128 ? 0.8293 0.6789 0.5856 0.0155 0.0472 -0.0290 330 GLN A N
|
|
787 C CA . GLN A 128 ? 0.8261 0.6691 0.5870 0.0156 0.0354 -0.0201 330 GLN A CA
|
|
788 C C . GLN A 128 ? 0.8583 0.7087 0.6569 0.0106 0.0362 -0.0207 330 GLN A C
|
|
789 O O . GLN A 128 ? 0.8742 0.7181 0.6778 0.0080 0.0353 -0.0103 330 GLN A O
|
|
790 C CB . GLN A 128 ? 0.8605 0.7021 0.6081 0.0242 0.0158 -0.0287 330 GLN A CB
|
|
791 C CG . GLN A 128 ? 0.9180 0.7516 0.6216 0.0309 0.0121 -0.0255 330 GLN A CG
|
|
792 C CD . GLN A 128 ? 1.0600 0.8974 0.7531 0.0405 -0.0097 -0.0365 330 GLN A CD
|
|
793 O OE1 . GLN A 128 ? 1.0410 0.8741 0.7361 0.0468 -0.0239 -0.0308 330 GLN A OE1
|
|
794 N NE2 . GLN A 128 ? 0.9471 0.7931 0.6294 0.0428 -0.0141 -0.0538 330 GLN A NE2
|
|
795 N N . MET A 129 ? 0.7686 0.6308 0.5916 0.0088 0.0381 -0.0327 331 MET A N
|
|
796 C CA . MET A 129 ? 0.7108 0.5828 0.5661 0.0045 0.0406 -0.0327 331 MET A CA
|
|
797 C C . MET A 129 ? 0.7694 0.6424 0.6311 -0.0005 0.0538 -0.0210 331 MET A C
|
|
798 O O . MET A 129 ? 0.7609 0.6374 0.6365 -0.0031 0.0529 -0.0158 331 MET A O
|
|
799 C CB . MET A 129 ? 0.7134 0.5940 0.5898 0.0021 0.0420 -0.0445 331 MET A CB
|
|
800 C CG . MET A 129 ? 0.7481 0.6342 0.6276 0.0038 0.0279 -0.0575 331 MET A CG
|
|
801 S SD . MET A 129 ? 0.7884 0.6810 0.6969 -0.0041 0.0302 -0.0696 331 MET A SD
|
|
802 C CE . MET A 129 ? 0.7707 0.6607 0.6635 -0.0021 0.0164 -0.0871 331 MET A CE
|
|
803 N N . LEU A 130 ? 0.7165 0.5890 0.5676 -0.0010 0.0657 -0.0181 332 LEU A N
|
|
804 C CA . LEU A 130 ? 0.6749 0.5548 0.5354 -0.0057 0.0780 -0.0073 332 LEU A CA
|
|
805 C C . LEU A 130 ? 0.7300 0.6030 0.5804 -0.0110 0.0761 0.0049 332 LEU A C
|
|
806 O O . LEU A 130 ? 0.7220 0.6012 0.5886 -0.0172 0.0786 0.0116 332 LEU A O
|
|
807 C CB . LEU A 130 ? 0.6808 0.5663 0.5345 -0.0028 0.0918 -0.0084 332 LEU A CB
|
|
808 C CG . LEU A 130 ? 0.7061 0.5949 0.5752 0.0022 0.0964 -0.0188 332 LEU A CG
|
|
809 C CD1 . LEU A 130 ? 0.7269 0.6173 0.5814 0.0089 0.1084 -0.0241 332 LEU A CD1
|
|
810 C CD2 . LEU A 130 ? 0.6479 0.5479 0.5460 0.0002 0.1004 -0.0125 332 LEU A CD2
|
|
811 N N . LEU A 131 ? 0.7164 0.5751 0.5391 -0.0089 0.0706 0.0083 333 LEU A N
|
|
812 C CA . LEU A 131 ? 0.7181 0.5623 0.5284 -0.0145 0.0677 0.0220 333 LEU A CA
|
|
813 C C . LEU A 131 ? 0.7711 0.6070 0.5959 -0.0144 0.0546 0.0197 333 LEU A C
|
|
814 O O . LEU A 131 ? 0.7856 0.6145 0.6175 -0.0223 0.0547 0.0274 333 LEU A O
|
|
815 C CB . LEU A 131 ? 0.7475 0.5758 0.5214 -0.0096 0.0631 0.0274 333 LEU A CB
|
|
816 C CG . LEU A 131 ? 0.8139 0.6493 0.5642 -0.0089 0.0769 0.0310 333 LEU A CG
|
|
817 C CD1 . LEU A 131 ? 0.8567 0.6757 0.5667 -0.0028 0.0691 0.0374 333 LEU A CD1
|
|
818 C CD2 . LEU A 131 ? 0.7855 0.6312 0.5433 -0.0203 0.0946 0.0451 333 LEU A CD2
|
|
819 N N . ALA A 132 ? 0.7095 0.5479 0.5401 -0.0057 0.0437 0.0076 334 ALA A N
|
|
820 C CA . ALA A 132 ? 0.6893 0.5249 0.5332 -0.0021 0.0326 0.0026 334 ALA A CA
|
|
821 C C . ALA A 132 ? 0.7028 0.5528 0.5717 -0.0080 0.0386 0.0009 334 ALA A C
|
|
822 O O . ALA A 132 ? 0.7079 0.5500 0.5809 -0.0110 0.0346 0.0030 334 ALA A O
|
|
823 C CB . ALA A 132 ? 0.6901 0.5343 0.5382 0.0078 0.0225 -0.0097 334 ALA A CB
|
|
824 N N . VAL A 133 ? 0.6449 0.5138 0.5286 -0.0094 0.0473 -0.0027 335 VAL A N
|
|
825 C CA . VAL A 133 ? 0.6219 0.5066 0.5264 -0.0134 0.0528 -0.0021 335 VAL A CA
|
|
826 C C . VAL A 133 ? 0.6658 0.5510 0.5724 -0.0224 0.0587 0.0074 335 VAL A C
|
|
827 O O . VAL A 133 ? 0.6548 0.5472 0.5734 -0.0260 0.0563 0.0074 335 VAL A O
|
|
828 C CB . VAL A 133 ? 0.6580 0.5578 0.5764 -0.0114 0.0598 -0.0060 335 VAL A CB
|
|
829 C CG1 . VAL A 133 ? 0.6345 0.5502 0.5709 -0.0136 0.0647 -0.0024 335 VAL A CG1
|
|
830 C CG2 . VAL A 133 ? 0.6563 0.5586 0.5785 -0.0065 0.0529 -0.0153 335 VAL A CG2
|
|
831 N N . GLN A 134 ? 0.6343 0.5136 0.5286 -0.0264 0.0655 0.0151 336 GLN A N
|
|
832 C CA . GLN A 134 ? 0.6487 0.5329 0.5492 -0.0373 0.0717 0.0248 336 GLN A CA
|
|
833 C C . GLN A 134 ? 0.7335 0.5983 0.6305 -0.0441 0.0611 0.0272 336 GLN A C
|
|
834 O O . GLN A 134 ? 0.7472 0.6200 0.6602 -0.0517 0.0590 0.0269 336 GLN A O
|
|
835 C CB . GLN A 134 ? 0.6801 0.5669 0.5684 -0.0400 0.0841 0.0331 336 GLN A CB
|
|
836 C CG . GLN A 134 ? 0.8234 0.7174 0.7193 -0.0539 0.0917 0.0453 336 GLN A CG
|
|
837 C CD . GLN A 134 ? 1.0128 0.9122 0.8934 -0.0554 0.1061 0.0541 336 GLN A CD
|
|
838 O OE1 . GLN A 134 ? 0.9490 0.8750 0.8447 -0.0578 0.1197 0.0575 336 GLN A OE1
|
|
839 N NE2 . GLN A 134 ? 0.8535 0.7307 0.7029 -0.0519 0.1037 0.0576 336 GLN A NE2
|
|
840 N N . TYR A 135 ? 0.7055 0.5442 0.5821 -0.0393 0.0523 0.0274 337 TYR A N
|
|
841 C CA . TYR A 135 ? 0.7253 0.5364 0.5951 -0.0416 0.0403 0.0282 337 TYR A CA
|
|
842 C C . TYR A 135 ? 0.7793 0.5975 0.6659 -0.0385 0.0319 0.0153 337 TYR A C
|
|
843 O O . TYR A 135 ? 0.7836 0.5925 0.6768 -0.0473 0.0269 0.0146 337 TYR A O
|
|
844 C CB . TYR A 135 ? 0.7594 0.5464 0.6058 -0.0301 0.0309 0.0286 337 TYR A CB
|
|
845 C CG . TYR A 135 ? 0.8192 0.5722 0.6575 -0.0286 0.0175 0.0294 337 TYR A CG
|
|
846 C CD1 . TYR A 135 ? 0.8705 0.5949 0.6971 -0.0406 0.0178 0.0443 337 TYR A CD1
|
|
847 C CD2 . TYR A 135 ? 0.8153 0.5642 0.6588 -0.0150 0.0052 0.0152 337 TYR A CD2
|
|
848 C CE1 . TYR A 135 ? 0.8746 0.5608 0.6944 -0.0393 0.0046 0.0447 337 TYR A CE1
|
|
849 C CE2 . TYR A 135 ? 0.8474 0.5620 0.6836 -0.0107 -0.0076 0.0136 337 TYR A CE2
|
|
850 C CZ . TYR A 135 ? 0.9477 0.6277 0.7716 -0.0228 -0.0087 0.0283 337 TYR A CZ
|
|
851 O OH . TYR A 135 ? 1.0256 0.6647 0.8421 -0.0183 -0.0222 0.0269 337 TYR A OH
|
|
852 N N . LEU A 136 ? 0.7047 0.5408 0.5978 -0.0270 0.0310 0.0050 338 LEU A N
|
|
853 C CA . LEU A 136 ? 0.6719 0.5209 0.5775 -0.0219 0.0259 -0.0065 338 LEU A CA
|
|
854 C C . LEU A 136 ? 0.7499 0.6155 0.6698 -0.0321 0.0293 -0.0053 338 LEU A C
|
|
855 O O . LEU A 136 ? 0.7727 0.6333 0.6950 -0.0340 0.0211 -0.0126 338 LEU A O
|
|
856 C CB . LEU A 136 ? 0.6311 0.5024 0.5439 -0.0124 0.0296 -0.0124 338 LEU A CB
|
|
857 C CG . LEU A 136 ? 0.6663 0.5316 0.5720 -0.0010 0.0231 -0.0184 338 LEU A CG
|
|
858 C CD1 . LEU A 136 ? 0.6065 0.4991 0.5271 0.0041 0.0273 -0.0249 338 LEU A CD1
|
|
859 C CD2 . LEU A 136 ? 0.6936 0.5395 0.5921 0.0073 0.0106 -0.0252 338 LEU A CD2
|
|
860 N N . HIS A 137 ? 0.6800 0.5655 0.6092 -0.0373 0.0403 0.0027 339 HIS A N
|
|
861 C CA . HIS A 137 ? 0.6430 0.5513 0.5887 -0.0446 0.0432 0.0050 339 HIS A CA
|
|
862 C C . HIS A 137 ? 0.7293 0.6279 0.6787 -0.0592 0.0391 0.0085 339 HIS A C
|
|
863 O O . HIS A 137 ? 0.7355 0.6413 0.6938 -0.0644 0.0313 0.0022 339 HIS A O
|
|
864 C CB . HIS A 137 ? 0.6124 0.5427 0.5678 -0.0426 0.0557 0.0122 339 HIS A CB
|
|
865 C CG . HIS A 137 ? 0.6188 0.5573 0.5749 -0.0312 0.0586 0.0086 339 HIS A CG
|
|
866 N ND1 . HIS A 137 ? 0.6134 0.5642 0.5772 -0.0272 0.0685 0.0133 339 HIS A ND1
|
|
867 C CD2 . HIS A 137 ? 0.6243 0.5607 0.5766 -0.0241 0.0533 0.0011 339 HIS A CD2
|
|
868 C CE1 . HIS A 137 ? 0.5960 0.5479 0.5602 -0.0202 0.0683 0.0097 339 HIS A CE1
|
|
869 N NE2 . HIS A 137 ? 0.6050 0.5518 0.5633 -0.0186 0.0602 0.0029 339 HIS A NE2
|
|
870 N N . GLU A 138 ? 0.7080 0.5874 0.6480 -0.0663 0.0431 0.0177 340 GLU A N
|
|
871 C CA . GLU A 138 ? 0.7226 0.5863 0.6653 -0.0831 0.0400 0.0239 340 GLU A CA
|
|
872 C C . GLU A 138 ? 0.7994 0.6365 0.7378 -0.0845 0.0240 0.0128 340 GLU A C
|
|
873 O O . GLU A 138 ? 0.8179 0.6534 0.7685 -0.0992 0.0182 0.0111 340 GLU A O
|
|
874 C CB . GLU A 138 ? 0.7558 0.5981 0.6815 -0.0874 0.0471 0.0375 340 GLU A CB
|
|
875 C CG . GLU A 138 ? 0.8519 0.7222 0.7836 -0.0897 0.0639 0.0475 340 GLU A CG
|
|
876 C CD . GLU A 138 ? 1.0698 0.9260 0.9831 -0.0956 0.0737 0.0624 340 GLU A CD
|
|
877 O OE1 . GLU A 138 ? 0.8753 0.6971 0.7641 -0.0917 0.0668 0.0656 340 GLU A OE1
|
|
878 O OE2 . GLU A 138 ? 1.0264 0.9083 0.9488 -0.1021 0.0887 0.0711 340 GLU A OE2
|
|
879 N N . ASN A 139 ? 0.7521 0.5716 0.6756 -0.0686 0.0166 0.0034 341 ASN A N
|
|
880 C CA . ASN A 139 ? 0.7629 0.5562 0.6796 -0.0634 0.0021 -0.0101 341 ASN A CA
|
|
881 C C . ASN A 139 ? 0.8072 0.6225 0.7306 -0.0548 -0.0036 -0.0269 341 ASN A C
|
|
882 O O . ASN A 139 ? 0.8296 0.6258 0.7453 -0.0466 -0.0147 -0.0412 341 ASN A O
|
|
883 C CB . ASN A 139 ? 0.7689 0.5332 0.6666 -0.0490 -0.0027 -0.0103 341 ASN A CB
|
|
884 C CG . ASN A 139 ? 0.9297 0.6597 0.8148 -0.0586 -0.0024 0.0056 341 ASN A CG
|
|
885 O OD1 . ASN A 139 ? 0.9090 0.6044 0.7911 -0.0676 -0.0110 0.0064 341 ASN A OD1
|
|
886 N ND2 . ASN A 139 ? 0.7556 0.4946 0.6327 -0.0584 0.0082 0.0191 341 ASN A ND2
|
|
887 N N . GLY A 140 ? 0.7337 0.5878 0.6695 -0.0552 0.0040 -0.0250 342 GLY A N
|
|
888 C CA . GLY A 140 ? 0.7129 0.5925 0.6523 -0.0478 0.0002 -0.0370 342 GLY A CA
|
|
889 C C . GLY A 140 ? 0.7494 0.6389 0.6810 -0.0296 0.0025 -0.0439 342 GLY A C
|
|
890 O O . GLY A 140 ? 0.7547 0.6589 0.6834 -0.0221 -0.0017 -0.0556 342 GLY A O
|
|
891 N N . ILE A 141 ? 0.6894 0.5747 0.6179 -0.0232 0.0096 -0.0369 343 ILE A N
|
|
892 C CA . ILE A 141 ? 0.6714 0.5689 0.5976 -0.0088 0.0126 -0.0421 343 ILE A CA
|
|
893 C C . ILE A 141 ? 0.7051 0.6261 0.6401 -0.0092 0.0246 -0.0317 343 ILE A C
|
|
894 O O . ILE A 141 ? 0.7054 0.6201 0.6417 -0.0148 0.0300 -0.0220 343 ILE A O
|
|
895 C CB . ILE A 141 ? 0.7115 0.5833 0.6285 0.0001 0.0070 -0.0455 343 ILE A CB
|
|
896 C CG1 . ILE A 141 ? 0.7287 0.5654 0.6360 0.0005 -0.0056 -0.0531 343 ILE A CG1
|
|
897 C CG2 . ILE A 141 ? 0.6832 0.5738 0.6037 0.0142 0.0094 -0.0519 343 ILE A CG2
|
|
898 C CD1 . ILE A 141 ? 0.8317 0.6700 0.7361 0.0122 -0.0136 -0.0721 343 ILE A CD1
|
|
899 N N . ILE A 142 ? 0.6736 0.6197 0.6130 -0.0029 0.0291 -0.0339 344 ILE A N
|
|
900 C CA . ILE A 142 ? 0.6656 0.6296 0.6139 -0.0026 0.0398 -0.0246 344 ILE A CA
|
|
901 C C . ILE A 142 ? 0.6767 0.6461 0.6267 0.0055 0.0409 -0.0308 344 ILE A C
|
|
902 O O . ILE A 142 ? 0.6690 0.6506 0.6170 0.0128 0.0389 -0.0395 344 ILE A O
|
|
903 C CB . ILE A 142 ? 0.7104 0.6993 0.6630 -0.0026 0.0446 -0.0188 344 ILE A CB
|
|
904 C CG1 . ILE A 142 ? 0.7232 0.7155 0.6768 -0.0087 0.0401 -0.0161 344 ILE A CG1
|
|
905 C CG2 . ILE A 142 ? 0.7310 0.7288 0.6930 -0.0030 0.0554 -0.0072 344 ILE A CG2
|
|
906 C CD1 . ILE A 142 ? 0.7520 0.7697 0.7028 -0.0045 0.0393 -0.0153 344 ILE A CD1
|
|
907 N N . HIS A 143 ? 0.6062 0.5697 0.5605 0.0046 0.0437 -0.0279 345 HIS A N
|
|
908 C CA . HIS A 143 ? 0.5947 0.5675 0.5558 0.0104 0.0434 -0.0340 345 HIS A CA
|
|
909 C C . HIS A 143 ? 0.6528 0.6544 0.6259 0.0106 0.0524 -0.0317 345 HIS A C
|
|
910 O O . HIS A 143 ? 0.6491 0.6685 0.6272 0.0174 0.0521 -0.0395 345 HIS A O
|
|
911 C CB . HIS A 143 ? 0.5992 0.5600 0.5612 0.0076 0.0426 -0.0322 345 HIS A CB
|
|
912 C CG . HIS A 143 ? 0.6497 0.6207 0.6198 0.0133 0.0380 -0.0404 345 HIS A CG
|
|
913 N ND1 . HIS A 143 ? 0.6657 0.6597 0.6540 0.0099 0.0445 -0.0404 345 HIS A ND1
|
|
914 C CD2 . HIS A 143 ? 0.6824 0.6451 0.6468 0.0221 0.0271 -0.0479 345 HIS A CD2
|
|
915 C CE1 . HIS A 143 ? 0.6579 0.6615 0.6537 0.0159 0.0373 -0.0493 345 HIS A CE1
|
|
916 N NE2 . HIS A 143 ? 0.6786 0.6641 0.6598 0.0250 0.0262 -0.0542 345 HIS A NE2
|
|
917 N N . ARG A 144 ? 0.6115 0.6179 0.5897 0.0037 0.0610 -0.0201 346 ARG A N
|
|
918 C CA . ARG A 144 ? 0.5936 0.6221 0.5805 0.0017 0.0708 -0.0123 346 ARG A CA
|
|
919 C C . ARG A 144 ? 0.6479 0.6879 0.6520 -0.0024 0.0761 -0.0123 346 ARG A C
|
|
920 O O . ARG A 144 ? 0.6735 0.7300 0.6862 -0.0068 0.0858 -0.0030 346 ARG A O
|
|
921 C CB . ARG A 144 ? 0.5513 0.5993 0.5290 0.0084 0.0709 -0.0155 346 ARG A CB
|
|
922 C CG . ARG A 144 ? 0.4889 0.5332 0.4543 0.0086 0.0675 -0.0115 346 ARG A CG
|
|
923 C CD . ARG A 144 ? 0.6076 0.6728 0.5608 0.0155 0.0665 -0.0168 346 ARG A CD
|
|
924 N NE . ARG A 144 ? 0.9344 1.0261 0.8910 0.0172 0.0780 -0.0104 346 ARG A NE
|
|
925 C CZ . ARG A 144 ? 1.3548 1.4685 1.3059 0.0254 0.0804 -0.0205 346 ARG A CZ
|
|
926 N NH1 . ARG A 144 ? 1.2743 1.3827 1.2148 0.0345 0.0704 -0.0393 346 ARG A NH1
|
|
927 N NH2 . ARG A 144 ? 1.3056 1.4466 1.2622 0.0248 0.0934 -0.0119 346 ARG A NH2
|
|
928 N N . ASP A 145 ? 0.5874 0.6200 0.5969 -0.0020 0.0694 -0.0217 347 ASP A N
|
|
929 C CA . ASP A 145 ? 0.5854 0.6324 0.6150 -0.0076 0.0719 -0.0240 347 ASP A CA
|
|
930 C C . ASP A 145 ? 0.6771 0.7056 0.7082 -0.0105 0.0635 -0.0309 347 ASP A C
|
|
931 O O . ASP A 145 ? 0.6831 0.7235 0.7251 -0.0089 0.0567 -0.0406 347 ASP A O
|
|
932 C CB . ASP A 145 ? 0.6024 0.6811 0.6423 -0.0007 0.0722 -0.0322 347 ASP A CB
|
|
933 C CG . ASP A 145 ? 0.6889 0.7940 0.7561 -0.0091 0.0778 -0.0323 347 ASP A CG
|
|
934 O OD1 . ASP A 145 ? 0.7029 0.8037 0.7809 -0.0227 0.0855 -0.0218 347 ASP A OD1
|
|
935 O OD2 . ASP A 145 ? 0.7469 0.8769 0.8267 -0.0022 0.0740 -0.0431 347 ASP A OD2
|
|
936 N N . LEU A 146 ? 0.6296 0.6321 0.6492 -0.0134 0.0636 -0.0264 348 LEU A N
|
|
937 C CA . LEU A 146 ? 0.6129 0.5976 0.6277 -0.0151 0.0569 -0.0333 348 LEU A CA
|
|
938 C C . LEU A 146 ? 0.6620 0.6487 0.6956 -0.0257 0.0599 -0.0349 348 LEU A C
|
|
939 O O . LEU A 146 ? 0.6623 0.6434 0.7034 -0.0323 0.0695 -0.0256 348 LEU A O
|
|
940 C CB . LEU A 146 ? 0.6056 0.5662 0.6016 -0.0135 0.0584 -0.0287 348 LEU A CB
|
|
941 C CG . LEU A 146 ? 0.6496 0.6031 0.6281 -0.0070 0.0540 -0.0275 348 LEU A CG
|
|
942 C CD1 . LEU A 146 ? 0.6398 0.5785 0.6075 -0.0084 0.0590 -0.0208 348 LEU A CD1
|
|
943 C CD2 . LEU A 146 ? 0.6860 0.6336 0.6539 -0.0009 0.0422 -0.0357 348 LEU A CD2
|
|
944 N N . LYS A 147 ? 0.6150 0.6101 0.6576 -0.0273 0.0507 -0.0466 349 LYS A N
|
|
945 C CA . LYS A 147 ? 0.6016 0.5987 0.6643 -0.0395 0.0498 -0.0524 349 LYS A CA
|
|
946 C C . LYS A 147 ? 0.6964 0.6952 0.7555 -0.0366 0.0341 -0.0680 349 LYS A C
|
|
947 O O . LYS A 147 ? 0.6964 0.6981 0.7399 -0.0242 0.0255 -0.0711 349 LYS A O
|
|
948 C CB . LYS A 147 ? 0.5924 0.6171 0.6849 -0.0497 0.0581 -0.0466 349 LYS A CB
|
|
949 C CG . LYS A 147 ? 0.6563 0.7159 0.7577 -0.0422 0.0572 -0.0485 349 LYS A CG
|
|
950 C CD . LYS A 147 ? 0.7866 0.8704 0.9073 -0.0504 0.0719 -0.0366 349 LYS A CD
|
|
951 C CE . LYS A 147 ? 0.9236 1.0515 1.0659 -0.0471 0.0712 -0.0434 349 LYS A CE
|
|
952 N NZ . LYS A 147 ? 1.0798 1.2344 1.2295 -0.0490 0.0875 -0.0310 349 LYS A NZ
|
|
953 N N . PRO A 148 ? 0.6831 0.6776 0.7540 -0.0470 0.0285 -0.0784 350 PRO A N
|
|
954 C CA . PRO A 148 ? 0.6943 0.6940 0.7591 -0.0430 0.0111 -0.0943 350 PRO A CA
|
|
955 C C . PRO A 148 ? 0.7448 0.7794 0.8240 -0.0357 0.0010 -0.0990 350 PRO A C
|
|
956 O O . PRO A 148 ? 0.7644 0.8000 0.8274 -0.0244 -0.0140 -0.1070 350 PRO A O
|
|
957 C CB . PRO A 148 ? 0.7327 0.7265 0.8158 -0.0590 0.0078 -0.1053 350 PRO A CB
|
|
958 C CG . PRO A 148 ? 0.7815 0.7490 0.8647 -0.0660 0.0235 -0.0945 350 PRO A CG
|
|
959 C CD . PRO A 148 ? 0.7028 0.6852 0.7920 -0.0627 0.0360 -0.0769 350 PRO A CD
|
|
960 N N . GLU A 149 ? 0.6794 0.7433 0.7871 -0.0401 0.0095 -0.0933 351 GLU A N
|
|
961 C CA . GLU A 149 ? 0.6633 0.7653 0.7883 -0.0304 0.0015 -0.0991 351 GLU A CA
|
|
962 C C . GLU A 149 ? 0.6913 0.7869 0.7915 -0.0093 -0.0020 -0.0958 351 GLU A C
|
|
963 O O . GLU A 149 ? 0.6884 0.8088 0.7980 0.0036 -0.0117 -0.1025 351 GLU A O
|
|
964 C CB . GLU A 149 ? 0.6615 0.8046 0.8283 -0.0422 0.0116 -0.0968 351 GLU A CB
|
|
965 C CG . GLU A 149 ? 0.7611 0.8950 0.9324 -0.0551 0.0320 -0.0812 351 GLU A CG
|
|
966 C CD . GLU A 149 ? 1.0092 1.1274 1.1966 -0.0773 0.0364 -0.0794 351 GLU A CD
|
|
967 O OE1 . GLU A 149 ? 1.2674 1.4141 1.4910 -0.0926 0.0356 -0.0841 351 GLU A OE1
|
|
968 O OE2 . GLU A 149 ? 0.7075 0.7863 0.8742 -0.0798 0.0419 -0.0726 351 GLU A OE2
|
|
969 N N . ASN A 150 ? 0.6301 0.6917 0.7002 -0.0057 0.0049 -0.0861 352 ASN A N
|
|
970 C CA . ASN A 150 ? 0.6168 0.6640 0.6623 0.0104 0.0019 -0.0823 352 ASN A CA
|
|
971 C C . ASN A 150 ? 0.6592 0.6719 0.6704 0.0159 -0.0068 -0.0809 352 ASN A C
|
|
972 O O . ASN A 150 ? 0.6427 0.6353 0.6318 0.0248 -0.0076 -0.0748 352 ASN A O
|
|
973 C CB . ASN A 150 ? 0.6112 0.6544 0.6533 0.0092 0.0166 -0.0721 352 ASN A CB
|
|
974 C CG . ASN A 150 ? 0.9233 1.0025 0.9913 0.0085 0.0252 -0.0725 352 ASN A CG
|
|
975 O OD1 . ASN A 150 ? 1.0193 1.1286 1.1065 0.0155 0.0193 -0.0813 352 ASN A OD1
|
|
976 N ND2 . ASN A 150 ? 0.7411 0.8210 0.8101 0.0010 0.0398 -0.0624 352 ASN A ND2
|
|
977 N N . VAL A 151 ? 0.6340 0.6401 0.6407 0.0094 -0.0126 -0.0868 353 VAL A N
|
|
978 C CA . VAL A 151 ? 0.6506 0.6294 0.6228 0.0145 -0.0198 -0.0862 353 VAL A CA
|
|
979 C C . VAL A 151 ? 0.7508 0.7440 0.7229 0.0219 -0.0395 -0.0977 353 VAL A C
|
|
980 O O . VAL A 151 ? 0.7617 0.7726 0.7538 0.0130 -0.0446 -0.1092 353 VAL A O
|
|
981 C CB . VAL A 151 ? 0.6722 0.6305 0.6330 0.0039 -0.0096 -0.0850 353 VAL A CB
|
|
982 C CG1 . VAL A 151 ? 0.6844 0.6197 0.6073 0.0104 -0.0147 -0.0840 353 VAL A CG1
|
|
983 C CG2 . VAL A 151 ? 0.6377 0.5883 0.6044 -0.0019 0.0079 -0.0734 353 VAL A CG2
|
|
984 N N . LEU A 152 ? 0.7067 0.6928 0.6586 0.0382 -0.0517 -0.0945 354 LEU A N
|
|
985 C CA . LEU A 152 ? 0.7120 0.7129 0.6615 0.0495 -0.0729 -0.1034 354 LEU A CA
|
|
986 C C . LEU A 152 ? 0.7860 0.7629 0.6937 0.0542 -0.0822 -0.1016 354 LEU A C
|
|
987 O O . LEU A 152 ? 0.7801 0.7261 0.6564 0.0555 -0.0739 -0.0887 354 LEU A O
|
|
988 C CB . LEU A 152 ? 0.7088 0.7188 0.6642 0.0682 -0.0826 -0.1011 354 LEU A CB
|
|
989 C CG . LEU A 152 ? 0.7202 0.7554 0.7107 0.0686 -0.0731 -0.1033 354 LEU A CG
|
|
990 C CD1 . LEU A 152 ? 0.7211 0.7463 0.7031 0.0890 -0.0794 -0.0993 354 LEU A CD1
|
|
991 C CD2 . LEU A 152 ? 0.7266 0.8088 0.7584 0.0639 -0.0780 -0.1163 354 LEU A CD2
|
|
992 N N . LEU A 153 ? 0.7537 0.7480 0.6613 0.0564 -0.0997 -0.1146 355 LEU A N
|
|
993 C CA . LEU A 153 ? 0.7938 0.7713 0.6586 0.0626 -0.1111 -0.1153 355 LEU A CA
|
|
994 C C . LEU A 153 ? 0.8706 0.8497 0.7163 0.0842 -0.1322 -0.1099 355 LEU A C
|
|
995 O O . LEU A 153 ? 0.8422 0.8506 0.7175 0.0931 -0.1457 -0.1168 355 LEU A O
|
|
996 C CB . LEU A 153 ? 0.8039 0.7962 0.6750 0.0515 -0.1191 -0.1354 355 LEU A CB
|
|
997 C CG . LEU A 153 ? 0.8168 0.8110 0.7179 0.0305 -0.1030 -0.1442 355 LEU A CG
|
|
998 C CD1 . LEU A 153 ? 0.8318 0.8291 0.7285 0.0218 -0.1134 -0.1646 355 LEU A CD1
|
|
999 C CD2 . LEU A 153 ? 0.8041 0.7686 0.6903 0.0253 -0.0795 -0.1309 355 LEU A CD2
|
|
1000 N N . SER A 154 ? 0.8788 0.8270 0.6758 0.0932 -0.1341 -0.0959 356 SER A N
|
|
1001 C CA . SER A 154 ? 0.9237 0.8640 0.6967 0.1147 -0.1531 -0.0857 356 SER A CA
|
|
1002 C C . SER A 154 ? 1.0241 0.9906 0.7909 0.1267 -0.1804 -0.0983 356 SER A C
|
|
1003 O O . SER A 154 ? 1.0361 1.0109 0.8045 0.1466 -0.1995 -0.0947 356 SER A O
|
|
1004 C CB . SER A 154 ? 1.0032 0.9002 0.7271 0.1185 -0.1446 -0.0627 356 SER A CB
|
|
1005 O OG . SER A 154 ? 1.2068 1.0959 0.8936 0.1120 -0.1405 -0.0634 356 SER A OG
|
|
1006 N N . SER A 155 ? 1.0020 0.9815 0.7625 0.1157 -0.1837 -0.1143 357 SER A N
|
|
1007 C CA . SER A 155 ? 1.0343 1.0415 0.7885 0.1242 -0.2111 -0.1301 357 SER A CA
|
|
1008 C C . SER A 155 ? 1.0915 1.1234 0.8722 0.1047 -0.2122 -0.1563 357 SER A C
|
|
1009 O O . SER A 155 ? 1.0709 1.0914 0.8656 0.0860 -0.1905 -0.1599 357 SER A O
|
|
1010 C CB . SER A 155 ? 1.1225 1.1064 0.8109 0.1388 -0.2223 -0.1183 357 SER A CB
|
|
1011 O OG . SER A 155 ? 1.2200 1.1828 0.8716 0.1272 -0.2069 -0.1194 357 SER A OG
|
|
1012 N N . GLN A 156 ? 1.0797 1.1439 0.8671 0.1093 -0.2389 -0.1745 358 GLN A N
|
|
1013 C CA . GLN A 156 ? 1.0807 1.1677 0.8942 0.0902 -0.2451 -0.2019 358 GLN A CA
|
|
1014 C C . GLN A 156 ? 1.1514 1.2096 0.9155 0.0835 -0.2395 -0.2103 358 GLN A C
|
|
1015 O O . GLN A 156 ? 1.1365 1.2032 0.9150 0.0675 -0.2436 -0.2345 358 GLN A O
|
|
1016 C CB . GLN A 156 ? 1.1168 1.2528 0.9578 0.0970 -0.2779 -0.2199 358 GLN A CB
|
|
1017 C CG . GLN A 156 ? 1.2916 1.4647 1.1912 0.1022 -0.2808 -0.2163 358 GLN A CG
|
|
1018 C CD . GLN A 156 ? 1.5942 1.7618 1.4745 0.1318 -0.2896 -0.1956 358 GLN A CD
|
|
1019 O OE1 . GLN A 156 ? 1.5310 1.6585 1.3542 0.1461 -0.2876 -0.1770 358 GLN A OE1
|
|
1020 N NE2 . GLN A 156 ? 1.5153 1.7228 1.4446 0.1416 -0.2983 -0.1978 358 GLN A NE2
|
|
1021 N N . GLU A 157 ? 1.1360 1.1596 0.8437 0.0953 -0.2285 -0.1901 359 GLU A N
|
|
1022 C CA . GLU A 157 ? 1.1671 1.1647 0.8230 0.0931 -0.2187 -0.1941 359 GLU A CA
|
|
1023 C C . GLU A 157 ? 1.1639 1.1389 0.8375 0.0764 -0.1872 -0.1913 359 GLU A C
|
|
1024 O O . GLU A 157 ? 1.1304 1.0983 0.8301 0.0735 -0.1706 -0.1733 359 GLU A O
|
|
1025 C CB . GLU A 157 ? 1.2284 1.2033 0.8204 0.1121 -0.2180 -0.1692 359 GLU A CB
|
|
1026 C CG . GLU A 157 ? 1.4138 1.4068 0.9796 0.1325 -0.2504 -0.1679 359 GLU A CG
|
|
1027 C CD . GLU A 157 ? 1.7284 1.7330 1.2512 0.1373 -0.2707 -0.1893 359 GLU A CD
|
|
1028 O OE1 . GLU A 157 ? 1.6049 1.6034 1.1205 0.1240 -0.2604 -0.2099 359 GLU A OE1
|
|
1029 O OE2 . GLU A 157 ? 1.6966 1.7155 1.1907 0.1561 -0.2980 -0.1859 359 GLU A OE2
|
|
1030 N N . GLU A 158 ? 1.1167 1.0810 0.7774 0.0666 -0.1800 -0.2105 360 GLU A N
|
|
1031 C CA . GLU A 158 ? 1.0801 1.0234 0.7587 0.0530 -0.1517 -0.2092 360 GLU A CA
|
|
1032 C C . GLU A 158 ? 1.0898 1.0084 0.7355 0.0597 -0.1273 -0.1832 360 GLU A C
|
|
1033 O O . GLU A 158 ? 1.0235 0.9308 0.6936 0.0512 -0.1052 -0.1730 360 GLU A O
|
|
1034 C CB . GLU A 158 ? 1.1190 1.0557 0.8008 0.0414 -0.1522 -0.2392 360 GLU A CB
|
|
1035 C CG . GLU A 158 ? 1.3438 1.2671 0.9642 0.0518 -0.1536 -0.2513 360 GLU A CG
|
|
1036 C CD . GLU A 158 ? 1.7274 1.6394 1.3499 0.0423 -0.1546 -0.2842 360 GLU A CD
|
|
1037 O OE1 . GLU A 158 ? 1.7497 1.6442 1.4036 0.0308 -0.1355 -0.2862 360 GLU A OE1
|
|
1038 O OE2 . GLU A 158 ? 1.6363 1.5544 1.2256 0.0478 -0.1748 -0.3079 360 GLU A OE2
|
|
1039 N N . ASP A 159 ? 1.0925 1.0047 0.6837 0.0743 -0.1318 -0.1713 361 ASP A N
|
|
1040 C CA . ASP A 159 ? 1.0929 0.9847 0.6529 0.0791 -0.1100 -0.1441 361 ASP A CA
|
|
1041 C C . ASP A 159 ? 1.1263 1.0181 0.6960 0.0861 -0.1182 -0.1206 361 ASP A C
|
|
1042 O O . ASP A 159 ? 1.1603 1.0567 0.7025 0.0998 -0.1387 -0.1148 361 ASP A O
|
|
1043 C CB . ASP A 159 ? 1.1798 1.0648 0.6728 0.0901 -0.1094 -0.1438 361 ASP A CB
|
|
1044 C CG . ASP A 159 ? 1.3411 1.2209 0.8177 0.0864 -0.0945 -0.1645 361 ASP A CG
|
|
1045 O OD1 . ASP A 159 ? 1.3053 1.1817 0.8240 0.0747 -0.0827 -0.1772 361 ASP A OD1
|
|
1046 O OD2 . ASP A 159 ? 1.4402 1.3182 0.8601 0.0965 -0.0928 -0.1664 361 ASP A OD2
|
|
1047 N N . CYS A 160 ? 1.0336 0.9219 0.6455 0.0779 -0.1053 -0.1101 362 CYS A N
|
|
1048 C CA . CYS A 160 ? 1.0203 0.9066 0.6468 0.0848 -0.1122 -0.0919 362 CYS A CA
|
|
1049 C C . CYS A 160 ? 1.0684 0.9391 0.7156 0.0765 -0.0897 -0.0745 362 CYS A C
|
|
1050 O O . CYS A 160 ? 1.0533 0.9201 0.7116 0.0649 -0.0695 -0.0772 362 CYS A O
|
|
1051 C CB . CYS A 160 ? 1.0009 0.9149 0.6693 0.0870 -0.1334 -0.1074 362 CYS A CB
|
|
1052 S SG . CYS A 160 ? 0.9919 0.9230 0.7257 0.0679 -0.1209 -0.1231 362 CYS A SG
|
|
1053 N N . LEU A 161 ? 1.0319 0.8933 0.6845 0.0837 -0.0947 -0.0577 363 LEU A N
|
|
1054 C CA . LEU A 161 ? 1.0003 0.8477 0.6738 0.0761 -0.0774 -0.0437 363 LEU A CA
|
|
1055 C C . LEU A 161 ? 0.9824 0.8502 0.7084 0.0703 -0.0771 -0.0570 363 LEU A C
|
|
1056 O O . LEU A 161 ? 0.9632 0.8527 0.7102 0.0768 -0.0941 -0.0693 363 LEU A O
|
|
1057 C CB . LEU A 161 ? 1.0284 0.8513 0.6832 0.0860 -0.0832 -0.0217 363 LEU A CB
|
|
1058 C CG . LEU A 161 ? 1.1280 0.9247 0.7318 0.0875 -0.0769 -0.0001 363 LEU A CG
|
|
1059 C CD1 . LEU A 161 ? 1.1595 0.9285 0.7473 0.0987 -0.0881 0.0205 363 LEU A CD1
|
|
1060 C CD2 . LEU A 161 ? 1.1267 0.9151 0.7301 0.0711 -0.0497 0.0089 363 LEU A CD2
|
|
1061 N N . ILE A 162 ? 0.9120 0.7768 0.6595 0.0581 -0.0577 -0.0543 364 ILE A N
|
|
1062 C CA . ILE A 162 ? 0.8683 0.7519 0.6620 0.0519 -0.0542 -0.0632 364 ILE A CA
|
|
1063 C C . ILE A 162 ? 0.9119 0.7840 0.7153 0.0537 -0.0486 -0.0503 364 ILE A C
|
|
1064 O O . ILE A 162 ? 0.9507 0.7982 0.7302 0.0534 -0.0421 -0.0349 364 ILE A O
|
|
1065 C CB . ILE A 162 ? 0.8705 0.7634 0.6860 0.0376 -0.0398 -0.0736 364 ILE A CB
|
|
1066 C CG1 . ILE A 162 ? 0.8691 0.7460 0.6767 0.0300 -0.0188 -0.0622 364 ILE A CG1
|
|
1067 C CG2 . ILE A 162 ? 0.8596 0.7599 0.6663 0.0360 -0.0478 -0.0902 364 ILE A CG2
|
|
1068 C CD1 . ILE A 162 ? 0.9368 0.8131 0.7672 0.0257 -0.0086 -0.0521 364 ILE A CD1
|
|
1069 N N . LYS A 163 ? 0.8088 0.6991 0.6466 0.0551 -0.0509 -0.0571 365 LYS A N
|
|
1070 C CA . LYS A 163 ? 0.7753 0.6564 0.6230 0.0576 -0.0463 -0.0497 365 LYS A CA
|
|
1071 C C . LYS A 163 ? 0.7718 0.6773 0.6562 0.0500 -0.0364 -0.0575 365 LYS A C
|
|
1072 O O . LYS A 163 ? 0.7325 0.6655 0.6407 0.0480 -0.0396 -0.0690 365 LYS A O
|
|
1073 C CB . LYS A 163 ? 0.8204 0.6943 0.6625 0.0756 -0.0633 -0.0481 365 LYS A CB
|
|
1074 C CG . LYS A 163 ? 0.9156 0.7583 0.7167 0.0835 -0.0723 -0.0345 365 LYS A CG
|
|
1075 C CD . LYS A 163 ? 1.0321 0.8553 0.8266 0.1009 -0.0863 -0.0288 365 LYS A CD
|
|
1076 C CE . LYS A 163 ? 1.1229 0.9241 0.8786 0.1120 -0.1002 -0.0167 365 LYS A CE
|
|
1077 N NZ . LYS A 163 ? 1.1685 0.9236 0.8977 0.1141 -0.0997 0.0032 365 LYS A NZ
|
|
1078 N N . ILE A 164 ? 0.7257 0.6216 0.6138 0.0440 -0.0240 -0.0505 366 ILE A N
|
|
1079 C CA . ILE A 164 ? 0.6944 0.6104 0.6102 0.0377 -0.0135 -0.0542 366 ILE A CA
|
|
1080 C C . ILE A 164 ? 0.7616 0.6884 0.6901 0.0502 -0.0211 -0.0601 366 ILE A C
|
|
1081 O O . ILE A 164 ? 0.7818 0.6867 0.6949 0.0600 -0.0287 -0.0568 366 ILE A O
|
|
1082 C CB . ILE A 164 ? 0.7328 0.6358 0.6439 0.0275 0.0007 -0.0446 366 ILE A CB
|
|
1083 C CG1 . ILE A 164 ? 0.7385 0.6338 0.6387 0.0183 0.0095 -0.0401 366 ILE A CG1
|
|
1084 C CG2 . ILE A 164 ? 0.7408 0.6632 0.6746 0.0237 0.0097 -0.0465 366 ILE A CG2
|
|
1085 C CD1 . ILE A 164 ? 0.7877 0.6985 0.7033 0.0127 0.0132 -0.0476 366 ILE A CD1
|
|
1086 N N . THR A 165 ? 0.7184 0.6786 0.6754 0.0500 -0.0186 -0.0688 367 THR A N
|
|
1087 C CA . THR A 165 ? 0.7097 0.6902 0.6834 0.0631 -0.0229 -0.0768 367 THR A CA
|
|
1088 C C . THR A 165 ? 0.7285 0.7332 0.7221 0.0563 -0.0079 -0.0779 367 THR A C
|
|
1089 O O . THR A 165 ? 0.6812 0.6853 0.6765 0.0417 0.0039 -0.0711 367 THR A O
|
|
1090 C CB . THR A 165 ? 0.7973 0.8033 0.7865 0.0725 -0.0362 -0.0864 367 THR A CB
|
|
1091 O OG1 . THR A 165 ? 0.8885 0.9068 0.8872 0.0918 -0.0438 -0.0939 367 THR A OG1
|
|
1092 C CG2 . THR A 165 ? 0.7221 0.7645 0.7415 0.0592 -0.0298 -0.0917 367 THR A CG2
|
|
1093 N N . ASP A 166 ? 0.7230 0.7496 0.7301 0.0689 -0.0086 -0.0863 368 ASP A N
|
|
1094 C CA . ASP A 166 ? 0.7162 0.7726 0.7399 0.0663 0.0051 -0.0883 368 ASP A CA
|
|
1095 C C . ASP A 166 ? 0.7214 0.7590 0.7281 0.0598 0.0143 -0.0815 368 ASP A C
|
|
1096 O O . ASP A 166 ? 0.6971 0.7364 0.7053 0.0450 0.0250 -0.0721 368 ASP A O
|
|
1097 C CB . ASP A 166 ? 0.7380 0.8322 0.7908 0.0536 0.0141 -0.0874 368 ASP A CB
|
|
1098 C CG . ASP A 166 ? 1.0124 1.1410 1.0819 0.0496 0.0301 -0.0859 368 ASP A CG
|
|
1099 O OD1 . ASP A 166 ? 1.0471 1.1865 1.1125 0.0637 0.0320 -0.0927 368 ASP A OD1
|
|
1100 O OD2 . ASP A 166 ? 1.1242 1.2684 1.2099 0.0330 0.0408 -0.0782 368 ASP A OD2
|
|
1101 N N . PHE A 167 ? 0.6523 0.6711 0.6436 0.0718 0.0083 -0.0873 369 PHE A N
|
|
1102 C CA . PHE A 167 ? 0.6314 0.6339 0.6074 0.0668 0.0130 -0.0844 369 PHE A CA
|
|
1103 C C . PHE A 167 ? 0.7060 0.7374 0.6873 0.0739 0.0207 -0.0928 369 PHE A C
|
|
1104 O O . PHE A 167 ? 0.7442 0.7631 0.7108 0.0755 0.0199 -0.0965 369 PHE A O
|
|
1105 C CB . PHE A 167 ? 0.6663 0.6248 0.6210 0.0708 0.0011 -0.0849 369 PHE A CB
|
|
1106 C CG . PHE A 167 ? 0.6778 0.6106 0.6224 0.0604 -0.0020 -0.0727 369 PHE A CG
|
|
1107 C CD1 . PHE A 167 ? 0.7289 0.6565 0.6726 0.0668 -0.0108 -0.0723 369 PHE A CD1
|
|
1108 C CD2 . PHE A 167 ? 0.6801 0.5972 0.6154 0.0457 0.0036 -0.0622 369 PHE A CD2
|
|
1109 C CE1 . PHE A 167 ? 0.7435 0.6498 0.6732 0.0584 -0.0126 -0.0617 369 PHE A CE1
|
|
1110 C CE2 . PHE A 167 ? 0.7316 0.6291 0.6566 0.0376 0.0031 -0.0517 369 PHE A CE2
|
|
1111 C CZ . PHE A 167 ? 0.7250 0.6167 0.6452 0.0439 -0.0044 -0.0516 369 PHE A CZ
|
|
1112 N N . GLY A 168 ? 0.6431 0.7153 0.6454 0.0768 0.0285 -0.0956 370 GLY A N
|
|
1113 C CA . GLY A 168 ? 0.6432 0.7525 0.6519 0.0836 0.0394 -0.1020 370 GLY A CA
|
|
1114 C C . GLY A 168 ? 0.7387 0.8545 0.7368 0.0725 0.0510 -0.0924 370 GLY A C
|
|
1115 O O . GLY A 168 ? 0.7807 0.9117 0.7686 0.0813 0.0553 -0.1001 370 GLY A O
|
|
1116 N N . HIS A 169 ? 0.7011 0.8064 0.7003 0.0552 0.0556 -0.0762 371 HIS A N
|
|
1117 C CA . HIS A 169 ? 0.7033 0.8124 0.6930 0.0454 0.0650 -0.0637 371 HIS A CA
|
|
1118 C C . HIS A 169 ? 0.7086 0.7830 0.6805 0.0408 0.0567 -0.0605 371 HIS A C
|
|
1119 O O . HIS A 169 ? 0.6703 0.7462 0.6362 0.0332 0.0618 -0.0494 371 HIS A O
|
|
1120 C CB . HIS A 169 ? 0.7183 0.8399 0.7246 0.0305 0.0764 -0.0471 371 HIS A CB
|
|
1121 C CG . HIS A 169 ? 0.7819 0.9411 0.8107 0.0302 0.0859 -0.0480 371 HIS A CG
|
|
1122 N ND1 . HIS A 169 ? 0.8139 0.9768 0.8654 0.0239 0.0835 -0.0491 371 HIS A ND1
|
|
1123 C CD2 . HIS A 169 ? 0.8228 1.0199 0.8547 0.0356 0.0973 -0.0492 371 HIS A CD2
|
|
1124 C CE1 . HIS A 169 ? 0.8090 1.0133 0.8813 0.0235 0.0937 -0.0498 371 HIS A CE1
|
|
1125 N NE2 . HIS A 169 ? 0.8196 1.0463 0.8804 0.0308 0.1036 -0.0492 371 HIS A NE2
|
|
1126 N N . SER A 170 ? 0.6848 0.7292 0.6497 0.0450 0.0440 -0.0687 372 SER A N
|
|
1127 C CA . SER A 170 ? 0.6878 0.7017 0.6399 0.0379 0.0371 -0.0647 372 SER A CA
|
|
1128 C C . SER A 170 ? 0.7583 0.7723 0.6965 0.0404 0.0334 -0.0717 372 SER A C
|
|
1129 O O . SER A 170 ? 0.7754 0.8046 0.7085 0.0518 0.0331 -0.0845 372 SER A O
|
|
1130 C CB . SER A 170 ? 0.7277 0.7091 0.6760 0.0387 0.0268 -0.0667 372 SER A CB
|
|
1131 O OG . SER A 170 ? 0.8824 0.8514 0.8243 0.0521 0.0167 -0.0809 372 SER A OG
|
|
1132 N N . LYS A 171 ? 0.7213 0.7242 0.6544 0.0300 0.0314 -0.0640 373 LYS A N
|
|
1133 C CA . LYS A 171 ? 0.7367 0.7424 0.6582 0.0298 0.0256 -0.0709 373 LYS A CA
|
|
1134 C C . LYS A 171 ? 0.8375 0.8120 0.7558 0.0210 0.0144 -0.0732 373 LYS A C
|
|
1135 O O . LYS A 171 ? 0.8299 0.7877 0.7546 0.0127 0.0155 -0.0627 373 LYS A O
|
|
1136 C CB . LYS A 171 ? 0.7318 0.7644 0.6536 0.0252 0.0335 -0.0581 373 LYS A CB
|
|
1137 N N . ILE A 172 ? 0.8489 0.8157 0.7570 0.0222 0.0038 -0.0876 374 ILE A N
|
|
1138 C CA . ILE A 172 ? 0.8730 0.8114 0.7807 0.0104 -0.0075 -0.0905 374 ILE A CA
|
|
1139 C C . ILE A 172 ? 0.9698 0.9294 0.8802 0.0004 -0.0097 -0.0868 374 ILE A C
|
|
1140 O O . ILE A 172 ? 0.9671 0.9502 0.8681 0.0071 -0.0116 -0.0952 374 ILE A O
|
|
1141 C CB . ILE A 172 ? 0.9332 0.8404 0.8302 0.0169 -0.0208 -0.1109 374 ILE A CB
|
|
1142 C CG1 . ILE A 172 ? 0.9414 0.8278 0.8374 0.0290 -0.0205 -0.1128 374 ILE A CG1
|
|
1143 C CG2 . ILE A 172 ? 0.9480 0.8256 0.8475 0.0000 -0.0321 -0.1119 374 ILE A CG2
|
|
1144 C CD1 . ILE A 172 ? 1.0328 0.9012 0.9179 0.0456 -0.0304 -0.1359 374 ILE A CD1
|
|
1145 N N . LEU A 173 ? 0.9653 0.9191 0.8879 -0.0146 -0.0099 -0.0746 375 LEU A N
|
|
1146 C CA . LEU A 173 ? 0.9751 0.9522 0.9064 -0.0244 -0.0128 -0.0692 375 LEU A CA
|
|
1147 C C . LEU A 173 ? 1.1353 1.1118 1.0621 -0.0301 -0.0289 -0.0865 375 LEU A C
|
|
1148 O O . LEU A 173 ? 1.1449 1.1519 1.0729 -0.0310 -0.0332 -0.0866 375 LEU A O
|
|
1149 C CB . LEU A 173 ? 0.9515 0.9266 0.9001 -0.0370 -0.0064 -0.0521 375 LEU A CB
|
|
1150 C CG . LEU A 173 ? 0.9742 0.9540 0.9259 -0.0305 0.0084 -0.0376 375 LEU A CG
|
|
1151 C CD1 . LEU A 173 ? 0.9572 0.9316 0.9215 -0.0406 0.0152 -0.0243 375 LEU A CD1
|
|
1152 C CD2 . LEU A 173 ? 1.0085 1.0189 0.9605 -0.0218 0.0144 -0.0310 375 LEU A CD2
|
|
1153 N N . GLY A 174 ? 1.3306 1.0986 1.1748 -0.0580 -0.0480 0.0636 376 GLY A N
|
|
1154 C CA . GLY A 174 ? 1.3836 1.1203 1.2017 -0.0599 -0.0699 0.0643 376 GLY A CA
|
|
1155 C C . GLY A 174 ? 1.4690 1.2240 1.3089 -0.0737 -0.0713 0.0653 376 GLY A C
|
|
1156 O O . GLY A 174 ? 1.4707 1.2440 1.3267 -0.1000 -0.0621 0.0686 376 GLY A O
|
|
1157 N N . GLU A 175 ? 1.4386 1.1897 1.2768 -0.0548 -0.0843 0.0625 377 GLU A N
|
|
1158 C CA . GLU A 175 ? 1.4342 1.2035 1.2920 -0.0632 -0.0886 0.0618 377 GLU A CA
|
|
1159 C C . GLU A 175 ? 1.4353 1.2384 1.3218 -0.0337 -0.0803 0.0588 377 GLU A C
|
|
1160 O O . GLU A 175 ? 1.4473 1.2348 1.3173 -0.0059 -0.0924 0.0566 377 GLU A O
|
|
1161 C CB . GLU A 175 ? 1.5048 1.2276 1.3253 -0.0725 -0.1174 0.0608 377 GLU A CB
|
|
1162 N N . THR A 176 ? 1.3284 1.1782 1.2560 -0.0378 -0.0589 0.0595 378 THR A N
|
|
1163 C CA . THR A 176 ? 1.2716 1.1566 1.2296 -0.0124 -0.0463 0.0581 378 THR A CA
|
|
1164 C C . THR A 176 ? 1.2908 1.1765 1.2476 0.0028 -0.0611 0.0550 378 THR A C
|
|
1165 O O . THR A 176 ? 1.3087 1.1877 1.2593 -0.0153 -0.0748 0.0531 378 THR A O
|
|
1166 C CB . THR A 176 ? 1.3334 1.2614 1.3286 -0.0219 -0.0214 0.0591 378 THR A CB
|
|
1167 O OG1 . THR A 176 ? 1.3698 1.2912 1.3594 -0.0399 -0.0125 0.0611 378 THR A OG1
|
|
1168 C CG2 . THR A 176 ? 1.2801 1.2346 1.3009 0.0050 -0.0054 0.0593 378 THR A CG2
|
|
1169 N N . SER A 177 ? 1.1890 1.0837 1.1515 0.0363 -0.0589 0.0548 379 SER A N
|
|
1170 C CA . SER A 177 ? 1.1682 1.0681 1.1310 0.0582 -0.0707 0.0516 379 SER A CA
|
|
1171 C C . SER A 177 ? 1.1353 1.0787 1.1347 0.0528 -0.0567 0.0500 379 SER A C
|
|
1172 O O . SER A 177 ? 1.1540 1.1040 1.1549 0.0600 -0.0684 0.0457 379 SER A O
|
|
1173 C CB . SER A 177 ? 1.2063 1.1084 1.1655 0.0965 -0.0691 0.0542 379 SER A CB
|
|
1174 O OG . SER A 177 ? 1.3151 1.2507 1.3061 0.1055 -0.0436 0.0591 379 SER A OG
|
|
1175 N N . LEU A 178 ? 0.9988 0.9708 1.0250 0.0412 -0.0330 0.0527 380 LEU A N
|
|
1176 C CA . LEU A 178 ? 0.9501 0.9644 1.0078 0.0373 -0.0181 0.0512 380 LEU A CA
|
|
1177 C C . LEU A 178 ? 1.0388 1.0590 1.0956 0.0079 -0.0294 0.0486 380 LEU A C
|
|
1178 O O . LEU A 178 ? 1.0225 1.0697 1.0945 0.0118 -0.0317 0.0450 380 LEU A O
|
|
1179 C CB . LEU A 178 ? 0.9057 0.9423 0.9852 0.0340 0.0076 0.0542 380 LEU A CB
|
|
1180 C CG . LEU A 178 ? 0.9141 0.9942 1.0226 0.0349 0.0248 0.0525 380 LEU A CG
|
|
1181 C CD1 . LEU A 178 ? 0.8909 0.9895 1.0124 0.0661 0.0282 0.0513 380 LEU A CD1
|
|
1182 C CD2 . LEU A 178 ? 0.9029 0.9940 1.0239 0.0308 0.0459 0.0545 380 LEU A CD2
|
|
1183 N N . MET A 179 ? 1.0413 1.0365 1.0792 -0.0211 -0.0374 0.0509 381 MET A N
|
|
1184 C CA . MET A 179 ? 1.0815 1.0794 1.1167 -0.0537 -0.0491 0.0512 381 MET A CA
|
|
1185 C C . MET A 179 ? 1.1432 1.1221 1.1634 -0.0486 -0.0754 0.0462 381 MET A C
|
|
1186 O O . MET A 179 ? 1.1447 1.1502 1.1803 -0.0619 -0.0807 0.0439 381 MET A O
|
|
1187 C CB . MET A 179 ? 1.1517 1.1187 1.1641 -0.0828 -0.0534 0.0563 381 MET A CB
|
|
1188 C CG . MET A 179 ? 1.1998 1.1837 1.2242 -0.0872 -0.0295 0.0600 381 MET A CG
|
|
1189 S SD . MET A 179 ? 1.3079 1.2473 1.2981 -0.1117 -0.0359 0.0654 381 MET A SD
|
|
1190 C CE . MET A 179 ? 1.2330 1.1979 1.2420 -0.1044 -0.0076 0.0662 381 MET A CE
|
|
1191 N N . ARG A 180 ? 1.1054 1.0420 1.0961 -0.0266 -0.0917 0.0440 382 ARG A N
|
|
1192 C CA . ARG A 180 ? 1.1219 1.0337 1.0920 -0.0140 -0.1187 0.0379 382 ARG A CA
|
|
1193 C C . ARG A 180 ? 1.1079 1.0615 1.1055 0.0110 -0.1136 0.0327 382 ARG A C
|
|
1194 O O . ARG A 180 ? 1.1090 1.0681 1.1080 0.0037 -0.1302 0.0272 382 ARG A O
|
|
1195 C CB . ARG A 180 ? 1.1508 1.0135 1.0822 0.0112 -0.1338 0.0372 382 ARG A CB
|
|
1196 N N . THR A 181 ? 1.0102 0.9931 1.0294 0.0391 -0.0905 0.0348 383 THR A N
|
|
1197 C CA . THR A 181 ? 0.9691 0.9924 1.0141 0.0666 -0.0803 0.0317 383 THR A CA
|
|
1198 C C . THR A 181 ? 0.9904 1.0595 1.0649 0.0457 -0.0717 0.0293 383 THR A C
|
|
1199 O O . THR A 181 ? 0.9807 1.0739 1.0662 0.0578 -0.0781 0.0233 383 THR A O
|
|
1200 C CB . THR A 181 ? 1.0348 1.0722 1.0933 0.0945 -0.0561 0.0374 383 THR A CB
|
|
1201 O OG1 . THR A 181 ? 1.0956 1.0998 1.1285 0.1177 -0.0661 0.0397 383 THR A OG1
|
|
1202 C CG2 . THR A 181 ? 0.9598 1.0379 1.0445 0.1210 -0.0415 0.0361 383 THR A CG2
|
|
1203 N N . LEU A 182 ? 0.9357 1.0192 1.0217 0.0157 -0.0577 0.0338 384 LEU A N
|
|
1204 C CA . LEU A 182 ? 0.9149 1.0469 1.0277 -0.0044 -0.0482 0.0330 384 LEU A CA
|
|
1205 C C . LEU A 182 ? 1.0216 1.1529 1.1294 -0.0316 -0.0720 0.0298 384 LEU A C
|
|
1206 O O . LEU A 182 ? 1.0324 1.2113 1.1643 -0.0430 -0.0679 0.0279 384 LEU A O
|
|
1207 C CB . LEU A 182 ? 0.8915 1.0396 1.0148 -0.0265 -0.0273 0.0394 384 LEU A CB
|
|
1208 C CG . LEU A 182 ? 0.8893 1.0492 1.0245 -0.0050 -0.0011 0.0419 384 LEU A CG
|
|
1209 C CD1 . LEU A 182 ? 0.8668 1.0469 1.0113 -0.0277 0.0155 0.0461 384 LEU A CD1
|
|
1210 C CD2 . LEU A 182 ? 0.8672 1.0606 1.0224 0.0280 0.0111 0.0381 384 LEU A CD2
|
|
1211 N N . CYS A 183 ? 1.0156 1.0939 1.0915 -0.0424 -0.0975 0.0292 385 CYS A N
|
|
1212 C CA . CYS A 183 ? 1.0584 1.1274 1.1262 -0.0709 -0.1235 0.0262 385 CYS A CA
|
|
1213 C C . CYS A 183 ? 1.1073 1.1930 1.1821 -0.0491 -0.1386 0.0161 385 CYS A C
|
|
1214 O O . CYS A 183 ? 1.1190 1.2207 1.2016 -0.0727 -0.1547 0.0126 385 CYS A O
|
|
1215 C CB . CYS A 183 ? 1.1151 1.1162 1.1418 -0.0894 -0.1470 0.0287 385 CYS A CB
|
|
1216 S SG . CYS A 183 ? 1.1776 1.1664 1.1976 -0.1279 -0.1338 0.0407 385 CYS A SG
|
|
1217 N N . GLY A 184 ? 1.0454 1.1313 1.1193 -0.0049 -0.1322 0.0122 386 GLY A N
|
|
1218 C CA . GLY A 184 ? 1.0484 1.1522 1.1283 0.0233 -0.1436 0.0026 386 GLY A CA
|
|
1219 C C . GLY A 184 ? 1.0666 1.2381 1.1845 0.0362 -0.1217 0.0005 386 GLY A C
|
|
1220 O O . GLY A 184 ? 1.0309 1.2382 1.1713 0.0226 -0.0975 0.0062 386 GLY A O
|
|
1221 N N . THR A 185 ? 1.0283 1.2167 1.1504 0.0653 -0.1313 -0.0085 387 THR A N
|
|
1222 C CA . THR A 185 ? 0.9929 1.2422 1.1456 0.0863 -0.1129 -0.0121 387 THR A CA
|
|
1223 C C . THR A 185 ? 0.9916 1.2397 1.1452 0.1274 -0.0887 -0.0071 387 THR A C
|
|
1224 O O . THR A 185 ? 1.0118 1.2197 1.1426 0.1514 -0.0964 -0.0057 387 THR A O
|
|
1225 C CB . THR A 185 ? 1.1632 1.4324 1.3195 0.0969 -0.1354 -0.0244 387 THR A CB
|
|
1226 O OG1 . THR A 185 ? 1.1139 1.4485 1.3010 0.1113 -0.1166 -0.0276 387 THR A OG1
|
|
1227 C CG2 . THR A 185 ? 1.1913 1.4213 1.3206 0.1367 -0.1545 -0.0306 387 THR A CG2
|
|
1228 N N . PRO A 186 ? 0.8770 1.1675 1.0549 0.1362 -0.0598 -0.0036 388 PRO A N
|
|
1229 C CA . PRO A 186 ? 0.8322 1.1168 1.0101 0.1712 -0.0373 0.0026 388 PRO A CA
|
|
1230 C C . PRO A 186 ? 0.7984 1.1038 0.9811 0.2162 -0.0337 -0.0017 388 PRO A C
|
|
1231 O O . PRO A 186 ? 0.7693 1.0781 0.9564 0.2432 -0.0118 0.0047 388 PRO A O
|
|
1232 C CB . PRO A 186 ? 0.8393 1.1498 1.0353 0.1560 -0.0105 0.0083 388 PRO A CB
|
|
1233 C CG . PRO A 186 ? 0.9057 1.2612 1.1190 0.1303 -0.0146 0.0028 388 PRO A CG
|
|
1234 C CD . PRO A 186 ? 0.8787 1.2225 1.0825 0.1147 -0.0464 -0.0043 388 PRO A CD
|
|
1235 N N . THR A 187 ? 0.7345 1.0500 0.9141 0.2247 -0.0559 -0.0119 389 THR A N
|
|
1236 C CA . THR A 187 ? 0.7206 1.0562 0.9022 0.2698 -0.0548 -0.0170 389 THR A CA
|
|
1237 C C . THR A 187 ? 0.7500 1.0607 0.9199 0.3072 -0.0412 -0.0074 389 THR A C
|
|
1238 O O . THR A 187 ? 0.7241 1.0582 0.9051 0.3367 -0.0189 -0.0034 389 THR A O
|
|
1239 C CB . THR A 187 ? 0.7841 1.1161 0.9547 0.2744 -0.0877 -0.0297 389 THR A CB
|
|
1240 O OG1 . THR A 187 ? 0.8118 1.1471 0.9865 0.2281 -0.1056 -0.0348 389 THR A OG1
|
|
1241 C CG2 . THR A 187 ? 0.7268 1.1025 0.9096 0.3101 -0.0849 -0.0383 389 THR A CG2
|
|
1242 N N . TYR A 188 ? 0.7064 0.9705 0.8538 0.3035 -0.0536 -0.0025 390 TYR A N
|
|
1243 C CA . TYR A 188 ? 0.6722 0.9135 0.8075 0.3345 -0.0438 0.0081 390 TYR A CA
|
|
1244 C C . TYR A 188 ? 0.6843 0.9106 0.8241 0.3168 -0.0227 0.0204 390 TYR A C
|
|
1245 O O . TYR A 188 ? 0.6897 0.9009 0.8225 0.3383 -0.0137 0.0306 390 TYR A O
|
|
1246 C CB . TYR A 188 ? 0.6936 0.8983 0.7986 0.3492 -0.0723 0.0049 390 TYR A CB
|
|
1247 C CG . TYR A 188 ? 0.7079 0.9211 0.8056 0.3617 -0.0979 -0.0093 390 TYR A CG
|
|
1248 C CD1 . TYR A 188 ? 0.7247 0.9577 0.8218 0.4079 -0.0969 -0.0118 390 TYR A CD1
|
|
1249 C CD2 . TYR A 188 ? 0.7366 0.9377 0.8276 0.3269 -0.1237 -0.0201 390 TYR A CD2
|
|
1250 C CE1 . TYR A 188 ? 0.7443 0.9872 0.8353 0.4203 -0.1213 -0.0265 390 TYR A CE1
|
|
1251 C CE2 . TYR A 188 ? 0.7735 0.9821 0.8587 0.3361 -0.1493 -0.0341 390 TYR A CE2
|
|
1252 C CZ . TYR A 188 ? 0.8656 1.0958 0.9510 0.3836 -0.1483 -0.0382 390 TYR A CZ
|
|
1253 O OH . TYR A 188 ? 0.9031 1.1402 0.9817 0.3938 -0.1754 -0.0534 390 TYR A OH
|
|
1254 N N . LEU A 189 ? 0.6113 0.8450 0.7633 0.2794 -0.0146 0.0199 391 LEU A N
|
|
1255 C CA . LEU A 189 ? 0.6062 0.8252 0.7613 0.2613 0.0030 0.0294 391 LEU A CA
|
|
1256 C C . LEU A 189 ? 0.6531 0.8904 0.8253 0.2791 0.0333 0.0374 391 LEU A C
|
|
1257 O O . LEU A 189 ? 0.6373 0.9067 0.8253 0.2810 0.0462 0.0338 391 LEU A O
|
|
1258 C CB . LEU A 189 ? 0.6169 0.8356 0.7753 0.2165 -0.0011 0.0260 391 LEU A CB
|
|
1259 C CG . LEU A 189 ? 0.6815 0.8745 0.8345 0.1930 0.0071 0.0334 391 LEU A CG
|
|
1260 C CD1 . LEU A 189 ? 0.6780 0.8295 0.8066 0.2012 -0.0065 0.0377 391 LEU A CD1
|
|
1261 C CD2 . LEU A 189 ? 0.7605 0.9570 0.9154 0.1515 0.0015 0.0302 391 LEU A CD2
|
|
1262 N N . ALA A 190 ? 0.5992 0.8151 0.7666 0.2909 0.0438 0.0487 392 ALA A N
|
|
1263 C CA . ALA A 190 ? 0.5540 0.7758 0.7337 0.3052 0.0701 0.0586 392 ALA A CA
|
|
1264 C C . ALA A 190 ? 0.5861 0.8169 0.7778 0.2794 0.0849 0.0565 392 ALA A C
|
|
1265 O O . ALA A 190 ? 0.5804 0.8029 0.7687 0.2471 0.0763 0.0523 392 ALA A O
|
|
1266 C CB . ALA A 190 ? 0.5557 0.7521 0.7280 0.3109 0.0733 0.0706 392 ALA A CB
|
|
1267 N N . PRO A 191 ? 0.5269 0.7740 0.7300 0.2948 0.1064 0.0592 393 PRO A N
|
|
1268 C CA . PRO A 191 ? 0.5273 0.7837 0.7383 0.2750 0.1200 0.0562 393 PRO A CA
|
|
1269 C C . PRO A 191 ? 0.5970 0.8267 0.8055 0.2493 0.1247 0.0611 393 PRO A C
|
|
1270 O O . PRO A 191 ? 0.6159 0.8507 0.8256 0.2234 0.1246 0.0560 393 PRO A O
|
|
1271 C CB . PRO A 191 ? 0.5461 0.8159 0.7629 0.3040 0.1403 0.0592 393 PRO A CB
|
|
1272 C CG . PRO A 191 ? 0.5843 0.8583 0.7985 0.3372 0.1368 0.0628 393 PRO A CG
|
|
1273 C CD . PRO A 191 ? 0.5281 0.7828 0.7340 0.3327 0.1192 0.0659 393 PRO A CD
|
|
1274 N N . GLU A 192 ? 0.5376 0.7421 0.7429 0.2563 0.1284 0.0711 394 GLU A N
|
|
1275 C CA . GLU A 192 ? 0.5328 0.7136 0.7362 0.2328 0.1320 0.0749 394 GLU A CA
|
|
1276 C C . GLU A 192 ? 0.6137 0.7851 0.8081 0.2022 0.1156 0.0691 394 GLU A C
|
|
1277 O O . GLU A 192 ? 0.6364 0.7962 0.8297 0.1796 0.1196 0.0685 394 GLU A O
|
|
1278 C CB . GLU A 192 ? 0.5351 0.6963 0.7385 0.2449 0.1372 0.0874 394 GLU A CB
|
|
1279 C CG . GLU A 192 ? 0.5666 0.7240 0.7610 0.2580 0.1217 0.0913 394 GLU A CG
|
|
1280 C CD . GLU A 192 ? 0.5607 0.7322 0.7557 0.2936 0.1223 0.0961 394 GLU A CD
|
|
1281 O OE1 . GLU A 192 ? 0.5838 0.7730 0.7853 0.3099 0.1317 0.0934 394 GLU A OE1
|
|
1282 O OE2 . GLU A 192 ? 0.4214 0.5873 0.6080 0.3073 0.1125 0.1023 394 GLU A OE2
|
|
1283 N N . VAL A 193 ? 0.5392 0.7138 0.7253 0.2023 0.0967 0.0647 395 VAL A N
|
|
1284 C CA . VAL A 193 ? 0.5229 0.6844 0.6968 0.1745 0.0793 0.0600 395 VAL A CA
|
|
1285 C C . VAL A 193 ? 0.5475 0.7299 0.7287 0.1511 0.0830 0.0535 395 VAL A C
|
|
1286 O O . VAL A 193 ? 0.5594 0.7312 0.7354 0.1244 0.0815 0.0530 395 VAL A O
|
|
1287 C CB . VAL A 193 ? 0.5669 0.7199 0.7264 0.1835 0.0564 0.0572 395 VAL A CB
|
|
1288 C CG1 . VAL A 193 ? 0.5755 0.7104 0.7193 0.1532 0.0374 0.0525 395 VAL A CG1
|
|
1289 C CG2 . VAL A 193 ? 0.5560 0.6916 0.7062 0.2087 0.0538 0.0651 395 VAL A CG2
|
|
1290 N N . LEU A 194 ? 0.4621 0.6770 0.6552 0.1630 0.0893 0.0492 396 LEU A N
|
|
1291 C CA . LEU A 194 ? 0.4561 0.7011 0.6578 0.1452 0.0944 0.0438 396 LEU A CA
|
|
1292 C C . LEU A 194 ? 0.5535 0.7982 0.7592 0.1400 0.1138 0.0459 396 LEU A C
|
|
1293 O O . LEU A 194 ? 0.5627 0.8208 0.7695 0.1179 0.1162 0.0436 396 LEU A O
|
|
1294 C CB . LEU A 194 ? 0.4460 0.7298 0.6587 0.1647 0.0959 0.0384 396 LEU A CB
|
|
1295 C CG . LEU A 194 ? 0.5060 0.7938 0.7149 0.1684 0.0739 0.0338 396 LEU A CG
|
|
1296 C CD1 . LEU A 194 ? 0.4855 0.8089 0.7046 0.1966 0.0775 0.0286 396 LEU A CD1
|
|
1297 C CD2 . LEU A 194 ? 0.5502 0.8411 0.7558 0.1323 0.0561 0.0302 396 LEU A CD2
|
|
1298 N N . VAL A 195 ? 0.5392 0.7668 0.7454 0.1599 0.1267 0.0507 397 VAL A N
|
|
1299 C CA . VAL A 195 ? 0.5405 0.7589 0.7475 0.1585 0.1434 0.0523 397 VAL A CA
|
|
1300 C C . VAL A 195 ? 0.6127 0.8040 0.8119 0.1334 0.1389 0.0541 397 VAL A C
|
|
1301 O O . VAL A 195 ? 0.6550 0.8461 0.8529 0.1222 0.1475 0.0519 397 VAL A O
|
|
1302 C CB . VAL A 195 ? 0.5838 0.7902 0.7936 0.1871 0.1568 0.0580 397 VAL A CB
|
|
1303 C CG1 . VAL A 195 ? 0.5850 0.7674 0.7924 0.1820 0.1691 0.0607 397 VAL A CG1
|
|
1304 C CG2 . VAL A 195 ? 0.5746 0.8103 0.7894 0.2124 0.1653 0.0547 397 VAL A CG2
|
|
1305 N N . SER A 196 ? 0.5475 0.7171 0.7393 0.1265 0.1250 0.0574 398 SER A N
|
|
1306 C CA . SER A 196 ? 0.5455 0.6897 0.7273 0.1047 0.1192 0.0588 398 SER A CA
|
|
1307 C C . SER A 196 ? 0.6369 0.7886 0.8121 0.0770 0.1115 0.0545 398 SER A C
|
|
1308 O O . SER A 196 ? 0.6660 0.8002 0.8324 0.0591 0.1100 0.0548 398 SER A O
|
|
1309 C CB . SER A 196 ? 0.5770 0.6979 0.7495 0.1103 0.1064 0.0636 398 SER A CB
|
|
1310 O OG . SER A 196 ? 0.7042 0.8304 0.8705 0.1147 0.0908 0.0617 398 SER A OG
|
|
1311 N N . VAL A 197 ? 0.5927 0.7722 0.7725 0.0732 0.1066 0.0511 399 VAL A N
|
|
1312 C CA . VAL A 197 ? 0.5986 0.7914 0.7747 0.0454 0.0993 0.0493 399 VAL A CA
|
|
1313 C C . VAL A 197 ? 0.6748 0.8786 0.8525 0.0336 0.1134 0.0486 399 VAL A C
|
|
1314 O O . VAL A 197 ? 0.6933 0.8899 0.8619 0.0098 0.1087 0.0499 399 VAL A O
|
|
1315 C CB . VAL A 197 ? 0.6431 0.8692 0.8277 0.0447 0.0913 0.0462 399 VAL A CB
|
|
1316 C CG1 . VAL A 197 ? 0.6556 0.9004 0.8394 0.0129 0.0848 0.0466 399 VAL A CG1
|
|
1317 C CG2 . VAL A 197 ? 0.6439 0.8522 0.8217 0.0557 0.0740 0.0458 399 VAL A CG2
|
|
1318 N N . GLY A 198 ? 0.6333 0.8497 0.8191 0.0524 0.1299 0.0467 400 GLY A N
|
|
1319 C CA . GLY A 198 ? 0.6437 0.8692 0.8279 0.0478 0.1428 0.0448 400 GLY A CA
|
|
1320 C C . GLY A 198 ? 0.7395 0.9311 0.9125 0.0361 0.1428 0.0456 400 GLY A C
|
|
1321 O O . GLY A 198 ? 0.7551 0.9538 0.9222 0.0216 0.1461 0.0446 400 GLY A O
|
|
1322 N N . THR A 199 ? 0.7012 0.8589 0.8712 0.0432 0.1389 0.0479 401 THR A N
|
|
1323 C CA . THR A 199 ? 0.6973 0.8239 0.8578 0.0337 0.1376 0.0483 401 THR A CA
|
|
1324 C C . THR A 199 ? 0.7217 0.8304 0.8693 0.0148 0.1224 0.0506 401 THR A C
|
|
1325 O O . THR A 199 ? 0.7429 0.8355 0.8799 0.0017 0.1211 0.0497 401 THR A O
|
|
1326 C CB . THR A 199 ? 0.8225 0.9270 0.9878 0.0505 0.1422 0.0505 401 THR A CB
|
|
1327 O OG1 . THR A 199 ? 0.9126 1.0088 1.0783 0.0568 0.1320 0.0554 401 THR A OG1
|
|
1328 C CG2 . THR A 199 ? 0.8287 0.9444 1.0033 0.0717 0.1560 0.0494 401 THR A CG2
|
|
1329 N N . ALA A 200 ? 0.6262 0.7348 0.7718 0.0153 0.1099 0.0531 402 ALA A N
|
|
1330 C CA . ALA A 200 ? 0.6074 0.6931 0.7357 0.0011 0.0929 0.0551 402 ALA A CA
|
|
1331 C C . ALA A 200 ? 0.6702 0.7488 0.7847 -0.0237 0.0903 0.0550 402 ALA A C
|
|
1332 O O . ALA A 200 ? 0.7068 0.8100 0.8259 -0.0358 0.0960 0.0547 402 ALA A O
|
|
1333 C CB . ALA A 200 ? 0.6104 0.7035 0.7378 0.0024 0.0800 0.0557 402 ALA A CB
|
|
1334 N N . GLY A 201 ? 0.6017 0.6497 0.6989 -0.0295 0.0824 0.0559 403 GLY A N
|
|
1335 C CA . GLY A 201 ? 0.6061 0.6430 0.6866 -0.0509 0.0797 0.0563 403 GLY A CA
|
|
1336 C C . GLY A 201 ? 0.6465 0.6857 0.7288 -0.0521 0.0924 0.0532 403 GLY A C
|
|
1337 O O . GLY A 201 ? 0.6838 0.7223 0.7544 -0.0683 0.0929 0.0538 403 GLY A O
|
|
1338 N N . TYR A 202 ? 0.5476 0.5883 0.6434 -0.0352 0.1023 0.0502 404 TYR A N
|
|
1339 C CA . TYR A 202 ? 0.5233 0.5605 0.6197 -0.0341 0.1119 0.0457 404 TYR A CA
|
|
1340 C C . TYR A 202 ? 0.5818 0.5941 0.6753 -0.0277 0.1078 0.0447 404 TYR A C
|
|
1341 O O . TYR A 202 ? 0.5960 0.6040 0.6955 -0.0228 0.1151 0.0407 404 TYR A O
|
|
1342 C CB . TYR A 202 ? 0.5208 0.5798 0.6332 -0.0218 0.1263 0.0425 404 TYR A CB
|
|
1343 C CG . TYR A 202 ? 0.5708 0.6575 0.6813 -0.0303 0.1326 0.0418 404 TYR A CG
|
|
1344 C CD1 . TYR A 202 ? 0.5962 0.7085 0.7114 -0.0370 0.1302 0.0459 404 TYR A CD1
|
|
1345 C CD2 . TYR A 202 ? 0.5827 0.6714 0.6853 -0.0331 0.1395 0.0376 404 TYR A CD2
|
|
1346 C CE1 . TYR A 202 ? 0.5749 0.7189 0.6899 -0.0471 0.1359 0.0473 404 TYR A CE1
|
|
1347 C CE2 . TYR A 202 ? 0.5960 0.7148 0.6957 -0.0405 0.1453 0.0388 404 TYR A CE2
|
|
1348 C CZ . TYR A 202 ? 0.6447 0.7933 0.7518 -0.0480 0.1442 0.0444 404 TYR A CZ
|
|
1349 O OH . TYR A 202 ? 0.6813 0.8667 0.7882 -0.0557 0.1509 0.0471 404 TYR A OH
|
|
1350 N N . ASN A 203 ? 0.5278 0.5240 0.6109 -0.0273 0.0952 0.0482 405 ASN A N
|
|
1351 C CA . ASN A 203 ? 0.5290 0.5089 0.6103 -0.0199 0.0910 0.0485 405 ASN A CA
|
|
1352 C C . ASN A 203 ? 0.5799 0.5467 0.6478 -0.0300 0.0896 0.0437 405 ASN A C
|
|
1353 O O . ASN A 203 ? 0.5628 0.5240 0.6367 -0.0256 0.0911 0.0415 405 ASN A O
|
|
1354 C CB . ASN A 203 ? 0.5428 0.5120 0.6131 -0.0122 0.0775 0.0534 405 ASN A CB
|
|
1355 C CG . ASN A 203 ? 0.9742 0.9533 1.0510 -0.0021 0.0746 0.0574 405 ASN A CG
|
|
1356 O OD1 . ASN A 203 ? 0.9715 0.9609 1.0495 -0.0090 0.0750 0.0568 405 ASN A OD1
|
|
1357 N ND2 . ASN A 203 ? 0.9458 0.9223 1.0237 0.0144 0.0691 0.0617 405 ASN A ND2
|
|
1358 N N . ARG A 204 ? 0.5461 0.5097 0.5967 -0.0440 0.0870 0.0425 406 ARG A N
|
|
1359 C CA . ARG A 204 ? 0.5528 0.5051 0.5869 -0.0531 0.0859 0.0380 406 ARG A CA
|
|
1360 C C . ARG A 204 ? 0.5872 0.5468 0.6341 -0.0499 0.0967 0.0315 406 ARG A C
|
|
1361 O O . ARG A 204 ? 0.6204 0.5692 0.6586 -0.0517 0.0947 0.0262 406 ARG A O
|
|
1362 C CB . ARG A 204 ? 0.5649 0.5167 0.5802 -0.0688 0.0835 0.0406 406 ARG A CB
|
|
1363 C CG . ARG A 204 ? 0.5846 0.5629 0.6118 -0.0739 0.0953 0.0410 406 ARG A CG
|
|
1364 C CD . ARG A 204 ? 0.5266 0.5085 0.5379 -0.0914 0.0926 0.0467 406 ARG A CD
|
|
1365 N NE . ARG A 204 ? 0.6394 0.6124 0.6449 -0.0973 0.0810 0.0528 406 ARG A NE
|
|
1366 C CZ . ARG A 204 ? 0.8044 0.7761 0.7965 -0.1153 0.0752 0.0595 406 ARG A CZ
|
|
1367 N NH1 . ARG A 204 ? 0.6883 0.6717 0.6731 -0.1291 0.0817 0.0626 406 ARG A NH1
|
|
1368 N NH2 . ARG A 204 ? 0.6951 0.6535 0.6803 -0.1197 0.0622 0.0635 406 ARG A NH2
|
|
1369 N N . ALA A 205 ? 0.5165 0.4931 0.5813 -0.0438 0.1073 0.0310 407 ALA A N
|
|
1370 C CA . ALA A 205 ? 0.5058 0.4846 0.5795 -0.0378 0.1166 0.0242 407 ALA A CA
|
|
1371 C C . ALA A 205 ? 0.5693 0.5321 0.6511 -0.0327 0.1139 0.0211 407 ALA A C
|
|
1372 O O . ALA A 205 ? 0.5905 0.5462 0.6726 -0.0317 0.1170 0.0137 407 ALA A O
|
|
1373 C CB . ALA A 205 ? 0.4957 0.4930 0.5839 -0.0286 0.1268 0.0251 407 ALA A CB
|
|
1374 N N . VAL A 206 ? 0.5187 0.4767 0.6057 -0.0298 0.1072 0.0269 408 VAL A N
|
|
1375 C CA . VAL A 206 ? 0.5194 0.4687 0.6159 -0.0273 0.1042 0.0262 408 VAL A CA
|
|
1376 C C . VAL A 206 ? 0.5871 0.5259 0.6695 -0.0352 0.0978 0.0184 408 VAL A C
|
|
1377 O O . VAL A 206 ? 0.6168 0.5495 0.7078 -0.0362 0.0975 0.0135 408 VAL A O
|
|
1378 C CB . VAL A 206 ? 0.5596 0.5132 0.6650 -0.0198 0.0992 0.0355 408 VAL A CB
|
|
1379 C CG1 . VAL A 206 ? 0.5550 0.5191 0.6742 -0.0094 0.1059 0.0424 408 VAL A CG1
|
|
1380 C CG2 . VAL A 206 ? 0.5502 0.5001 0.6353 -0.0209 0.0873 0.0378 408 VAL A CG2
|
|
1381 N N . ASP A 207 ? 0.5329 0.4685 0.5929 -0.0411 0.0922 0.0174 409 ASP A N
|
|
1382 C CA . ASP A 207 ? 0.5421 0.4680 0.5834 -0.0467 0.0863 0.0102 409 ASP A CA
|
|
1383 C C . ASP A 207 ? 0.6271 0.5515 0.6667 -0.0486 0.0925 0.0008 409 ASP A C
|
|
1384 O O . ASP A 207 ? 0.6258 0.5422 0.6581 -0.0501 0.0881 -0.0076 409 ASP A O
|
|
1385 C CB . ASP A 207 ? 0.5610 0.4809 0.5759 -0.0518 0.0798 0.0137 409 ASP A CB
|
|
1386 C CG . ASP A 207 ? 0.6000 0.5127 0.6040 -0.0477 0.0687 0.0190 409 ASP A CG
|
|
1387 O OD1 . ASP A 207 ? 0.5591 0.4762 0.5759 -0.0407 0.0656 0.0194 409 ASP A OD1
|
|
1388 O OD2 . ASP A 207 ? 0.6375 0.5395 0.6175 -0.0514 0.0623 0.0228 409 ASP A OD2
|
|
1389 N N . CYS A 208 ? 0.6190 0.5525 0.6637 -0.0466 0.1019 0.0015 410 CYS A N
|
|
1390 C CA . CYS A 208 ? 0.6446 0.5780 0.6849 -0.0439 0.1078 -0.0074 410 CYS A CA
|
|
1391 C C . CYS A 208 ? 0.6792 0.6024 0.7347 -0.0379 0.1092 -0.0137 410 CYS A C
|
|
1392 O O . CYS A 208 ? 0.7079 0.6210 0.7559 -0.0361 0.1077 -0.0241 410 CYS A O
|
|
1393 C CB . CYS A 208 ? 0.6652 0.6167 0.7026 -0.0423 0.1169 -0.0039 410 CYS A CB
|
|
1394 S SG . CYS A 208 ? 0.7308 0.6913 0.7487 -0.0543 0.1143 0.0043 410 CYS A SG
|
|
1395 N N . TRP A 209 ? 0.6044 0.5277 0.6793 -0.0350 0.1108 -0.0072 411 TRP A N
|
|
1396 C CA . TRP A 209 ? 0.6054 0.5152 0.6948 -0.0322 0.1112 -0.0106 411 TRP A CA
|
|
1397 C C . TRP A 209 ? 0.7066 0.6057 0.7944 -0.0400 0.1008 -0.0170 411 TRP A C
|
|
1398 O O . TRP A 209 ? 0.7366 0.6216 0.8193 -0.0404 0.0980 -0.0280 411 TRP A O
|
|
1399 C CB . TRP A 209 ? 0.5621 0.4765 0.6720 -0.0282 0.1148 0.0006 411 TRP A CB
|
|
1400 C CG . TRP A 209 ? 0.5831 0.4815 0.7081 -0.0281 0.1151 -0.0002 411 TRP A CG
|
|
1401 C CD1 . TRP A 209 ? 0.6182 0.5119 0.7557 -0.0359 0.1083 0.0022 411 TRP A CD1
|
|
1402 C CD2 . TRP A 209 ? 0.5970 0.4802 0.7232 -0.0208 0.1215 -0.0041 411 TRP A CD2
|
|
1403 N NE1 . TRP A 209 ? 0.6270 0.5025 0.7757 -0.0369 0.1101 0.0013 411 TRP A NE1
|
|
1404 C CE2 . TRP A 209 ? 0.6537 0.5188 0.7935 -0.0267 0.1177 -0.0030 411 TRP A CE2
|
|
1405 C CE3 . TRP A 209 ? 0.6271 0.5110 0.7430 -0.0091 0.1297 -0.0079 411 TRP A CE3
|
|
1406 C CZ2 . TRP A 209 ? 0.6693 0.5104 0.8106 -0.0218 0.1214 -0.0052 411 TRP A CZ2
|
|
1407 C CZ3 . TRP A 209 ? 0.6698 0.5323 0.7856 -0.0007 0.1337 -0.0111 411 TRP A CZ3
|
|
1408 C CH2 . TRP A 209 ? 0.6913 0.5291 0.8184 -0.0074 0.1292 -0.0099 411 TRP A CH2
|
|
1409 N N . SER A 210 ? 0.6517 0.5585 0.7408 -0.0444 0.0940 -0.0110 412 SER A N
|
|
1410 C CA . SER A 210 ? 0.6439 0.5483 0.7318 -0.0504 0.0837 -0.0157 412 SER A CA
|
|
1411 C C . SER A 210 ? 0.7012 0.5965 0.7696 -0.0524 0.0790 -0.0294 412 SER A C
|
|
1412 O O . SER A 210 ? 0.7114 0.5986 0.7841 -0.0564 0.0723 -0.0383 412 SER A O
|
|
1413 C CB . SER A 210 ? 0.6716 0.5879 0.7543 -0.0497 0.0781 -0.0073 412 SER A CB
|
|
1414 O OG . SER A 210 ? 0.7823 0.7083 0.8823 -0.0452 0.0814 0.0050 412 SER A OG
|
|
1415 N N . LEU A 211 ? 0.6524 0.5497 0.6998 -0.0498 0.0824 -0.0308 413 LEU A N
|
|
1416 C CA . LEU A 211 ? 0.6632 0.5542 0.6891 -0.0487 0.0800 -0.0422 413 LEU A CA
|
|
1417 C C . LEU A 211 ? 0.7366 0.6156 0.7657 -0.0443 0.0816 -0.0533 413 LEU A C
|
|
1418 O O . LEU A 211 ? 0.7592 0.6283 0.7778 -0.0433 0.0748 -0.0659 413 LEU A O
|
|
1419 C CB . LEU A 211 ? 0.6527 0.5519 0.6581 -0.0476 0.0858 -0.0374 413 LEU A CB
|
|
1420 C CG . LEU A 211 ? 0.6792 0.5803 0.6684 -0.0520 0.0808 -0.0301 413 LEU A CG
|
|
1421 C CD1 . LEU A 211 ? 0.6786 0.5855 0.6490 -0.0542 0.0867 -0.0248 413 LEU A CD1
|
|
1422 C CD2 . LEU A 211 ? 0.7062 0.5997 0.6815 -0.0519 0.0705 -0.0381 413 LEU A CD2
|
|
1423 N N . GLY A 212 ? 0.6765 0.5545 0.7177 -0.0399 0.0897 -0.0492 414 GLY A N
|
|
1424 C CA . GLY A 212 ? 0.6929 0.5547 0.7337 -0.0331 0.0910 -0.0588 414 GLY A CA
|
|
1425 C C . GLY A 212 ? 0.7539 0.5963 0.8085 -0.0396 0.0817 -0.0648 414 GLY A C
|
|
1426 O O . GLY A 212 ? 0.8068 0.6294 0.8527 -0.0366 0.0760 -0.0780 414 GLY A O
|
|
1427 N N . VAL A 213 ? 0.6664 0.5150 0.7423 -0.0486 0.0796 -0.0549 415 VAL A N
|
|
1428 C CA . VAL A 213 ? 0.6536 0.4912 0.7475 -0.0588 0.0708 -0.0568 415 VAL A CA
|
|
1429 C C . VAL A 213 ? 0.7253 0.5649 0.8096 -0.0644 0.0586 -0.0681 415 VAL A C
|
|
1430 O O . VAL A 213 ? 0.7619 0.5857 0.8502 -0.0706 0.0491 -0.0786 415 VAL A O
|
|
1431 C CB . VAL A 213 ? 0.6536 0.5055 0.7728 -0.0647 0.0736 -0.0403 415 VAL A CB
|
|
1432 C CG1 . VAL A 213 ? 0.6553 0.5013 0.7951 -0.0777 0.0650 -0.0402 415 VAL A CG1
|
|
1433 C CG2 . VAL A 213 ? 0.6409 0.4907 0.7673 -0.0567 0.0855 -0.0302 415 VAL A CG2
|
|
1434 N N . ILE A 214 ? 0.6561 0.5128 0.7254 -0.0618 0.0582 -0.0666 416 ILE A N
|
|
1435 C CA . ILE A 214 ? 0.6608 0.5205 0.7165 -0.0636 0.0477 -0.0772 416 ILE A CA
|
|
1436 C C . ILE A 214 ? 0.7643 0.6064 0.8004 -0.0572 0.0441 -0.0940 416 ILE A C
|
|
1437 O O . ILE A 214 ? 0.7956 0.6286 0.8322 -0.0612 0.0325 -0.1068 416 ILE A O
|
|
1438 C CB . ILE A 214 ? 0.6752 0.5514 0.7144 -0.0603 0.0484 -0.0706 416 ILE A CB
|
|
1439 C CG1 . ILE A 214 ? 0.6521 0.5447 0.7080 -0.0641 0.0475 -0.0570 416 ILE A CG1
|
|
1440 C CG2 . ILE A 214 ? 0.6906 0.5668 0.7083 -0.0581 0.0387 -0.0832 416 ILE A CG2
|
|
1441 C CD1 . ILE A 214 ? 0.7215 0.6231 0.7573 -0.0586 0.0489 -0.0482 416 ILE A CD1
|
|
1442 N N . LEU A 215 ? 0.7172 0.5568 0.7361 -0.0467 0.0535 -0.0941 417 LEU A N
|
|
1443 C CA . LEU A 215 ? 0.7383 0.5650 0.7351 -0.0359 0.0517 -0.1086 417 LEU A CA
|
|
1444 C C . LEU A 215 ? 0.8180 0.6180 0.8213 -0.0360 0.0437 -0.1207 417 LEU A C
|
|
1445 O O . LEU A 215 ? 0.8798 0.6658 0.8684 -0.0314 0.0335 -0.1369 417 LEU A O
|
|
1446 C CB . LEU A 215 ? 0.7330 0.5698 0.7144 -0.0247 0.0650 -0.1026 417 LEU A CB
|
|
1447 C CG . LEU A 215 ? 0.8107 0.6417 0.7660 -0.0094 0.0654 -0.1151 417 LEU A CG
|
|
1448 C CD1 . LEU A 215 ? 0.8270 0.6597 0.7621 -0.0070 0.0573 -0.1247 417 LEU A CD1
|
|
1449 C CD2 . LEU A 215 ? 0.7912 0.6411 0.7369 -0.0002 0.0796 -0.1058 417 LEU A CD2
|
|
1450 N N . PHE A 216 ? 0.7354 0.5260 0.7587 -0.0409 0.0473 -0.1131 418 PHE A N
|
|
1451 C CA . PHE A 216 ? 0.7585 0.5182 0.7883 -0.0436 0.0396 -0.1215 418 PHE A CA
|
|
1452 C C . PHE A 216 ? 0.8067 0.5599 0.8482 -0.0587 0.0234 -0.1301 418 PHE A C
|
|
1453 O O . PHE A 216 ? 0.8220 0.5512 0.8522 -0.0572 0.0112 -0.1467 418 PHE A O
|
|
1454 C CB . PHE A 216 ? 0.7688 0.5242 0.8195 -0.0475 0.0485 -0.1069 418 PHE A CB
|
|
1455 C CG . PHE A 216 ? 0.8189 0.5363 0.8711 -0.0483 0.0430 -0.1130 418 PHE A CG
|
|
1456 C CD1 . PHE A 216 ? 0.8731 0.5717 0.9403 -0.0653 0.0293 -0.1176 418 PHE A CD1
|
|
1457 C CD2 . PHE A 216 ? 0.8494 0.5501 0.8878 -0.0325 0.0512 -0.1132 418 PHE A CD2
|
|
1458 C CE1 . PHE A 216 ? 0.9116 0.5693 0.9784 -0.0682 0.0230 -0.1222 418 PHE A CE1
|
|
1459 C CE2 . PHE A 216 ? 0.9278 0.5874 0.9633 -0.0320 0.0454 -0.1185 418 PHE A CE2
|
|
1460 C CZ . PHE A 216 ? 0.9226 0.5582 0.9719 -0.0510 0.0311 -0.1225 418 PHE A CZ
|
|
1461 N N . ILE A 217 ? 0.7548 0.5318 0.8177 -0.0718 0.0226 -0.1191 419 ILE A N
|
|
1462 C CA . ILE A 217 ? 0.7665 0.5491 0.8442 -0.0867 0.0082 -0.1246 419 ILE A CA
|
|
1463 C C . ILE A 217 ? 0.8600 0.6424 0.9147 -0.0803 -0.0028 -0.1431 419 ILE A C
|
|
1464 O O . ILE A 217 ? 0.8844 0.6530 0.9419 -0.0878 -0.0178 -0.1571 419 ILE A O
|
|
1465 C CB . ILE A 217 ? 0.7613 0.5769 0.8621 -0.0964 0.0117 -0.1074 419 ILE A CB
|
|
1466 C CG1 . ILE A 217 ? 0.7517 0.5640 0.8790 -0.1049 0.0186 -0.0915 419 ILE A CG1
|
|
1467 C CG2 . ILE A 217 ? 0.7685 0.6029 0.8787 -0.1071 -0.0023 -0.1135 419 ILE A CG2
|
|
1468 C CD1 . ILE A 217 ? 0.8057 0.6482 0.9461 -0.1037 0.0284 -0.0721 419 ILE A CD1
|
|
1469 N N . CYS A 218 ? 0.8129 0.6099 0.8445 -0.0668 0.0041 -0.1428 420 CYS A N
|
|
1470 C CA . CYS A 218 ? 0.8297 0.6275 0.8360 -0.0576 -0.0040 -0.1584 420 CYS A CA
|
|
1471 C C . CYS A 218 ? 0.9178 0.6865 0.9054 -0.0474 -0.0115 -0.1770 420 CYS A C
|
|
1472 O O . CYS A 218 ? 0.9388 0.6997 0.9197 -0.0478 -0.0266 -0.1937 420 CYS A O
|
|
1473 C CB . CYS A 218 ? 0.8186 0.6347 0.8032 -0.0462 0.0069 -0.1508 420 CYS A CB
|
|
1474 S SG . CYS A 218 ? 0.8394 0.6841 0.8353 -0.0543 0.0098 -0.1341 420 CYS A SG
|
|
1475 N N . LEU A 219 ? 0.8777 0.6317 0.8549 -0.0361 -0.0017 -0.1745 421 LEU A N
|
|
1476 C CA . LEU A 219 ? 0.9078 0.6338 0.8615 -0.0207 -0.0072 -0.1909 421 LEU A CA
|
|
1477 C C . LEU A 219 ? 1.0101 0.7011 0.9735 -0.0301 -0.0230 -0.2029 421 LEU A C
|
|
1478 O O . LEU A 219 ? 1.0712 0.7399 1.0147 -0.0212 -0.0369 -0.2225 421 LEU A O
|
|
1479 C CB . LEU A 219 ? 0.8956 0.6212 0.8366 -0.0050 0.0086 -0.1829 421 LEU A CB
|
|
1480 C CG . LEU A 219 ? 0.9071 0.6641 0.8332 0.0058 0.0237 -0.1724 421 LEU A CG
|
|
1481 C CD1 . LEU A 219 ? 0.9050 0.6662 0.8284 0.0161 0.0383 -0.1626 421 LEU A CD1
|
|
1482 C CD2 . LEU A 219 ? 0.9094 0.6702 0.8039 0.0226 0.0196 -0.1856 421 LEU A CD2
|
|
1483 N N . SER A 220 ? 0.9486 0.6330 0.9407 -0.0477 -0.0216 -0.1910 422 SER A N
|
|
1484 C CA . SER A 220 ? 0.9797 0.6271 0.9829 -0.0604 -0.0352 -0.1980 422 SER A CA
|
|
1485 C C . SER A 220 ? 1.0373 0.6898 1.0684 -0.0863 -0.0505 -0.1998 422 SER A C
|
|
1486 O O . SER A 220 ? 1.0761 0.6953 1.1092 -0.0966 -0.0670 -0.2118 422 SER A O
|
|
1487 C CB . SER A 220 ? 1.0143 0.6459 1.0275 -0.0614 -0.0236 -0.1836 422 SER A CB
|
|
1488 O OG . SER A 220 ? 1.0941 0.7541 1.1384 -0.0764 -0.0131 -0.1624 422 SER A OG
|
|
1489 N N . GLY A 221 ? 0.9610 0.6548 1.0124 -0.0965 -0.0455 -0.1876 423 GLY A N
|
|
1490 C CA . GLY A 221 ? 0.9540 0.6650 1.0344 -0.1197 -0.0575 -0.1859 423 GLY A CA
|
|
1491 C C . GLY A 221 ? 0.9971 0.7115 1.1111 -0.1386 -0.0514 -0.1656 423 GLY A C
|
|
1492 O O . GLY A 221 ? 0.9829 0.7222 1.1252 -0.1581 -0.0574 -0.1583 423 GLY A O
|
|
1493 N N . TYR A 222 ? 0.9606 0.6533 1.0710 -0.1316 -0.0388 -0.1557 424 TYR A N
|
|
1494 C CA . TYR A 222 ? 0.9496 0.6415 1.0881 -0.1461 -0.0312 -0.1356 424 TYR A CA
|
|
1495 C C . TYR A 222 ? 0.9638 0.6740 1.1023 -0.1324 -0.0099 -0.1174 424 TYR A C
|
|
1496 O O . TYR A 222 ? 0.9367 0.6434 1.0497 -0.1119 -0.0015 -0.1222 424 TYR A O
|
|
1497 C CB . TYR A 222 ? 1.0045 0.6434 1.1419 -0.1555 -0.0406 -0.1411 424 TYR A CB
|
|
1498 C CG . TYR A 222 ? 1.0283 0.6287 1.1356 -0.1334 -0.0331 -0.1464 424 TYR A CG
|
|
1499 C CD1 . TYR A 222 ? 1.0276 0.6216 1.1401 -0.1281 -0.0174 -0.1292 424 TYR A CD1
|
|
1500 C CD2 . TYR A 222 ? 1.0773 0.6474 1.1498 -0.1165 -0.0429 -0.1688 424 TYR A CD2
|
|
1501 C CE1 . TYR A 222 ? 1.0431 0.6050 1.1271 -0.1061 -0.0108 -0.1344 424 TYR A CE1
|
|
1502 C CE2 . TYR A 222 ? 1.1133 0.6513 1.1565 -0.0937 -0.0366 -0.1735 424 TYR A CE2
|
|
1503 C CZ . TYR A 222 ? 1.1888 0.7247 1.2379 -0.0884 -0.0201 -0.1563 424 TYR A CZ
|
|
1504 O OH . TYR A 222 ? 1.2166 0.7261 1.2355 -0.0634 -0.0136 -0.1613 424 TYR A OH
|
|
1505 N N . PRO A 223 ? 0.9115 0.6417 1.0786 -0.1434 -0.0015 -0.0962 425 PRO A N
|
|
1506 C CA . PRO A 223 ? 0.8797 0.6258 1.0468 -0.1297 0.0171 -0.0798 425 PRO A CA
|
|
1507 C C . PRO A 223 ? 0.9588 0.6696 1.1140 -0.1187 0.0258 -0.0781 425 PRO A C
|
|
1508 O O . PRO A 223 ? 0.9944 0.6682 1.1521 -0.1274 0.0192 -0.0808 425 PRO A O
|
|
1509 C CB . PRO A 223 ? 0.8747 0.6529 1.0749 -0.1435 0.0207 -0.0592 425 PRO A CB
|
|
1510 C CG . PRO A 223 ? 0.9580 0.7210 1.1781 -0.1668 0.0075 -0.0609 425 PRO A CG
|
|
1511 C CD . PRO A 223 ? 0.9273 0.6702 1.1282 -0.1680 -0.0087 -0.0855 425 PRO A CD
|
|
1512 N N . PRO A 224 ? 0.8953 0.6167 1.0372 -0.0998 0.0401 -0.0729 426 PRO A N
|
|
1513 C CA . PRO A 224 ? 0.9158 0.6082 1.0450 -0.0863 0.0488 -0.0717 426 PRO A CA
|
|
1514 C C . PRO A 224 ? 0.9634 0.6482 1.1141 -0.0931 0.0561 -0.0536 426 PRO A C
|
|
1515 O O . PRO A 224 ? 0.9956 0.6436 1.1362 -0.0872 0.0577 -0.0549 426 PRO A O
|
|
1516 C CB . PRO A 224 ? 0.9094 0.6257 1.0218 -0.0665 0.0613 -0.0706 426 PRO A CB
|
|
1517 C CG . PRO A 224 ? 0.9146 0.6703 1.0369 -0.0721 0.0618 -0.0643 426 PRO A CG
|
|
1518 C CD . PRO A 224 ? 0.8659 0.6245 1.0018 -0.0900 0.0480 -0.0685 426 PRO A CD
|
|
1519 N N . PHE A 225 ? 0.8811 0.6006 1.0583 -0.1024 0.0609 -0.0365 427 PHE A N
|
|
1520 C CA . PHE A 225 ? 0.8777 0.5986 1.0770 -0.1073 0.0693 -0.0165 427 PHE A CA
|
|
1521 C C . PHE A 225 ? 0.9714 0.7101 1.2001 -0.1309 0.0611 -0.0070 427 PHE A C
|
|
1522 O O . PHE A 225 ? 0.9461 0.7229 1.1839 -0.1345 0.0581 -0.0053 427 PHE A O
|
|
1523 C CB . PHE A 225 ? 0.8503 0.6021 1.0518 -0.0908 0.0846 -0.0032 427 PHE A CB
|
|
1524 C CG . PHE A 225 ? 0.8561 0.6032 1.0310 -0.0698 0.0916 -0.0129 427 PHE A CG
|
|
1525 C CD1 . PHE A 225 ? 0.9065 0.6259 1.0680 -0.0561 0.0988 -0.0138 427 PHE A CD1
|
|
1526 C CD2 . PHE A 225 ? 0.8359 0.6070 0.9979 -0.0636 0.0908 -0.0207 427 PHE A CD2
|
|
1527 C CE1 . PHE A 225 ? 0.9040 0.6264 1.0422 -0.0364 0.1053 -0.0223 427 PHE A CE1
|
|
1528 C CE2 . PHE A 225 ? 0.8567 0.6282 0.9963 -0.0466 0.0974 -0.0279 427 PHE A CE2
|
|
1529 C CZ . PHE A 225 ? 0.8514 0.6016 0.9805 -0.0330 0.1047 -0.0288 427 PHE A CZ
|
|
1530 N N . SER A 226 ? 0.9918 0.7020 1.2333 -0.1473 0.0563 -0.0016 428 SER A N
|
|
1531 C CA . SER A 226 ? 1.0068 0.7340 1.2781 -0.1732 0.0474 0.0076 428 SER A CA
|
|
1532 C C . SER A 226 ? 1.1205 0.8231 1.4092 -0.1875 0.0504 0.0246 428 SER A C
|
|
1533 O O . SER A 226 ? 1.1587 0.8138 1.4298 -0.1804 0.0534 0.0221 428 SER A O
|
|
1534 C CB . SER A 226 ? 1.0899 0.8026 1.3547 -0.1874 0.0283 -0.0131 428 SER A CB
|
|
1535 O OG . SER A 226 ? 1.2454 0.9796 1.5402 -0.2139 0.0181 -0.0058 428 SER A OG
|
|
1536 N N . GLU A 227 ? 1.0893 0.8238 1.4111 -0.2079 0.0488 0.0420 429 GLU A N
|
|
1537 C CA . GLU A 227 ? 1.1258 0.8396 1.4668 -0.2258 0.0513 0.0609 429 GLU A CA
|
|
1538 C C . GLU A 227 ? 1.2595 0.9326 1.6033 -0.2542 0.0324 0.0504 429 GLU A C
|
|
1539 O O . GLU A 227 ? 1.3014 0.9395 1.6531 -0.2702 0.0321 0.0627 429 GLU A O
|
|
1540 C CB . GLU A 227 ? 1.1079 0.8774 1.4829 -0.2314 0.0614 0.0887 429 GLU A CB
|
|
1541 C CG . GLU A 227 ? 1.2055 0.9976 1.5730 -0.2017 0.0796 0.0996 429 GLU A CG
|
|
1542 C CD . GLU A 227 ? 1.3792 1.2297 1.7734 -0.1986 0.0896 0.1247 429 GLU A CD
|
|
1543 O OE1 . GLU A 227 ? 1.2625 1.1514 1.6827 -0.2175 0.0828 0.1335 429 GLU A OE1
|
|
1544 O OE2 . GLU A 227 ? 1.1500 1.0100 1.5382 -0.1753 0.1039 0.1353 429 GLU A OE2
|
|
1545 N N . HIS A 228 ? 1.2419 0.9144 1.5755 -0.2590 0.0162 0.0268 430 HIS A N
|
|
1546 C CA . HIS A 228 ? 1.3069 0.9402 1.6393 -0.2838 -0.0050 0.0119 430 HIS A CA
|
|
1547 C C . HIS A 228 ? 1.4298 0.9844 1.7284 -0.2763 -0.0098 -0.0010 430 HIS A C
|
|
1548 O O . HIS A 228 ? 1.4238 0.9591 1.6888 -0.2476 -0.0049 -0.0159 430 HIS A O
|
|
1549 C CB . HIS A 228 ? 1.3099 0.9666 1.6375 -0.2857 -0.0204 -0.0108 430 HIS A CB
|
|
1550 C CG . HIS A 228 ? 1.4116 1.0316 1.7396 -0.3113 -0.0442 -0.0269 430 HIS A CG
|
|
1551 N ND1 . HIS A 228 ? 1.4447 1.0907 1.8093 -0.3456 -0.0554 -0.0169 430 HIS A ND1
|
|
1552 C CD2 . HIS A 228 ? 1.4797 1.0404 1.7755 -0.3065 -0.0590 -0.0519 430 HIS A CD2
|
|
1553 C CE1 . HIS A 228 ? 1.4897 1.0899 1.8438 -0.3620 -0.0775 -0.0369 430 HIS A CE1
|
|
1554 N NE2 . HIS A 228 ? 1.5182 1.0645 1.8295 -0.3381 -0.0807 -0.0588 430 HIS A NE2
|
|
1555 N N . ARG A 229 ? 1.4485 0.9588 1.7555 -0.3029 -0.0204 0.0052 431 ARG A N
|
|
1556 C CA . ARG A 229 ? 1.5187 0.9462 1.7938 -0.3004 -0.0281 -0.0045 431 ARG A CA
|
|
1557 C C . ARG A 229 ? 1.5581 0.9619 1.8025 -0.2647 -0.0095 -0.0018 431 ARG A C
|
|
1558 O O . ARG A 229 ? 1.5874 0.9504 1.7918 -0.2409 -0.0136 -0.0229 431 ARG A O
|
|
1559 C CB . ARG A 229 ? 1.5763 0.9620 1.8263 -0.3046 -0.0529 -0.0357 431 ARG A CB
|
|
1560 N N . THR A 230 ? 1.4547 0.8904 1.7187 -0.2594 0.0110 0.0243 432 THR A N
|
|
1561 C CA . THR A 230 ? 1.4221 0.8484 1.6642 -0.2267 0.0302 0.0304 432 THR A CA
|
|
1562 C C . THR A 230 ? 1.4261 0.8612 1.6911 -0.2332 0.0458 0.0616 432 THR A C
|
|
1563 O O . THR A 230 ? 1.3967 0.8766 1.7001 -0.2556 0.0477 0.0809 432 THR A O
|
|
1564 C CB . THR A 230 ? 1.4182 0.9005 1.6563 -0.2001 0.0412 0.0233 432 THR A CB
|
|
1565 N N . GLN A 231 ? 1.3764 0.7722 1.6167 -0.2114 0.0573 0.0668 433 GLN A N
|
|
1566 C CA . GLN A 231 ? 1.3589 0.7584 1.6140 -0.2106 0.0742 0.0958 433 GLN A CA
|
|
1567 C C . GLN A 231 ? 1.3141 0.7701 1.5734 -0.1800 0.0945 0.1037 433 GLN A C
|
|
1568 O O . GLN A 231 ? 1.2727 0.7698 1.5593 -0.1820 0.1075 0.1282 433 GLN A O
|
|
1569 C CB . GLN A 231 ? 1.4419 0.7604 1.6632 -0.2028 0.0740 0.0963 433 GLN A CB
|
|
1570 N N . VAL A 232 ? 1.2370 0.6957 1.4687 -0.1521 0.0960 0.0827 434 VAL A N
|
|
1571 C CA . VAL A 232 ? 1.1765 0.6809 1.4057 -0.1225 0.1120 0.0849 434 VAL A CA
|
|
1572 C C . VAL A 232 ? 1.1447 0.7209 1.4052 -0.1298 0.1141 0.0922 434 VAL A C
|
|
1573 O O . VAL A 232 ? 1.1438 0.7364 1.4107 -0.1441 0.1014 0.0796 434 VAL A O
|
|
1574 C CB . VAL A 232 ? 1.2401 0.7242 1.4303 -0.0946 0.1110 0.0602 434 VAL A CB
|
|
1575 C CG1 . VAL A 232 ? 1.2574 0.7256 1.4345 -0.1050 0.0927 0.0359 434 VAL A CG1
|
|
1576 C CG2 . VAL A 232 ? 1.1823 0.7179 1.3719 -0.0684 0.1250 0.0607 434 VAL A CG2
|
|
1577 N N . SER A 233 ? 1.0256 0.6430 1.3032 -0.1180 0.1292 0.1123 435 SER A N
|
|
1578 C CA . SER A 233 ? 0.9478 0.6306 1.2503 -0.1205 0.1308 0.1199 435 SER A CA
|
|
1579 C C . SER A 233 ? 0.9708 0.6750 1.2576 -0.1075 0.1263 0.0989 435 SER A C
|
|
1580 O O . SER A 233 ? 0.9801 0.6655 1.2402 -0.0872 0.1298 0.0853 435 SER A O
|
|
1581 C CB . SER A 233 ? 0.9327 0.6508 1.2503 -0.1050 0.1469 0.1435 435 SER A CB
|
|
1582 O OG . SER A 233 ? 0.9635 0.6914 1.2627 -0.0744 0.1569 0.1380 435 SER A OG
|
|
1583 N N . LEU A 234 ? 0.8876 0.6321 1.1899 -0.1193 0.1185 0.0970 436 LEU A N
|
|
1584 C CA . LEU A 234 ? 0.8312 0.5988 1.1202 -0.1102 0.1135 0.0798 436 LEU A CA
|
|
1585 C C . LEU A 234 ? 0.8314 0.6159 1.1067 -0.0826 0.1256 0.0808 436 LEU A C
|
|
1586 O O . LEU A 234 ? 0.8401 0.6161 1.0927 -0.0713 0.1244 0.0641 436 LEU A O
|
|
1587 C CB . LEU A 234 ? 0.7982 0.6097 1.1078 -0.1250 0.1051 0.0835 436 LEU A CB
|
|
1588 C CG . LEU A 234 ? 0.8169 0.6547 1.1136 -0.1179 0.0989 0.0687 436 LEU A CG
|
|
1589 C CD1 . LEU A 234 ? 0.8397 0.6451 1.1105 -0.1166 0.0912 0.0448 436 LEU A CD1
|
|
1590 C CD2 . LEU A 234 ? 0.8122 0.6843 1.1273 -0.1336 0.0891 0.0717 436 LEU A CD2
|
|
1591 N N . LYS A 235 ? 0.7479 0.5525 1.0358 -0.0716 0.1373 0.1001 437 LYS A N
|
|
1592 C CA . LYS A 235 ? 0.7147 0.5348 0.9913 -0.0460 0.1478 0.1016 437 LYS A CA
|
|
1593 C C . LYS A 235 ? 0.8177 0.6019 1.0700 -0.0316 0.1528 0.0900 437 LYS A C
|
|
1594 O O . LYS A 235 ? 0.8061 0.6006 1.0422 -0.0168 0.1548 0.0791 437 LYS A O
|
|
1595 C CB . LYS A 235 ? 0.7126 0.5559 1.0070 -0.0360 0.1586 0.1250 437 LYS A CB
|
|
1596 C CG . LYS A 235 ? 0.6865 0.5534 0.9720 -0.0106 0.1663 0.1261 437 LYS A CG
|
|
1597 C CD . LYS A 235 ? 0.7220 0.5851 1.0108 0.0066 0.1794 0.1414 437 LYS A CD
|
|
1598 C CE . LYS A 235 ? 0.8476 0.7425 1.1319 0.0300 0.1842 0.1434 437 LYS A CE
|
|
1599 N NZ . LYS A 235 ? 1.0195 0.9078 1.3010 0.0514 0.1970 0.1534 437 LYS A NZ
|
|
1600 N N . ASP A 236 ? 0.8298 0.5727 1.0786 -0.0352 0.1548 0.0936 438 ASP A N
|
|
1601 C CA . ASP A 236 ? 0.8569 0.5615 1.0790 -0.0188 0.1593 0.0835 438 ASP A CA
|
|
1602 C C . ASP A 236 ? 0.9107 0.6004 1.1102 -0.0189 0.1498 0.0599 438 ASP A C
|
|
1603 O O . ASP A 236 ? 0.9116 0.6008 1.0898 0.0013 0.1547 0.0497 438 ASP A O
|
|
1604 C CB . ASP A 236 ? 0.9326 0.5892 1.1528 -0.0255 0.1605 0.0924 438 ASP A CB
|
|
1605 C CG . ASP A 236 ? 1.0637 0.7293 1.3018 -0.0217 0.1723 0.1175 438 ASP A CG
|
|
1606 O OD1 . ASP A 236 ? 1.0174 0.7266 1.2661 -0.0071 0.1810 0.1268 438 ASP A OD1
|
|
1607 O OD2 . ASP A 236 ? 1.1709 0.7991 1.4114 -0.0335 0.1723 0.1282 438 ASP A OD2
|
|
1608 N N . GLN A 237 ? 0.8599 0.5415 1.0643 -0.0406 0.1364 0.0515 439 GLN A N
|
|
1609 C CA . GLN A 237 ? 0.8509 0.5207 1.0344 -0.0411 0.1262 0.0294 439 GLN A CA
|
|
1610 C C . GLN A 237 ? 0.8413 0.5510 1.0179 -0.0272 0.1308 0.0236 439 GLN A C
|
|
1611 O O . GLN A 237 ? 0.8648 0.5680 1.0180 -0.0110 0.1332 0.0113 439 GLN A O
|
|
1612 C CB . GLN A 237 ? 0.8681 0.5365 1.0636 -0.0666 0.1112 0.0237 439 GLN A CB
|
|
1613 C CG . GLN A 237 ? 1.0754 0.7032 1.2787 -0.0861 0.1032 0.0279 439 GLN A CG
|
|
1614 C CD . GLN A 237 ? 1.2742 0.9090 1.4917 -0.1113 0.0878 0.0215 439 GLN A CD
|
|
1615 O OE1 . GLN A 237 ? 1.1873 0.8199 1.3898 -0.1110 0.0777 0.0024 439 GLN A OE1
|
|
1616 N NE2 . GLN A 237 ? 1.1734 0.8186 1.4200 -0.1330 0.0856 0.0379 439 GLN A NE2
|
|
1617 N N . ILE A 238 ? 0.7177 0.4688 0.9135 -0.0329 0.1318 0.0333 440 ILE A N
|
|
1618 C CA . ILE A 238 ? 0.6668 0.4529 0.8563 -0.0235 0.1342 0.0294 440 ILE A CA
|
|
1619 C C . ILE A 238 ? 0.7283 0.5243 0.9081 -0.0016 0.1461 0.0320 440 ILE A C
|
|
1620 O O . ILE A 238 ? 0.7311 0.5371 0.8947 0.0069 0.1470 0.0217 440 ILE A O
|
|
1621 C CB . ILE A 238 ? 0.6517 0.4735 0.8588 -0.0330 0.1302 0.0384 440 ILE A CB
|
|
1622 C CG1 . ILE A 238 ? 0.6504 0.4675 0.8666 -0.0537 0.1180 0.0344 440 ILE A CG1
|
|
1623 C CG2 . ILE A 238 ? 0.6186 0.4669 0.8136 -0.0251 0.1304 0.0329 440 ILE A CG2
|
|
1624 C CD1 . ILE A 238 ? 0.6097 0.4599 0.8466 -0.0616 0.1152 0.0475 440 ILE A CD1
|
|
1625 N N . THR A 239 ? 0.7002 0.4963 0.8901 0.0077 0.1553 0.0460 441 THR A N
|
|
1626 C CA . THR A 239 ? 0.6957 0.5052 0.8772 0.0296 0.1659 0.0477 441 THR A CA
|
|
1627 C C . THR A 239 ? 0.7967 0.5828 0.9540 0.0432 0.1688 0.0351 441 THR A C
|
|
1628 O O . THR A 239 ? 0.8081 0.6151 0.9540 0.0569 0.1734 0.0290 441 THR A O
|
|
1629 C CB . THR A 239 ? 0.7295 0.5496 0.9263 0.0392 0.1748 0.0655 441 THR A CB
|
|
1630 O OG1 . THR A 239 ? 0.8376 0.6226 1.0364 0.0372 0.1777 0.0726 441 THR A OG1
|
|
1631 C CG2 . THR A 239 ? 0.5405 0.3921 0.7571 0.0312 0.1715 0.0770 441 THR A CG2
|
|
1632 N N . SER A 240 ? 0.7804 0.5237 0.9284 0.0389 0.1649 0.0304 442 SER A N
|
|
1633 C CA . SER A 240 ? 0.8115 0.5263 0.9310 0.0540 0.1652 0.0167 442 SER A CA
|
|
1634 C C . SER A 240 ? 0.9157 0.6363 1.0201 0.0503 0.1569 -0.0002 442 SER A C
|
|
1635 O O . SER A 240 ? 0.9422 0.6506 1.0209 0.0665 0.1576 -0.0124 442 SER A O
|
|
1636 C CB . SER A 240 ? 0.8544 0.5147 0.9660 0.0500 0.1612 0.0175 442 SER A CB
|
|
1637 O OG . SER A 240 ? 0.8812 0.5231 1.0003 0.0256 0.1481 0.0131 442 SER A OG
|
|
1638 N N . GLY A 241 ? 0.8748 0.6135 0.9932 0.0309 0.1492 -0.0005 443 GLY A N
|
|
1639 C CA . GLY A 241 ? 0.8727 0.6165 0.9785 0.0251 0.1407 -0.0149 443 GLY A CA
|
|
1640 C C . GLY A 241 ? 0.9638 0.6638 1.0489 0.0258 0.1314 -0.0294 443 GLY A C
|
|
1641 O O . GLY A 241 ? 0.9716 0.6720 1.0348 0.0349 0.1283 -0.0433 443 GLY A O
|
|
1642 N N . LYS A 242 ? 0.9550 0.6164 1.0458 0.0167 0.1265 -0.0258 444 LYS A N
|
|
1643 C CA . LYS A 242 ? 1.0197 0.6305 1.0896 0.0160 0.1152 -0.0393 444 LYS A CA
|
|
1644 C C . LYS A 242 ? 1.0837 0.6857 1.1662 -0.0096 0.1003 -0.0443 444 LYS A C
|
|
1645 O O . LYS A 242 ? 1.1118 0.6974 1.2139 -0.0288 0.0954 -0.0352 444 LYS A O
|
|
1646 C CB . LYS A 242 ? 1.0881 0.6538 1.1488 0.0240 0.1182 -0.0336 444 LYS A CB
|
|
1647 N N . TYR A 243 ? 1.0120 0.6297 1.0842 -0.0095 0.0936 -0.0578 445 TYR A N
|
|
1648 C CA . TYR A 243 ? 1.0034 0.6184 1.0838 -0.0298 0.0790 -0.0656 445 TYR A CA
|
|
1649 C C . TYR A 243 ? 1.1181 0.6783 1.1829 -0.0349 0.0639 -0.0790 445 TYR A C
|
|
1650 O O . TYR A 243 ? 1.1547 0.6792 1.1906 -0.0164 0.0632 -0.0884 445 TYR A O
|
|
1651 C CB . TYR A 243 ? 0.9791 0.6259 1.0485 -0.0245 0.0774 -0.0760 445 TYR A CB
|
|
1652 C CG . TYR A 243 ? 1.0040 0.6464 1.0409 0.0005 0.0813 -0.0880 445 TYR A CG
|
|
1653 C CD1 . TYR A 243 ? 1.0781 0.6838 1.0875 0.0096 0.0699 -0.1063 445 TYR A CD1
|
|
1654 C CD2 . TYR A 243 ? 0.9857 0.6626 1.0190 0.0159 0.0959 -0.0809 445 TYR A CD2
|
|
1655 C CE1 . TYR A 243 ? 1.1181 0.7231 1.0959 0.0361 0.0740 -0.1164 445 TYR A CE1
|
|
1656 C CE2 . TYR A 243 ? 1.0161 0.6966 1.0211 0.0392 0.1003 -0.0904 445 TYR A CE2
|
|
1657 C CZ . TYR A 243 ? 1.1828 0.8282 1.1595 0.0506 0.0899 -0.1078 445 TYR A CZ
|
|
1658 O OH . TYR A 243 ? 1.2381 0.8905 1.1851 0.0768 0.0944 -0.1165 445 TYR A OH
|
|
1659 N N . ASN A 244 ? 0.9603 0.5144 1.0390 0.0034 0.0558 -0.0348 446 ASN A N
|
|
1660 C CA . ASN A 244 ? 0.9934 0.4958 1.1042 0.0045 0.0523 -0.0553 446 ASN A CA
|
|
1661 C C . ASN A 244 ? 1.0535 0.5361 1.1352 0.0144 0.0493 -0.0989 446 ASN A C
|
|
1662 O O . ASN A 244 ? 1.0065 0.4939 1.0503 0.0050 0.0408 -0.1241 446 ASN A O
|
|
1663 C CB . ASN A 244 ? 1.0170 0.5065 1.1431 -0.0171 0.0428 -0.0580 446 ASN A CB
|
|
1664 C CG . ASN A 244 ? 1.2924 0.7303 1.4655 -0.0183 0.0385 -0.0727 446 ASN A CG
|
|
1665 O OD1 . ASN A 244 ? 1.2624 0.6818 1.4827 -0.0110 0.0454 -0.0501 446 ASN A OD1
|
|
1666 N ND2 . ASN A 244 ? 1.1851 0.5990 1.3490 -0.0279 0.0257 -0.1104 446 ASN A ND2
|
|
1667 N N . PHE A 245 ? 1.0665 0.5304 1.1641 0.0347 0.0572 -0.1065 447 PHE A N
|
|
1668 C CA . PHE A 245 ? 1.0949 0.5425 1.1644 0.0465 0.0567 -0.1482 447 PHE A CA
|
|
1669 C C . PHE A 245 ? 1.1954 0.5897 1.2951 0.0488 0.0491 -0.1805 447 PHE A C
|
|
1670 O O . PHE A 245 ? 1.2308 0.5990 1.3800 0.0590 0.0538 -0.1718 447 PHE A O
|
|
1671 C CB . PHE A 245 ? 1.1225 0.5900 1.1833 0.0687 0.0708 -0.1432 447 PHE A CB
|
|
1672 C CG . PHE A 245 ? 1.1694 0.6262 1.1960 0.0812 0.0728 -0.1852 447 PHE A CG
|
|
1673 C CD1 . PHE A 245 ? 1.1821 0.6637 1.1539 0.0746 0.0704 -0.1997 447 PHE A CD1
|
|
1674 C CD2 . PHE A 245 ? 1.2509 0.6720 1.3013 0.0992 0.0765 -0.2113 447 PHE A CD2
|
|
1675 C CE1 . PHE A 245 ? 1.2221 0.6965 1.1592 0.0863 0.0731 -0.2360 447 PHE A CE1
|
|
1676 C CE2 . PHE A 245 ? 1.3152 0.7292 1.3301 0.1114 0.0787 -0.2525 447 PHE A CE2
|
|
1677 C CZ . PHE A 245 ? 1.2714 0.7135 1.2277 0.1050 0.0775 -0.2631 447 PHE A CZ
|
|
1678 N N . ILE A 246 ? 1.1598 0.5384 1.2324 0.0396 0.0362 -0.2178 448 ILE A N
|
|
1679 C CA . ILE A 246 ? 1.1990 0.5290 1.2969 0.0409 0.0253 -0.2559 448 ILE A CA
|
|
1680 C C . ILE A 246 ? 1.3172 0.6387 1.3772 0.0597 0.0266 -0.2998 448 ILE A C
|
|
1681 O O . ILE A 246 ? 1.2967 0.6322 1.3032 0.0556 0.0198 -0.3222 448 ILE A O
|
|
1682 C CB . ILE A 246 ? 1.2177 0.5346 1.3224 0.0174 0.0077 -0.2664 448 ILE A CB
|
|
1683 C CG1 . ILE A 246 ? 1.1711 0.5006 1.3144 0.0006 0.0101 -0.2212 448 ILE A CG1
|
|
1684 C CG2 . ILE A 246 ? 1.2816 0.5489 1.4178 0.0195 -0.0052 -0.3080 448 ILE A CG2
|
|
1685 C CD1 . ILE A 246 ? 1.1969 0.5289 1.3398 -0.0228 -0.0039 -0.2250 448 ILE A CD1
|
|
1686 N N . PRO A 247 ? 1.3669 0.6676 1.4540 0.0813 0.0362 -0.3110 449 PRO A N
|
|
1687 C CA . PRO A 247 ? 1.4133 0.7119 1.4631 0.1018 0.0409 -0.3519 449 PRO A CA
|
|
1688 C C . PRO A 247 ? 1.5242 0.8063 1.5361 0.0985 0.0251 -0.4015 449 PRO A C
|
|
1689 O O . PRO A 247 ? 1.5217 0.8265 1.4747 0.1069 0.0290 -0.4201 449 PRO A O
|
|
1690 C CB . PRO A 247 ? 1.4745 0.7435 1.5778 0.1229 0.0501 -0.3583 449 PRO A CB
|
|
1691 C CG . PRO A 247 ? 1.5002 0.7753 1.6535 0.1173 0.0565 -0.3059 449 PRO A CG
|
|
1692 C CD . PRO A 247 ? 1.4082 0.6897 1.5616 0.0897 0.0444 -0.2846 449 PRO A CD
|
|
1693 N N . GLU A 248 ? 1.5295 0.7744 1.5764 0.0865 0.0072 -0.4214 450 GLU A N
|
|
1694 C CA . GLU A 248 ? 1.5685 0.7952 1.5869 0.0830 -0.0122 -0.4708 450 GLU A CA
|
|
1695 C C . GLU A 248 ? 1.5776 0.8387 1.5318 0.0692 -0.0197 -0.4665 450 GLU A C
|
|
1696 O O . GLU A 248 ? 1.5952 0.8626 1.4953 0.0764 -0.0262 -0.5007 450 GLU A O
|
|
1697 C CB . GLU A 248 ? 1.6125 0.7960 1.6922 0.0691 -0.0309 -0.4863 450 GLU A CB
|
|
1698 C CG . GLU A 248 ? 1.8066 0.9514 1.9617 0.0798 -0.0252 -0.4862 450 GLU A CG
|
|
1699 C CD . GLU A 248 ? 2.0282 1.1716 2.2444 0.0683 -0.0165 -0.4309 450 GLU A CD
|
|
1700 O OE1 . GLU A 248 ? 1.8181 0.9792 2.0341 0.0461 -0.0213 -0.4009 450 GLU A OE1
|
|
1701 O OE2 . GLU A 248 ? 1.9517 1.0756 2.2183 0.0822 -0.0055 -0.4186 450 GLU A OE2
|
|
1702 N N . VAL A 249 ? 1.4836 0.7683 1.4441 0.0507 -0.0183 -0.4238 451 VAL A N
|
|
1703 C CA . VAL A 249 ? 1.4537 0.7705 1.3638 0.0362 -0.0253 -0.4144 451 VAL A CA
|
|
1704 C C . VAL A 249 ? 1.5029 0.8558 1.3535 0.0496 -0.0107 -0.4096 451 VAL A C
|
|
1705 O O . VAL A 249 ? 1.4993 0.8645 1.2958 0.0499 -0.0180 -0.4297 451 VAL A O
|
|
1706 C CB . VAL A 249 ? 1.4502 0.7832 1.3902 0.0148 -0.0257 -0.3707 451 VAL A CB
|
|
1707 C CG1 . VAL A 249 ? 1.4039 0.7740 1.2957 0.0024 -0.0297 -0.3571 451 VAL A CG1
|
|
1708 C CG2 . VAL A 249 ? 1.4584 0.7591 1.4532 -0.0007 -0.0408 -0.3770 451 VAL A CG2
|
|
1709 N N . TRP A 250 ? 1.4527 0.8226 1.3171 0.0611 0.0099 -0.3821 452 TRP A N
|
|
1710 C CA . TRP A 250 ? 1.4353 0.8424 1.2585 0.0729 0.0270 -0.3699 452 TRP A CA
|
|
1711 C C . TRP A 250 ? 1.5285 0.9336 1.3193 0.0963 0.0367 -0.4033 452 TRP A C
|
|
1712 O O . TRP A 250 ? 1.5093 0.9478 1.2585 0.1034 0.0493 -0.3957 452 TRP A O
|
|
1713 C CB . TRP A 250 ? 1.3806 0.8106 1.2355 0.0745 0.0427 -0.3264 452 TRP A CB
|
|
1714 C CG . TRP A 250 ? 1.3377 0.7908 1.1978 0.0530 0.0370 -0.2915 452 TRP A CG
|
|
1715 C CD1 . TRP A 250 ? 1.3565 0.7975 1.2584 0.0382 0.0290 -0.2729 452 TRP A CD1
|
|
1716 C CD2 . TRP A 250 ? 1.2953 0.7893 1.1197 0.0446 0.0398 -0.2718 452 TRP A CD2
|
|
1717 N NE1 . TRP A 250 ? 1.3011 0.7746 1.1920 0.0220 0.0267 -0.2453 452 TRP A NE1
|
|
1718 C CE2 . TRP A 250 ? 1.3061 0.8110 1.1515 0.0255 0.0323 -0.2449 452 TRP A CE2
|
|
1719 C CE3 . TRP A 250 ? 1.3025 0.8255 1.0814 0.0512 0.0483 -0.2741 452 TRP A CE3
|
|
1720 C CZ2 . TRP A 250 ? 1.2519 0.7941 1.0750 0.0136 0.0315 -0.2244 452 TRP A CZ2
|
|
1721 C CZ3 . TRP A 250 ? 1.2745 0.8324 1.0348 0.0380 0.0473 -0.2509 452 TRP A CZ3
|
|
1722 C CH2 . TRP A 250 ? 1.2438 0.8103 1.0264 0.0198 0.0382 -0.2283 452 TRP A CH2
|
|
1723 N N . ALA A 251 ? 1.5432 0.9108 1.3540 0.1084 0.0311 -0.4409 453 ALA A N
|
|
1724 C CA . ALA A 251 ? 1.5885 0.9525 1.3692 0.1325 0.0395 -0.4799 453 ALA A CA
|
|
1725 C C . ALA A 251 ? 1.6616 1.0444 1.3694 0.1311 0.0319 -0.5019 453 ALA A C
|
|
1726 O O . ALA A 251 ? 1.6913 1.0912 1.3562 0.1497 0.0447 -0.5204 453 ALA A O
|
|
1727 C CB . ALA A 251 ? 1.6460 0.9632 1.4682 0.1421 0.0298 -0.5186 453 ALA A CB
|
|
1728 N N . GLU A 252 ? 1.5968 0.9786 1.2920 0.1092 0.0118 -0.4969 454 GLU A N
|
|
1729 C CA . GLU A 252 ? 1.5992 0.9978 1.2311 0.1037 0.0001 -0.5101 454 GLU A CA
|
|
1730 C C . GLU A 252 ? 1.5646 1.0081 1.1592 0.1018 0.0163 -0.4743 454 GLU A C
|
|
1731 O O . GLU A 252 ? 1.5960 1.0603 1.1324 0.1081 0.0185 -0.4837 454 GLU A O
|
|
1732 C CB . GLU A 252 ? 1.6015 0.9847 1.2475 0.0798 -0.0265 -0.5101 454 GLU A CB
|
|
1733 C CG . GLU A 252 ? 1.7605 1.1000 1.4464 0.0788 -0.0455 -0.5468 454 GLU A CG
|
|
1734 N N . VAL A 253 ? 1.4131 0.8721 1.0427 0.0931 0.0272 -0.4330 455 VAL A N
|
|
1735 C CA . VAL A 253 ? 1.3363 0.8372 0.9455 0.0884 0.0412 -0.3963 455 VAL A CA
|
|
1736 C C . VAL A 253 ? 1.3578 0.8802 0.9594 0.1102 0.0677 -0.3929 455 VAL A C
|
|
1737 O O . VAL A 253 ? 1.3709 0.8761 1.0039 0.1259 0.0765 -0.4056 455 VAL A O
|
|
1738 C CB . VAL A 253 ? 1.2983 0.8076 0.9500 0.0688 0.0377 -0.3576 455 VAL A CB
|
|
1739 C CG1 . VAL A 253 ? 1.2471 0.7989 0.8854 0.0638 0.0501 -0.3227 455 VAL A CG1
|
|
1740 C CG2 . VAL A 253 ? 1.2740 0.7657 0.9331 0.0481 0.0134 -0.3624 455 VAL A CG2
|
|
1741 N N . SER A 254 ? 1.2725 0.8321 0.8355 0.1115 0.0802 -0.3763 456 SER A N
|
|
1742 C CA . SER A 254 ? 1.2713 0.8581 0.8281 0.1304 0.1067 -0.3696 456 SER A CA
|
|
1743 C C . SER A 254 ? 1.3089 0.9089 0.9194 0.1303 0.1187 -0.3374 456 SER A C
|
|
1744 O O . SER A 254 ? 1.2751 0.8760 0.9140 0.1126 0.1083 -0.3122 456 SER A O
|
|
1745 C CB . SER A 254 ? 1.2830 0.9067 0.7896 0.1287 0.1160 -0.3562 456 SER A CB
|
|
1746 O OG . SER A 254 ? 1.2993 0.9525 0.8236 0.1141 0.1206 -0.3160 456 SER A OG
|
|
1747 N N . GLU A 255 ? 1.2851 0.8989 0.9082 0.1511 0.1407 -0.3384 457 GLU A N
|
|
1748 C CA . GLU A 255 ? 1.2503 0.8814 0.9224 0.1553 0.1532 -0.3092 457 GLU A CA
|
|
1749 C C . GLU A 255 ? 1.2460 0.9187 0.9158 0.1405 0.1571 -0.2715 457 GLU A C
|
|
1750 O O . GLU A 255 ? 1.2092 0.8926 0.9188 0.1334 0.1551 -0.2440 457 GLU A O
|
|
1751 C CB . GLU A 255 ? 1.3049 0.9433 0.9878 0.1827 0.1759 -0.3232 457 GLU A CB
|
|
1752 N N . LYS A 256 ? 1.1861 0.8821 0.8101 0.1359 0.1615 -0.2706 458 LYS A N
|
|
1753 C CA . LYS A 256 ? 1.1362 0.8695 0.7574 0.1211 0.1642 -0.2386 458 LYS A CA
|
|
1754 C C . LYS A 256 ? 1.1447 0.8699 0.7774 0.0968 0.1415 -0.2235 458 LYS A C
|
|
1755 O O . LYS A 256 ? 1.0986 0.8474 0.7597 0.0869 0.1410 -0.1963 458 LYS A O
|
|
1756 C CB . LYS A 256 ? 1.1798 0.9341 0.7504 0.1224 0.1735 -0.2418 458 LYS A CB
|
|
1757 C CG . LYS A 256 ? 1.2325 1.0130 0.7971 0.1437 0.2015 -0.2443 458 LYS A CG
|
|
1758 C CD . LYS A 256 ? 1.2924 1.0920 0.8020 0.1458 0.2113 -0.2474 458 LYS A CD
|
|
1759 C CE . LYS A 256 ? 1.3372 1.1737 0.8473 0.1634 0.2422 -0.2404 458 LYS A CE
|
|
1760 N NZ . LYS A 256 ? 1.5358 1.4013 1.0036 0.1588 0.2529 -0.2263 458 LYS A NZ
|
|
1761 N N . ALA A 257 ? 1.1143 0.8084 0.7262 0.0879 0.1225 -0.2428 459 ALA A N
|
|
1762 C CA . ALA A 257 ? 1.0761 0.7615 0.6989 0.0659 0.1015 -0.2324 459 ALA A CA
|
|
1763 C C . ALA A 257 ? 1.1026 0.7845 0.7765 0.0628 0.0990 -0.2158 459 ALA A C
|
|
1764 O O . ALA A 257 ? 1.0516 0.7564 0.7436 0.0500 0.0953 -0.1909 459 ALA A O
|
|
1765 C CB . ALA A 257 ? 1.1134 0.7640 0.7124 0.0610 0.0828 -0.2601 459 ALA A CB
|
|
1766 N N . LEU A 258 ? 1.0853 0.7412 0.7831 0.0763 0.1023 -0.2289 460 LEU A N
|
|
1767 C CA . LEU A 258 ? 1.0634 0.7131 0.8104 0.0765 0.1013 -0.2116 460 LEU A CA
|
|
1768 C C . LEU A 258 ? 1.0840 0.7720 0.8554 0.0824 0.1147 -0.1823 460 LEU A C
|
|
1769 O O . LEU A 258 ? 1.0605 0.7578 0.8630 0.0754 0.1096 -0.1590 460 LEU A O
|
|
1770 C CB . LEU A 258 ? 1.1066 0.7177 0.8750 0.0916 0.1026 -0.2338 460 LEU A CB
|
|
1771 C CG . LEU A 258 ? 1.1529 0.7521 0.9752 0.0952 0.1030 -0.2153 460 LEU A CG
|
|
1772 C CD1 . LEU A 258 ? 1.1223 0.7137 0.9623 0.0742 0.0869 -0.1991 460 LEU A CD1
|
|
1773 C CD2 . LEU A 258 ? 1.2136 0.7754 1.0576 0.1130 0.1067 -0.2401 460 LEU A CD2
|
|
1774 N N . ASP A 259 ? 1.0343 0.7467 0.7923 0.0955 0.1318 -0.1835 461 ASP A N
|
|
1775 C CA . ASP A 259 ? 0.9960 0.7481 0.7788 0.1013 0.1442 -0.1581 461 ASP A CA
|
|
1776 C C . ASP A 259 ? 0.9981 0.7798 0.7822 0.0811 0.1343 -0.1349 461 ASP A C
|
|
1777 O O . ASP A 259 ? 0.9873 0.7893 0.8036 0.0793 0.1321 -0.1127 461 ASP A O
|
|
1778 C CB . ASP A 259 ? 1.0370 0.8106 0.8041 0.1174 0.1651 -0.1656 461 ASP A CB
|
|
1779 C CG . ASP A 259 ? 1.1161 0.9308 0.9161 0.1254 0.1785 -0.1418 461 ASP A CG
|
|
1780 O OD1 . ASP A 259 ? 1.1270 0.9393 0.9652 0.1380 0.1816 -0.1343 461 ASP A OD1
|
|
1781 O OD2 . ASP A 259 ? 1.1624 1.0115 0.9525 0.1199 0.1860 -0.1308 461 ASP A OD2
|
|
1782 N N . LEU A 260 ? 0.9244 0.7074 0.6746 0.0664 0.1266 -0.1411 462 LEU A N
|
|
1783 C CA . LEU A 260 ? 0.8700 0.6774 0.6217 0.0467 0.1156 -0.1239 462 LEU A CA
|
|
1784 C C . LEU A 260 ? 0.9207 0.7187 0.6938 0.0350 0.0997 -0.1155 462 LEU A C
|
|
1785 O O . LEU A 260 ? 0.8945 0.7213 0.6882 0.0275 0.0956 -0.0963 462 LEU A O
|
|
1786 C CB . LEU A 260 ? 0.8650 0.6683 0.5777 0.0356 0.1100 -0.1339 462 LEU A CB
|
|
1787 C CG . LEU A 260 ? 0.8703 0.6953 0.5840 0.0158 0.0985 -0.1200 462 LEU A CG
|
|
1788 C CD1 . LEU A 260 ? 0.8187 0.6865 0.5597 0.0150 0.1066 -0.0986 462 LEU A CD1
|
|
1789 C CD2 . LEU A 260 ? 0.9501 0.7686 0.6259 0.0096 0.0955 -0.1288 462 LEU A CD2
|
|
1790 N N . VAL A 261 ? 0.9060 0.6655 0.6760 0.0342 0.0912 -0.1304 463 VAL A N
|
|
1791 C CA . VAL A 261 ? 0.8861 0.6334 0.6778 0.0239 0.0786 -0.1226 463 VAL A CA
|
|
1792 C C . VAL A 261 ? 0.9302 0.6979 0.7581 0.0327 0.0852 -0.0989 463 VAL A C
|
|
1793 O O . VAL A 261 ? 0.8993 0.6951 0.7398 0.0234 0.0793 -0.0799 463 VAL A O
|
|
1794 C CB . VAL A 261 ? 0.9592 0.6599 0.7493 0.0248 0.0716 -0.1438 463 VAL A CB
|
|
1795 C CG1 . VAL A 261 ? 0.9422 0.6321 0.7635 0.0162 0.0628 -0.1309 463 VAL A CG1
|
|
1796 C CG2 . VAL A 261 ? 0.9623 0.6470 0.7160 0.0155 0.0613 -0.1664 463 VAL A CG2
|
|
1797 N N . LYS A 262 ? 0.9092 0.6664 0.7525 0.0521 0.0974 -0.1011 464 LYS A N
|
|
1798 C CA . LYS A 262 ? 0.8930 0.6677 0.7721 0.0648 0.1044 -0.0788 464 LYS A CA
|
|
1799 C C . LYS A 262 ? 0.9182 0.7435 0.8037 0.0615 0.1055 -0.0583 464 LYS A C
|
|
1800 O O . LYS A 262 ? 0.9266 0.7723 0.8356 0.0612 0.1011 -0.0362 464 LYS A O
|
|
1801 C CB . LYS A 262 ? 0.9469 0.7059 0.8377 0.0875 0.1189 -0.0896 464 LYS A CB
|
|
1802 C CG . LYS A 262 ? 0.9729 0.6825 0.8742 0.0941 0.1169 -0.1071 464 LYS A CG
|
|
1803 C CD . LYS A 262 ? 1.0820 0.7790 0.9927 0.1177 0.1317 -0.1230 464 LYS A CD
|
|
1804 C CE . LYS A 262 ? 1.3338 0.9879 1.2769 0.1278 0.1300 -0.1308 464 LYS A CE
|
|
1805 N NZ . LYS A 262 ? 1.5205 1.1669 1.4804 0.1531 0.1450 -0.1445 464 LYS A NZ
|
|
1806 N N . LYS A 263 ? 0.8545 0.7007 0.7197 0.0581 0.1102 -0.0652 465 LYS A N
|
|
1807 C CA . LYS A 263 ? 0.8044 0.6981 0.6797 0.0535 0.1104 -0.0494 465 LYS A CA
|
|
1808 C C . LYS A 263 ? 0.8235 0.7358 0.6968 0.0339 0.0944 -0.0412 465 LYS A C
|
|
1809 O O . LYS A 263 ? 0.7931 0.7447 0.6842 0.0314 0.0911 -0.0268 465 LYS A O
|
|
1810 C CB . LYS A 263 ? 0.8122 0.7205 0.6729 0.0570 0.1229 -0.0575 465 LYS A CB
|
|
1811 C CG . LYS A 263 ? 0.8257 0.7423 0.7052 0.0789 0.1405 -0.0558 465 LYS A CG
|
|
1812 C CD . LYS A 263 ? 0.9335 0.8462 0.7892 0.0865 0.1564 -0.0716 465 LYS A CD
|
|
1813 C CE . LYS A 263 ? 1.0032 0.9243 0.8812 0.1100 0.1748 -0.0719 465 LYS A CE
|
|
1814 N NZ . LYS A 263 ? 1.0985 1.0288 0.9551 0.1181 0.1938 -0.0837 465 LYS A NZ
|
|
1815 N N . LEU A 264 ? 0.7904 0.6761 0.6440 0.0205 0.0841 -0.0525 466 LEU A N
|
|
1816 C CA . LEU A 264 ? 0.7571 0.6573 0.6087 0.0024 0.0693 -0.0485 466 LEU A CA
|
|
1817 C C . LEU A 264 ? 0.8125 0.7084 0.6805 0.0019 0.0632 -0.0363 466 LEU A C
|
|
1818 O O . LEU A 264 ? 0.7863 0.7099 0.6619 -0.0066 0.0546 -0.0260 466 LEU A O
|
|
1819 C CB . LEU A 264 ? 0.7504 0.6278 0.5744 -0.0117 0.0612 -0.0664 466 LEU A CB
|
|
1820 C CG . LEU A 264 ? 0.7900 0.6747 0.5949 -0.0141 0.0658 -0.0743 466 LEU A CG
|
|
1821 C CD1 . LEU A 264 ? 0.7964 0.6471 0.5704 -0.0207 0.0599 -0.0928 466 LEU A CD1
|
|
1822 C CD2 . LEU A 264 ? 0.7539 0.6761 0.5702 -0.0257 0.0593 -0.0656 466 LEU A CD2
|
|
1823 N N . LEU A 265 ? 0.8048 0.6670 0.6800 0.0113 0.0680 -0.0374 467 LEU A N
|
|
1824 C CA . LEU A 265 ? 0.7911 0.6480 0.6859 0.0112 0.0642 -0.0213 467 LEU A CA
|
|
1825 C C . LEU A 265 ? 0.8399 0.7225 0.7612 0.0264 0.0699 0.0035 467 LEU A C
|
|
1826 O O . LEU A 265 ? 0.8851 0.7516 0.8266 0.0341 0.0722 0.0176 467 LEU A O
|
|
1827 C CB . LEU A 265 ? 0.8090 0.6167 0.7050 0.0099 0.0633 -0.0331 467 LEU A CB
|
|
1828 C CG . LEU A 265 ? 0.8500 0.6386 0.7239 -0.0074 0.0530 -0.0534 467 LEU A CG
|
|
1829 C CD1 . LEU A 265 ? 0.8714 0.6139 0.7539 -0.0085 0.0506 -0.0650 467 LEU A CD1
|
|
1830 C CD2 . LEU A 265 ? 0.8116 0.6299 0.6841 -0.0236 0.0431 -0.0441 467 LEU A CD2
|
|
1831 N N . VAL A 266 ? 0.7370 0.6613 0.6610 0.0299 0.0710 0.0097 468 VAL A N
|
|
1832 C CA . VAL A 266 ? 0.7159 0.6756 0.6641 0.0436 0.0733 0.0320 468 VAL A CA
|
|
1833 C C . VAL A 266 ? 0.7562 0.7497 0.7072 0.0353 0.0618 0.0494 468 VAL A C
|
|
1834 O O . VAL A 266 ? 0.7462 0.7575 0.6824 0.0201 0.0530 0.0402 468 VAL A O
|
|
1835 C CB . VAL A 266 ? 0.7335 0.7236 0.6855 0.0494 0.0788 0.0271 468 VAL A CB
|
|
1836 C CG1 . VAL A 266 ? 0.7151 0.7533 0.6919 0.0588 0.0756 0.0481 468 VAL A CG1
|
|
1837 C CG2 . VAL A 266 ? 0.7489 0.7114 0.7004 0.0624 0.0935 0.0139 468 VAL A CG2
|
|
1838 N N . VAL A 267 ? 0.7167 0.7185 0.6862 0.0458 0.0619 0.0741 469 VAL A N
|
|
1839 C CA . VAL A 267 ? 0.6930 0.7300 0.6633 0.0416 0.0528 0.0943 469 VAL A CA
|
|
1840 C C . VAL A 267 ? 0.7321 0.8266 0.7017 0.0407 0.0437 0.0958 469 VAL A C
|
|
1841 O O . VAL A 267 ? 0.7269 0.8471 0.6836 0.0287 0.0341 0.0927 469 VAL A O
|
|
1842 C CB . VAL A 267 ? 0.7517 0.7800 0.7429 0.0549 0.0567 0.1241 469 VAL A CB
|
|
1843 C CG1 . VAL A 267 ? 0.7385 0.8141 0.7292 0.0557 0.0485 0.1498 469 VAL A CG1
|
|
1844 C CG2 . VAL A 267 ? 0.7681 0.7428 0.7621 0.0494 0.0619 0.1210 469 VAL A CG2
|
|
1845 N N . ASP A 268 ? 0.6814 0.7969 0.6675 0.0536 0.0465 0.0986 470 ASP A N
|
|
1846 C CA . ASP A 268 ? 0.6382 0.8083 0.6313 0.0534 0.0372 0.0978 470 ASP A CA
|
|
1847 C C . ASP A 268 ? 0.6609 0.8330 0.6402 0.0355 0.0332 0.0711 470 ASP A C
|
|
1848 O O . ASP A 268 ? 0.6626 0.8098 0.6402 0.0342 0.0423 0.0569 470 ASP A O
|
|
1849 C CB . ASP A 268 ? 0.6478 0.8339 0.6679 0.0714 0.0432 0.1060 470 ASP A CB
|
|
1850 C CG . ASP A 268 ? 0.6694 0.9150 0.7054 0.0739 0.0321 0.1091 470 ASP A CG
|
|
1851 O OD1 . ASP A 268 ? 0.6704 0.9457 0.6956 0.0613 0.0190 0.1016 470 ASP A OD1
|
|
1852 O OD2 . ASP A 268 ? 0.7115 0.9751 0.7737 0.0887 0.0360 0.1170 470 ASP A OD2
|
|
1853 N N . PRO A 269 ? 0.5866 0.7869 0.5556 0.0222 0.0202 0.0639 471 PRO A N
|
|
1854 C CA . PRO A 269 ? 0.5467 0.7449 0.5073 0.0053 0.0159 0.0393 471 PRO A CA
|
|
1855 C C . PRO A 269 ? 0.5853 0.8064 0.5654 0.0064 0.0167 0.0319 471 PRO A C
|
|
1856 O O . PRO A 269 ? 0.5788 0.7849 0.5543 -0.0047 0.0188 0.0160 471 PRO A O
|
|
1857 C CB . PRO A 269 ? 0.5406 0.7673 0.4917 -0.0058 0.0017 0.0339 471 PRO A CB
|
|
1858 C CG . PRO A 269 ? 0.6097 0.8712 0.5662 0.0068 -0.0028 0.0559 471 PRO A CG
|
|
1859 C CD . PRO A 269 ? 0.5846 0.8203 0.5492 0.0228 0.0094 0.0772 471 PRO A CD
|
|
1860 N N . LYS A 270 ? 0.5310 0.7863 0.5347 0.0207 0.0162 0.0456 472 LYS A N
|
|
1861 C CA . LYS A 270 ? 0.4958 0.7782 0.5264 0.0235 0.0180 0.0419 472 LYS A CA
|
|
1862 C C . LYS A 270 ? 0.5742 0.8251 0.6088 0.0314 0.0371 0.0419 472 LYS A C
|
|
1863 O O . LYS A 270 ? 0.5695 0.8280 0.6166 0.0266 0.0427 0.0334 472 LYS A O
|
|
1864 C CB . LYS A 270 ? 0.4913 0.8252 0.5475 0.0360 0.0083 0.0556 472 LYS A CB
|
|
1865 C CG . LYS A 270 ? 0.4100 0.7852 0.4626 0.0284 -0.0120 0.0506 472 LYS A CG
|
|
1866 C CD . LYS A 270 ? 0.3829 0.8169 0.4651 0.0377 -0.0250 0.0562 472 LYS A CD
|
|
1867 C CE . LYS A 270 ? 0.4368 0.8944 0.5496 0.0282 -0.0291 0.0391 472 LYS A CE
|
|
1868 N NZ . LYS A 270 ? 0.4809 0.9970 0.6266 0.0375 -0.0436 0.0432 472 LYS A NZ
|
|
1869 N N . ALA A 271 ? 0.5589 0.7748 0.5840 0.0435 0.0475 0.0509 473 ALA A N
|
|
1870 C CA . ALA A 271 ? 0.5814 0.7644 0.6069 0.0539 0.0660 0.0480 473 ALA A CA
|
|
1871 C C . ALA A 271 ? 0.6768 0.8136 0.6712 0.0426 0.0721 0.0309 473 ALA A C
|
|
1872 O O . ALA A 271 ? 0.6991 0.8188 0.6892 0.0464 0.0859 0.0222 473 ALA A O
|
|
1873 C CB . ALA A 271 ? 0.6160 0.7833 0.6513 0.0731 0.0721 0.0638 473 ALA A CB
|
|
1874 N N . ARG A 272 ? 0.6167 0.7357 0.5893 0.0296 0.0618 0.0259 474 ARG A N
|
|
1875 C CA . ARG A 272 ? 0.6075 0.6855 0.5519 0.0179 0.0635 0.0094 474 ARG A CA
|
|
1876 C C . ARG A 272 ? 0.6514 0.7314 0.5894 0.0097 0.0684 -0.0032 474 ARG A C
|
|
1877 O O . ARG A 272 ? 0.6392 0.7562 0.5953 0.0045 0.0642 -0.0012 474 ARG A O
|
|
1878 C CB . ARG A 272 ? 0.5670 0.6445 0.4986 0.0030 0.0491 0.0065 474 ARG A CB
|
|
1879 C CG . ARG A 272 ? 0.5069 0.5418 0.4128 -0.0082 0.0481 -0.0087 474 ARG A CG
|
|
1880 C CD . ARG A 272 ? 0.6458 0.6701 0.5493 -0.0105 0.0421 -0.0017 474 ARG A CD
|
|
1881 N NE . ARG A 272 ? 0.7222 0.7765 0.6256 -0.0227 0.0291 -0.0019 474 ARG A NE
|
|
1882 C CZ . ARG A 272 ? 0.8200 0.8959 0.7296 -0.0205 0.0242 0.0124 474 ARG A CZ
|
|
1883 N NH1 . ARG A 272 ? 0.6346 0.7061 0.5544 -0.0068 0.0306 0.0317 474 ARG A NH1
|
|
1884 N NH2 . ARG A 272 ? 0.7118 0.8152 0.6181 -0.0312 0.0132 0.0080 474 ARG A NH2
|
|
1885 N N . PHE A 273 ? 0.6140 0.6557 0.5277 0.0088 0.0768 -0.0155 475 PHE A N
|
|
1886 C CA . PHE A 273 ? 0.6067 0.6479 0.5096 0.0020 0.0829 -0.0240 475 PHE A CA
|
|
1887 C C . PHE A 273 ? 0.6546 0.7062 0.5542 -0.0180 0.0683 -0.0292 475 PHE A C
|
|
1888 O O . PHE A 273 ? 0.6357 0.6739 0.5242 -0.0274 0.0557 -0.0345 475 PHE A O
|
|
1889 C CB . PHE A 273 ? 0.6576 0.6560 0.5297 0.0069 0.0928 -0.0367 475 PHE A CB
|
|
1890 C CG . PHE A 273 ? 0.7062 0.7051 0.5761 0.0211 0.1125 -0.0382 475 PHE A CG
|
|
1891 C CD1 . PHE A 273 ? 0.7434 0.7683 0.6426 0.0361 0.1233 -0.0276 475 PHE A CD1
|
|
1892 C CD2 . PHE A 273 ? 0.7664 0.7408 0.6040 0.0214 0.1205 -0.0508 475 PHE A CD2
|
|
1893 C CE1 . PHE A 273 ? 0.7650 0.7927 0.6639 0.0502 0.1433 -0.0301 475 PHE A CE1
|
|
1894 C CE2 . PHE A 273 ? 0.8314 0.8097 0.6642 0.0359 0.1406 -0.0530 475 PHE A CE2
|
|
1895 C CZ . PHE A 273 ? 0.7954 0.8004 0.6601 0.0501 0.1527 -0.0430 475 PHE A CZ
|
|
1896 N N . THR A 274 ? 0.6076 0.6836 0.5209 -0.0244 0.0705 -0.0274 476 THR A N
|
|
1897 C CA . THR A 274 ? 0.5800 0.6642 0.4961 -0.0428 0.0572 -0.0328 476 THR A CA
|
|
1898 C C . THR A 274 ? 0.6510 0.7006 0.5359 -0.0486 0.0610 -0.0404 476 THR A C
|
|
1899 O O . THR A 274 ? 0.6784 0.7036 0.5405 -0.0378 0.0738 -0.0425 476 THR A O
|
|
1900 C CB . THR A 274 ? 0.5850 0.7110 0.5377 -0.0469 0.0571 -0.0263 476 THR A CB
|
|
1901 O OG1 . THR A 274 ? 0.7072 0.8336 0.6613 -0.0400 0.0760 -0.0197 476 THR A OG1
|
|
1902 C CG2 . THR A 274 ? 0.4213 0.5847 0.4035 -0.0396 0.0510 -0.0199 476 THR A CG2
|
|
1903 N N . THR A 275 ? 0.6052 0.6528 0.4892 -0.0644 0.0494 -0.0453 477 THR A N
|
|
1904 C CA . THR A 275 ? 0.6307 0.6487 0.4855 -0.0699 0.0510 -0.0499 477 THR A CA
|
|
1905 C C . THR A 275 ? 0.7131 0.7391 0.5663 -0.0639 0.0695 -0.0399 477 THR A C
|
|
1906 O O . THR A 275 ? 0.7544 0.7564 0.5742 -0.0569 0.0796 -0.0425 477 THR A O
|
|
1907 C CB . THR A 275 ? 0.7383 0.7539 0.5984 -0.0870 0.0332 -0.0559 477 THR A CB
|
|
1908 O OG1 . THR A 275 ? 0.7318 0.7829 0.6315 -0.0949 0.0273 -0.0515 477 THR A OG1
|
|
1909 C CG2 . THR A 275 ? 0.6978 0.6984 0.5488 -0.0909 0.0190 -0.0673 477 THR A CG2
|
|
1910 N N . GLU A 276 ? 0.6263 0.6887 0.5168 -0.0652 0.0749 -0.0291 478 GLU A N
|
|
1911 C CA . GLU A 276 ? 0.6288 0.7067 0.5267 -0.0596 0.0949 -0.0167 478 GLU A CA
|
|
1912 C C . GLU A 276 ? 0.6912 0.7618 0.5703 -0.0395 0.1144 -0.0172 478 GLU A C
|
|
1913 O O . GLU A 276 ? 0.7296 0.7921 0.5851 -0.0326 0.1315 -0.0142 478 GLU A O
|
|
1914 C CB . GLU A 276 ? 0.6183 0.7390 0.5690 -0.0661 0.0946 -0.0064 478 GLU A CB
|
|
1915 C CG . GLU A 276 ? 0.8338 0.9629 0.8098 -0.0849 0.0739 -0.0099 478 GLU A CG
|
|
1916 C CD . GLU A 276 ? 1.2089 1.3441 1.1942 -0.0885 0.0531 -0.0229 478 GLU A CD
|
|
1917 O OE1 . GLU A 276 ? 1.2658 1.4182 1.2604 -0.0779 0.0537 -0.0231 478 GLU A OE1
|
|
1918 O OE2 . GLU A 276 ? 1.1035 1.2285 1.0880 -0.1012 0.0365 -0.0319 478 GLU A OE2
|
|
1919 N N . GLU A 277 ? 0.6108 0.6843 0.4998 -0.0293 0.1120 -0.0210 479 GLU A N
|
|
1920 C CA . GLU A 277 ? 0.6255 0.6899 0.5033 -0.0092 0.1286 -0.0231 479 GLU A CA
|
|
1921 C C . GLU A 277 ? 0.7166 0.7376 0.5471 -0.0044 0.1303 -0.0371 479 GLU A C
|
|
1922 O O . GLU A 277 ? 0.7554 0.7683 0.5656 0.0086 0.1480 -0.0407 479 GLU A O
|
|
1923 C CB . GLU A 277 ? 0.6209 0.6964 0.5232 0.0003 0.1233 -0.0212 479 GLU A CB
|
|
1924 C CG . GLU A 277 ? 0.6105 0.7328 0.5595 0.0001 0.1228 -0.0089 479 GLU A CG
|
|
1925 C CD . GLU A 277 ? 0.7950 0.9294 0.7645 0.0123 0.1179 -0.0046 479 GLU A CD
|
|
1926 O OE1 . GLU A 277 ? 0.6791 0.8035 0.6416 0.0077 0.1020 -0.0072 479 GLU A OE1
|
|
1927 O OE2 . GLU A 277 ? 0.8692 1.0210 0.8597 0.0279 0.1314 0.0021 479 GLU A OE2
|
|
1928 N N . ALA A 278 ? 0.6482 0.6439 0.4625 -0.0150 0.1116 -0.0463 480 ALA A N
|
|
1929 C CA . ALA A 278 ? 0.6681 0.6230 0.4421 -0.0136 0.1077 -0.0614 480 ALA A CA
|
|
1930 C C . ALA A 278 ? 0.7697 0.7189 0.5128 -0.0151 0.1159 -0.0620 480 ALA A C
|
|
1931 O O . ALA A 278 ? 0.8067 0.7400 0.5210 -0.0019 0.1280 -0.0712 480 ALA A O
|
|
1932 C CB . ALA A 278 ? 0.6557 0.5945 0.4279 -0.0276 0.0859 -0.0678 480 ALA A CB
|
|
1933 N N . LEU A 279 ? 0.7323 0.6985 0.4846 -0.0295 0.1112 -0.0508 481 LEU A N
|
|
1934 C CA . LEU A 279 ? 0.7557 0.7207 0.4825 -0.0322 0.1190 -0.0446 481 LEU A CA
|
|
1935 C C . LEU A 279 ? 0.8541 0.8368 0.5746 -0.0173 0.1455 -0.0372 481 LEU A C
|
|
1936 O O . LEU A 279 ? 0.8967 0.8730 0.5812 -0.0134 0.1552 -0.0357 481 LEU A O
|
|
1937 C CB . LEU A 279 ? 0.7290 0.7107 0.4806 -0.0509 0.1085 -0.0308 481 LEU A CB
|
|
1938 C CG . LEU A 279 ? 0.7465 0.7072 0.4926 -0.0653 0.0839 -0.0393 481 LEU A CG
|
|
1939 C CD1 . LEU A 279 ? 0.6824 0.6656 0.4711 -0.0816 0.0728 -0.0296 481 LEU A CD1
|
|
1940 C CD2 . LEU A 279 ? 0.7854 0.7197 0.4866 -0.0658 0.0804 -0.0428 481 LEU A CD2
|
|
1941 N N . ARG A 280 ? 0.8056 0.8126 0.5603 -0.0078 0.1574 -0.0324 482 ARG A N
|
|
1942 C CA . ARG A 280 ? 0.8303 0.8584 0.5875 0.0084 0.1842 -0.0265 482 ARG A CA
|
|
1943 C C . ARG A 280 ? 0.9168 0.9229 0.6487 0.0288 0.1932 -0.0453 482 ARG A C
|
|
1944 O O . ARG A 280 ? 0.9693 0.9881 0.6939 0.0444 0.2160 -0.0455 482 ARG A O
|
|
1945 C CB . ARG A 280 ? 0.7931 0.8611 0.6060 0.0089 0.1913 -0.0122 482 ARG A CB
|
|
1946 C CG . ARG A 280 ? 0.8748 0.9720 0.7186 -0.0072 0.1912 0.0068 482 ARG A CG
|
|
1947 C CD . ARG A 280 ? 1.0524 1.1910 0.9513 -0.0038 0.2003 0.0182 482 ARG A CD
|
|
1948 N NE . ARG A 280 ? 1.2396 1.3941 1.1805 -0.0171 0.1784 0.0198 482 ARG A NE
|
|
1949 C CZ . ARG A 280 ? 1.4478 1.6117 1.4108 -0.0366 0.1648 0.0264 482 ARG A CZ
|
|
1950 N NH1 . ARG A 280 ? 1.2953 1.4502 1.2419 -0.0463 0.1696 0.0351 482 ARG A NH1
|
|
1951 N NH2 . ARG A 280 ? 1.2424 1.4242 1.2431 -0.0458 0.1455 0.0238 482 ARG A NH2
|
|
1952 N N . HIS A 281 ? 0.8498 0.8246 0.5729 0.0291 0.1763 -0.0610 483 HIS A N
|
|
1953 C CA . HIS A 281 ? 0.8828 0.8317 0.5884 0.0472 0.1819 -0.0807 483 HIS A CA
|
|
1954 C C . HIS A 281 ? 0.9982 0.9318 0.6539 0.0579 0.1935 -0.0954 483 HIS A C
|
|
1955 O O . HIS A 281 ? 1.0154 0.9403 0.6388 0.0474 0.1855 -0.0953 483 HIS A O
|
|
1956 C CB . HIS A 281 ? 0.8824 0.7990 0.5895 0.0413 0.1599 -0.0923 483 HIS A CB
|
|
1957 C CG . HIS A 281 ? 0.9490 0.8401 0.6553 0.0588 0.1641 -0.1094 483 HIS A CG
|
|
1958 N ND1 . HIS A 281 ? 1.0102 0.8695 0.6787 0.0674 0.1647 -0.1330 483 HIS A ND1
|
|
1959 C CD2 . HIS A 281 ? 0.9546 0.8486 0.6962 0.0694 0.1671 -0.1058 483 HIS A CD2
|
|
1960 C CE1 . HIS A 281 ? 1.0157 0.8575 0.7010 0.0823 0.1683 -0.1444 483 HIS A CE1
|
|
1961 N NE2 . HIS A 281 ? 0.9882 0.8492 0.7175 0.0840 0.1701 -0.1269 483 HIS A NE2
|
|
1962 N N . PRO A 282 ? 0.9874 0.9183 0.6359 0.0798 0.2115 -0.1093 484 PRO A N
|
|
1963 C CA . PRO A 282 ? 1.0289 0.9478 0.6261 0.0923 0.2225 -0.1276 484 PRO A CA
|
|
1964 C C . PRO A 282 ? 1.1130 0.9949 0.6673 0.0852 0.2016 -0.1465 484 PRO A C
|
|
1965 O O . PRO A 282 ? 1.1594 1.0401 0.6669 0.0896 0.2067 -0.1541 484 PRO A O
|
|
1966 C CB . PRO A 282 ? 1.0676 0.9803 0.6749 0.1165 0.2377 -0.1462 484 PRO A CB
|
|
1967 C CG . PRO A 282 ? 1.0829 1.0230 0.7456 0.1180 0.2451 -0.1268 484 PRO A CG
|
|
1968 C CD . PRO A 282 ? 0.9919 0.9322 0.6793 0.0956 0.2225 -0.1098 484 PRO A CD
|
|
1969 N N . TRP A 283 ? 1.0525 0.9071 0.6227 0.0747 0.1785 -0.1532 485 TRP A N
|
|
1970 C CA . TRP A 283 ? 1.0671 0.8876 0.6046 0.0672 0.1573 -0.1718 485 TRP A CA
|
|
1971 C C . TRP A 283 ? 1.0938 0.9224 0.6062 0.0510 0.1474 -0.1585 485 TRP A C
|
|
1972 O O . TRP A 283 ? 1.1237 0.9354 0.5932 0.0515 0.1384 -0.1728 485 TRP A O
|
|
1973 C CB . TRP A 283 ? 1.0258 0.8195 0.5931 0.0589 0.1373 -0.1785 485 TRP A CB
|
|
1974 C CG . TRP A 283 ? 1.0557 0.8125 0.5960 0.0545 0.1173 -0.2025 485 TRP A CG
|
|
1975 C CD1 . TRP A 283 ? 1.1392 0.8718 0.6491 0.0686 0.1173 -0.2323 485 TRP A CD1
|
|
1976 C CD2 . TRP A 283 ? 1.0250 0.7664 0.5713 0.0353 0.0934 -0.2009 485 TRP A CD2
|
|
1977 N NE1 . TRP A 283 ? 1.1364 0.8398 0.6333 0.0584 0.0938 -0.2487 485 TRP A NE1
|
|
1978 C CE2 . TRP A 283 ? 1.1074 0.8159 0.6268 0.0379 0.0795 -0.2290 485 TRP A CE2
|
|
1979 C CE3 . TRP A 283 ? 0.9888 0.7435 0.5610 0.0165 0.0822 -0.1802 485 TRP A CE3
|
|
1980 C CZ2 . TRP A 283 ? 1.0799 0.7687 0.6006 0.0220 0.0556 -0.2349 485 TRP A CZ2
|
|
1981 C CZ3 . TRP A 283 ? 0.9959 0.7313 0.5668 0.0017 0.0600 -0.1868 485 TRP A CZ3
|
|
1982 C CH2 . TRP A 283 ? 1.0408 0.7437 0.5878 0.0043 0.0471 -0.2129 485 TRP A CH2
|
|
1983 N N . LEU A 284 ? 1.0008 0.8563 0.5418 0.0376 0.1487 -0.1317 486 LEU A N
|
|
1984 C CA . LEU A 284 ? 0.9765 0.8406 0.5043 0.0216 0.1396 -0.1156 486 LEU A CA
|
|
1985 C C . LEU A 284 ? 1.0038 0.8951 0.5088 0.0275 0.1609 -0.0995 486 LEU A C
|
|
1986 O O . LEU A 284 ? 0.9734 0.8710 0.4650 0.0161 0.1553 -0.0838 486 LEU A O
|
|
1987 C CB . LEU A 284 ? 0.9159 0.7916 0.4898 0.0027 0.1263 -0.0985 486 LEU A CB
|
|
1988 C CG . LEU A 284 ? 0.9320 0.7814 0.5178 -0.0044 0.1047 -0.1128 486 LEU A CG
|
|
1989 C CD1 . LEU A 284 ? 0.8869 0.7512 0.5191 -0.0078 0.1041 -0.1039 486 LEU A CD1
|
|
1990 C CD2 . LEU A 284 ? 0.9335 0.7672 0.5043 -0.0196 0.0830 -0.1152 486 LEU A CD2
|
|
1991 N N . GLN A 285 ? 0.9902 0.8972 0.4912 0.0460 0.1858 -0.1030 487 GLN A N
|
|
1992 C CA . GLN A 285 ? 1.0292 0.9652 0.5077 0.0539 0.2102 -0.0878 487 GLN A CA
|
|
1993 C C . GLN A 285 ? 1.1335 1.0528 0.5453 0.0649 0.2091 -0.1063 487 GLN A C
|
|
1994 O O . GLN A 285 ? 1.1521 1.0765 0.5370 0.0851 0.2275 -0.1220 487 GLN A O
|
|
1995 C CB . GLN A 285 ? 1.0465 1.0115 0.5532 0.0695 0.2384 -0.0836 487 GLN A CB
|
|
1996 C CG . GLN A 285 ? 1.0978 1.0837 0.6710 0.0597 0.2378 -0.0656 487 GLN A CG
|
|
1997 C CD . GLN A 285 ? 1.2194 1.2152 0.8174 0.0359 0.2231 -0.0423 487 GLN A CD
|
|
1998 O OE1 . GLN A 285 ? 1.0905 1.1066 0.6839 0.0289 0.2327 -0.0209 487 GLN A OE1
|
|
1999 N NE2 . GLN A 285 ? 1.1360 1.1169 0.7609 0.0232 0.1994 -0.0463 487 GLN A NE2
|
|
2000 N N . ASP A 286 ? 1.1302 1.0294 0.5173 0.0519 0.1853 -0.1066 488 ASP A N
|
|
2001 C CA . ASP A 286 ? 1.1886 1.0689 0.5140 0.0588 0.1747 -0.1251 488 ASP A CA
|
|
2002 C C . ASP A 286 ? 1.2663 1.1583 0.5687 0.0471 0.1696 -0.0980 488 ASP A C
|
|
2003 O O . ASP A 286 ? 1.2125 1.0911 0.5311 0.0292 0.1462 -0.0894 488 ASP A O
|
|
2004 C CB . ASP A 286 ? 1.2031 1.0434 0.5305 0.0540 0.1455 -0.1539 488 ASP A CB
|
|
2005 C CG . ASP A 286 ? 1.3436 1.1614 0.6137 0.0624 0.1306 -0.1809 488 ASP A CG
|
|
2006 O OD1 . ASP A 286 ? 1.4038 1.2316 0.6320 0.0616 0.1286 -0.1690 488 ASP A OD1
|
|
2007 O OD2 . ASP A 286 ? 1.3187 1.1079 0.5894 0.0683 0.1181 -0.2131 488 ASP A OD2
|
|
2008 N N . GLU A 287 ? 1.3084 1.2263 0.5734 0.0584 0.1923 -0.0841 489 GLU A N
|
|
2009 C CA . GLU A 287 ? 1.3298 1.2624 0.5721 0.0497 0.1919 -0.0529 489 GLU A CA
|
|
2010 C C . GLU A 287 ? 1.4026 1.3111 0.5990 0.0464 0.1640 -0.0623 489 GLU A C
|
|
2011 O O . GLU A 287 ? 1.3879 1.2982 0.5893 0.0318 0.1522 -0.0355 489 GLU A O
|
|
2012 C CB . GLU A 287 ? 1.3898 1.3613 0.6113 0.0618 0.2269 -0.0297 489 GLU A CB
|
|
2013 C CG . GLU A 287 ? 1.5196 1.5202 0.8063 0.0527 0.2475 -0.0008 489 GLU A CG
|
|
2014 C CD . GLU A 287 ? 1.7248 1.7216 1.0684 0.0272 0.2296 0.0233 489 GLU A CD
|
|
2015 O OE1 . GLU A 287 ? 1.5162 1.5058 0.8457 0.0156 0.2145 0.0413 489 GLU A OE1
|
|
2016 O OE2 . GLU A 287 ? 1.6204 1.6222 1.0234 0.0198 0.2297 0.0230 489 GLU A OE2
|
|
2017 N N . ASP A 288 ? 1.3769 1.2615 0.5358 0.0592 0.1513 -0.1016 490 ASP A N
|
|
2018 C CA . ASP A 288 ? 1.3892 1.2489 0.5073 0.0578 0.1213 -0.1192 490 ASP A CA
|
|
2019 C C . ASP A 288 ? 1.3700 1.2053 0.5343 0.0359 0.0918 -0.1173 490 ASP A C
|
|
2020 O O . ASP A 288 ? 1.3670 1.1983 0.5229 0.0248 0.0733 -0.1009 490 ASP A O
|
|
2021 C CB . ASP A 288 ? 1.4466 1.2870 0.5288 0.0763 0.1159 -0.1661 490 ASP A CB
|
|
2022 C CG . ASP A 288 ? 1.5878 1.4463 0.5978 0.0986 0.1302 -0.1765 490 ASP A CG
|
|
2023 O OD1 . ASP A 288 ? 1.6214 1.5142 0.6154 0.1039 0.1572 -0.1464 490 ASP A OD1
|
|
2024 O OD2 . ASP A 288 ? 1.6237 1.4637 0.5947 0.1111 0.1152 -0.2158 490 ASP A OD2
|
|
2025 N N . MET A 289 ? 1.2534 1.0742 0.4673 0.0306 0.0884 -0.1330 491 MET A N
|
|
2026 C CA . MET A 289 ? 1.1763 0.9774 0.4358 0.0117 0.0640 -0.1340 491 MET A CA
|
|
2027 C C . MET A 289 ? 1.2117 1.0298 0.5037 -0.0057 0.0632 -0.0971 491 MET A C
|
|
2028 O O . MET A 289 ? 1.2085 1.0138 0.5088 -0.0190 0.0394 -0.0928 491 MET A O
|
|
2029 C CB . MET A 289 ? 1.1570 0.9473 0.4609 0.0120 0.0672 -0.1517 491 MET A CB
|
|
2030 C CG . MET A 289 ? 1.1246 0.9033 0.4810 -0.0074 0.0479 -0.1478 491 MET A CG
|
|
2031 S SD . MET A 289 ? 1.1029 0.9106 0.5112 -0.0237 0.0563 -0.1103 491 MET A SD
|
|
2032 C CE . MET A 289 ? 1.0397 0.8693 0.4757 -0.0117 0.0861 -0.1072 491 MET A CE
|
|
2033 N N . LYS A 290 ? 1.1581 1.0051 0.4713 -0.0051 0.0889 -0.0715 492 LYS A N
|
|
2034 C CA . LYS A 290 ? 1.1202 0.9854 0.4705 -0.0210 0.0908 -0.0365 492 LYS A CA
|
|
2035 C C . LYS A 290 ? 1.2141 1.0794 0.5312 -0.0248 0.0809 -0.0161 492 LYS A C
|
|
2036 O O . LYS A 290 ? 1.1893 1.0483 0.5362 -0.0410 0.0628 -0.0020 492 LYS A O
|
|
2037 C CB . LYS A 290 ? 1.1189 1.0166 0.4991 -0.0181 0.1213 -0.0156 492 LYS A CB
|
|
2038 C CG . LYS A 290 ? 1.1417 1.0418 0.5761 -0.0218 0.1231 -0.0258 492 LYS A CG
|
|
2039 C CD . LYS A 290 ? 1.3412 1.2734 0.7986 -0.0140 0.1535 -0.0117 492 LYS A CD
|
|
2040 C CE . LYS A 290 ? 1.3838 1.3223 0.8950 -0.0165 0.1544 -0.0190 492 LYS A CE
|
|
2041 N NZ . LYS A 290 ? 1.4018 1.3719 0.9326 -0.0056 0.1839 -0.0086 492 LYS A NZ
|
|
2042 N N . ARG A 291 ? 1.2382 1.1094 0.4919 -0.0087 0.0906 -0.0172 493 ARG A N
|
|
2043 C CA . ARG A 291 ? 1.2768 1.1504 0.4878 -0.0083 0.0819 0.0030 493 ARG A CA
|
|
2044 C C . ARG A 291 ? 1.3238 1.1679 0.5317 -0.0173 0.0448 -0.0120 493 ARG A C
|
|
2045 O O . ARG A 291 ? 1.3022 1.1447 0.5299 -0.0304 0.0308 0.0123 493 ARG A O
|
|
2046 C CB . ARG A 291 ? 1.3506 1.2372 0.4887 0.0137 0.0982 -0.0040 493 ARG A CB
|
|
2047 C CG . ARG A 291 ? 1.5393 1.4515 0.6463 0.0161 0.1122 0.0371 493 ARG A CG
|
|
2048 C CD . ARG A 291 ? 1.7200 1.6512 0.7516 0.0398 0.1317 0.0295 493 ARG A CD
|
|
2049 N NE . ARG A 291 ? 1.7748 1.7275 0.8131 0.0525 0.1655 0.0207 493 ARG A NE
|
|
2050 C CZ . ARG A 291 ? 1.9360 1.8795 0.9546 0.0683 0.1688 -0.0218 493 ARG A CZ
|
|
2051 N NH1 . ARG A 291 ? 1.8018 1.7149 0.7944 0.0723 0.1404 -0.0600 493 ARG A NH1
|
|
2052 N NH2 . ARG A 291 ? 1.6997 1.6645 0.7295 0.0801 0.2002 -0.0266 493 ARG A NH2
|
|
2053 N N . LYS A 292 ? 1.2985 1.1192 0.4913 -0.0112 0.0289 -0.0521 494 LYS A N
|
|
2054 C CA . LYS A 292 ? 1.2941 1.0874 0.4889 -0.0191 -0.0058 -0.0717 494 LYS A CA
|
|
2055 C C . LYS A 292 ? 1.3279 1.1149 0.5876 -0.0400 -0.0200 -0.0586 494 LYS A C
|
|
2056 O O . LYS A 292 ? 1.3553 1.1312 0.6174 -0.0484 -0.0444 -0.0536 494 LYS A O
|
|
2057 C CB . LYS A 292 ? 1.3226 1.0940 0.5082 -0.0109 -0.0148 -0.1158 494 LYS A CB
|
|
2058 C CG . LYS A 292 ? 1.4606 1.2074 0.6300 -0.0137 -0.0490 -0.1390 494 LYS A CG
|
|
2059 N N . PHE A 293 ? 1.2221 1.0182 0.5338 -0.0474 -0.0056 -0.0537 495 PHE A N
|
|
2060 C CA . PHE A 293 ? 1.1751 0.9696 0.5480 -0.0659 -0.0174 -0.0443 495 PHE A CA
|
|
2061 C C . PHE A 293 ? 1.2258 1.0329 0.6142 -0.0754 -0.0183 -0.0081 495 PHE A C
|
|
2062 O O . PHE A 293 ? 1.1902 0.9867 0.6044 -0.0874 -0.0407 -0.0042 495 PHE A O
|
|
2063 C CB . PHE A 293 ? 1.1592 0.9648 0.5780 -0.0688 -0.0012 -0.0485 495 PHE A CB
|
|
2064 C CG . PHE A 293 ? 1.1291 0.9446 0.6095 -0.0857 -0.0062 -0.0337 495 PHE A CG
|
|
2065 C CD1 . PHE A 293 ? 1.1374 0.9389 0.6484 -0.0973 -0.0294 -0.0474 495 PHE A CD1
|
|
2066 C CD2 . PHE A 293 ? 1.1448 0.9855 0.6550 -0.0897 0.0124 -0.0078 495 PHE A CD2
|
|
2067 C CE1 . PHE A 293 ? 1.1088 0.9214 0.6756 -0.1115 -0.0344 -0.0378 495 PHE A CE1
|
|
2068 C CE2 . PHE A 293 ? 1.1413 0.9915 0.7104 -0.1050 0.0056 0.0019 495 PHE A CE2
|
|
2069 C CZ . PHE A 293 ? 1.0908 0.9271 0.6862 -0.1152 -0.0179 -0.0144 495 PHE A CZ
|
|
2070 N N . GLN A 294 ? 1.2035 1.0335 0.5788 -0.0697 0.0066 0.0189 496 GLN A N
|
|
2071 C CA . GLN A 294 ? 1.1974 1.0407 0.5882 -0.0778 0.0104 0.0580 496 GLN A CA
|
|
2072 C C . GLN A 294 ? 1.2847 1.1146 0.6390 -0.0765 -0.0114 0.0667 496 GLN A C
|
|
2073 O O . GLN A 294 ? 1.2814 1.1102 0.6656 -0.0879 -0.0223 0.0920 496 GLN A O
|
|
2074 C CB . GLN A 294 ? 1.2374 1.1090 0.6123 -0.0690 0.0439 0.0834 496 GLN A CB
|
|
2075 C CG . GLN A 294 ? 1.3348 1.2261 0.7647 -0.0745 0.0646 0.0878 496 GLN A CG
|
|
2076 C CD . GLN A 294 ? 1.4940 1.3865 0.9960 -0.0943 0.0531 0.1012 496 GLN A CD
|
|
2077 O OE1 . GLN A 294 ? 1.5087 1.4000 1.0273 -0.1039 0.0444 0.1273 496 GLN A OE1
|
|
2078 N NE2 . GLN A 294 ? 1.2445 1.1399 0.7918 -0.1001 0.0520 0.0830 496 GLN A NE2
|
|
2079 N N . ASP A 295 ? 1.2777 1.0972 0.5698 -0.0622 -0.0190 0.0443 497 ASP A N
|
|
2080 C CA . ASP A 295 ? 1.3257 1.1338 0.5727 -0.0574 -0.0421 0.0463 497 ASP A CA
|
|
2081 C C . ASP A 295 ? 1.3760 1.1602 0.6565 -0.0693 -0.0758 0.0297 497 ASP A C
|
|
2082 O O . ASP A 295 ? 1.3998 1.1785 0.6808 -0.0738 -0.0951 0.0482 497 ASP A O
|
|
2083 C CB . ASP A 295 ? 1.3953 1.2022 0.5693 -0.0376 -0.0398 0.0204 497 ASP A CB
|
|
2084 C CG . ASP A 295 ? 1.4992 1.3328 0.6252 -0.0224 -0.0088 0.0389 497 ASP A CG
|
|
2085 O OD1 . ASP A 295 ? 1.4768 1.3313 0.6269 -0.0279 0.0127 0.0773 497 ASP A OD1
|
|
2086 O OD2 . ASP A 295 ? 1.5824 1.4172 0.6496 -0.0048 -0.0051 0.0139 497 ASP A OD2
|
|
2087 N N . LEU A 296 ? 1.2956 1.0670 0.6059 -0.0739 -0.0822 -0.0033 498 LEU A N
|
|
2088 C CA . LEU A 296 ? 1.2561 1.0083 0.6034 -0.0854 -0.1105 -0.0218 498 LEU A CA
|
|
2089 C C . LEU A 296 ? 1.2798 1.0368 0.6898 -0.1014 -0.1147 0.0014 498 LEU A C
|
|
2090 O O . LEU A 296 ? 1.2691 1.0143 0.7022 -0.1093 -0.1395 0.0006 498 LEU A O
|
|
2091 C CB . LEU A 296 ? 1.2130 0.9553 0.5795 -0.0863 -0.1100 -0.0573 498 LEU A CB
|
|
2092 C CG . LEU A 296 ? 1.2894 1.0220 0.6068 -0.0717 -0.1090 -0.0868 498 LEU A CG
|
|
2093 C CD1 . LEU A 296 ? 1.2509 0.9789 0.5961 -0.0724 -0.0981 -0.1103 498 LEU A CD1
|
|
2094 C CD2 . LEU A 296 ? 1.3170 1.0319 0.6072 -0.0692 -0.1391 -0.1056 498 LEU A CD2
|
|
2095 N N . LEU A 297 ? 1.2130 0.9881 0.6530 -0.1056 -0.0907 0.0201 499 LEU A N
|
|
2096 C CA . LEU A 297 ? 1.1823 0.9653 0.6855 -0.1202 -0.0907 0.0404 499 LEU A CA
|
|
2097 C C . LEU A 297 ? 1.3066 1.0884 0.8088 -0.1230 -0.1005 0.0737 499 LEU A C
|
|
2098 O O . LEU A 297 ? 1.2949 1.0660 0.8360 -0.1329 -0.1223 0.0751 499 LEU A O
|
|
2099 C CB . LEU A 297 ? 1.1658 0.9715 0.6922 -0.1211 -0.0614 0.0533 499 LEU A CB
|
|
2100 C CG . LEU A 297 ? 1.1706 0.9830 0.7529 -0.1304 -0.0589 0.0369 499 LEU A CG
|
|
2101 C CD1 . LEU A 297 ? 1.1581 0.9958 0.7636 -0.1307 -0.0317 0.0548 499 LEU A CD1
|
|
2102 C CD2 . LEU A 297 ? 1.1836 0.9896 0.8219 -0.1451 -0.0808 0.0357 499 LEU A CD2
|
|
2103 N N . SER A 298 ? 1.3312 1.1246 0.7888 -0.1135 -0.0844 0.1011 500 SER A N
|
|
2104 C CA . SER A 298 ? 1.3792 1.1733 0.8312 -0.1147 -0.0913 0.1391 500 SER A CA
|
|
2105 C C . SER A 298 ? 1.4697 1.2442 0.8955 -0.1112 -0.1236 0.1305 500 SER A C
|
|
2106 O O . SER A 298 ? 1.4837 1.2530 0.9306 -0.1166 -0.1383 0.1571 500 SER A O
|
|
2107 C CB . SER A 298 ? 1.4819 1.2970 0.8882 -0.1041 -0.0641 0.1711 500 SER A CB
|
|
2108 O OG . SER A 298 ? 1.6594 1.4790 0.9981 -0.0875 -0.0537 0.1487 500 SER A OG
|
|
2109 N N . GLU A 299 ? 1.4399 1.2034 0.8267 -0.1028 -0.1357 0.0932 501 GLU A N
|
|
2110 C CA . GLU A 299 ? 1.4621 1.2082 0.8286 -0.0997 -0.1682 0.0780 501 GLU A CA
|
|
2111 C C . GLU A 299 ? 1.5008 1.2338 0.9383 -0.1148 -0.1898 0.0690 501 GLU A C
|
|
2112 O O . GLU A 299 ? 1.5183 1.2428 0.9677 -0.1171 -0.2127 0.0829 501 GLU A O
|
|
2113 C CB . GLU A 299 ? 1.4895 1.2280 0.8089 -0.0889 -0.1735 0.0371 501 GLU A CB
|
|
2114 N N . GLU A 300 ? 1.4198 1.1539 0.9052 -0.1241 -0.1815 0.0473 502 GLU A N
|
|
2115 C CA . GLU A 300 ? 1.3788 1.1060 0.9326 -0.1376 -0.1972 0.0350 502 GLU A CA
|
|
2116 C C . GLU A 300 ? 1.4559 1.1875 1.0586 -0.1468 -0.1973 0.0692 502 GLU A C
|
|
2117 O O . GLU A 300 ? 1.4531 1.1743 1.0906 -0.1523 -0.2202 0.0725 502 GLU A O
|
|
2118 C CB . GLU A 300 ? 1.3443 1.0781 0.9283 -0.1430 -0.1830 0.0088 502 GLU A CB
|
|
2119 C CG . GLU A 300 ? 1.4592 1.1933 1.1134 -0.1563 -0.1937 -0.0030 502 GLU A CG
|
|
2120 C CD . GLU A 300 ? 1.7457 1.4951 1.4374 -0.1626 -0.1757 -0.0133 502 GLU A CD
|
|
2121 O OE1 . GLU A 300 ? 1.8082 1.5717 1.5040 -0.1627 -0.1548 0.0064 502 GLU A OE1
|
|
2122 O OE2 . GLU A 300 ? 1.3624 1.1119 1.0826 -0.1676 -0.1829 -0.0396 502 GLU A OE2
|
|
2123 N N . ASN A 301 ? 1.4229 1.1701 1.0309 -0.1480 -0.1715 0.0946 503 ASN A N
|
|
2124 C CA . ASN A 301 ? 1.4184 1.1714 1.0780 -0.1575 -0.1669 0.1283 503 ASN A CA
|
|
2125 C C . ASN A 301 ? 1.5188 1.2656 1.1639 -0.1544 -0.1774 0.1670 503 ASN A C
|
|
2126 O O . ASN A 301 ? 1.5105 1.2561 1.2110 -0.1639 -0.1805 0.1926 503 ASN A O
|
|
2127 C CB . ASN A 301 ? 1.4158 1.1896 1.0905 -0.1603 -0.1357 0.1411 503 ASN A CB
|
|
2128 C CG . ASN A 301 ? 1.6570 1.4384 1.3648 -0.1657 -0.1289 0.1083 503 ASN A CG
|
|
2129 O OD1 . ASN A 301 ? 1.5010 1.2757 1.2511 -0.1734 -0.1459 0.0843 503 ASN A OD1
|
|
2130 N ND2 . ASN A 301 ? 1.6033 1.4014 1.2938 -0.1611 -0.1033 0.1078 503 ASN A ND2
|
|
2131 N N . GLU A 302 ? 1.5251 1.2681 1.0986 -0.1410 -0.1844 0.1709 504 GLU A N
|
|
2132 C CA . GLU A 302 ? 1.5780 1.3173 1.1254 -0.1351 -0.1963 0.2083 504 GLU A CA
|
|
2133 C C . GLU A 302 ? 1.6255 1.3475 1.2292 -0.1430 -0.2265 0.2135 504 GLU A C
|
|
2134 O O . GLU A 302 ? 1.6511 1.3708 1.2690 -0.1439 -0.2319 0.2542 504 GLU A O
|
|
2135 C CB . GLU A 302 ? 1.6434 1.3830 1.1029 -0.1182 -0.2036 0.1992 504 GLU A CB
|
|
2136 N N . SER A 303 ? 1.5462 1.2572 1.1850 -0.1486 -0.2448 0.1735 505 SER A N
|
|
2137 C CA . SER A 303 ? 1.5217 1.2178 1.2199 -0.1556 -0.2729 0.1679 505 SER A CA
|
|
2138 C C . SER A 303 ? 1.5155 1.2123 1.2967 -0.1693 -0.2669 0.1850 505 SER A C
|
|
2139 O O . SER A 303 ? 1.5267 1.2136 1.3458 -0.1721 -0.2820 0.2120 505 SER A O
|
|
2140 C CB . SER A 303 ? 1.5319 1.2218 1.2408 -0.1572 -0.2878 0.1181 505 SER A CB
|
|
2141 N N . THR A 304 ? 1.4044 1.1130 1.2156 -0.1772 -0.2463 0.1684 506 THR A N
|
|
2142 C CA . THR A 304 ? 1.3563 1.0692 1.2467 -0.1904 -0.2395 0.1758 506 THR A CA
|
|
2143 C C . THR A 304 ? 1.4097 1.1277 1.3146 -0.1934 -0.2241 0.2267 506 THR A C
|
|
2144 O O . THR A 304 ? 1.3966 1.1119 1.3757 -0.2044 -0.2268 0.2395 506 THR A O
|
|
2145 C CB . THR A 304 ? 1.3781 1.1066 1.2824 -0.1953 -0.2217 0.1439 506 THR A CB
|
|
2146 N N . ALA A 305 ? 1.3789 1.1055 1.2148 -0.1836 -0.2075 0.2545 507 ALA A N
|
|
2147 C CA . ALA A 305 ? 1.4012 1.1381 1.2340 -0.1841 -0.1869 0.3058 507 ALA A CA
|
|
2148 C C . ALA A 305 ? 1.4411 1.1664 1.3345 -0.1918 -0.1985 0.3470 507 ALA A C
|
|
2149 O O . ALA A 305 ? 1.4726 1.1841 1.3496 -0.1856 -0.2194 0.3657 507 ALA A O
|
|
2150 C CB . ALA A 305 ? 1.4654 1.2117 1.2026 -0.1685 -0.1752 0.3234 507 ALA A CB
|
|
2151 N N . LEU A 306 ? 1.3550 1.0865 1.3217 -0.2052 -0.1852 0.3612 508 LEU A N
|
|
2152 C CA . LEU A 306 ? 1.3607 1.0818 1.3990 -0.2148 -0.1917 0.4023 508 LEU A CA
|
|
2153 C C . LEU A 306 ? 1.4165 1.1541 1.4305 -0.2134 -0.1628 0.4588 508 LEU A C
|
|
2154 O O . LEU A 306 ? 1.4047 1.1646 1.3804 -0.2105 -0.1354 0.4546 508 LEU A O
|
|
2155 C CB . LEU A 306 ? 1.4302 1.1484 1.5704 -0.2308 -0.1966 0.3788 508 LEU A CB
|
|
2156 C CG . LEU A 306 ? 1.3658 1.0674 1.5382 -0.2317 -0.2270 0.3320 508 LEU A CG
|
|
2157 N N . PRO A 307 ? 1.3998 1.1285 1.4336 -0.2144 -0.1672 0.5130 509 PRO A N
|
|
2158 C CA . PRO A 307 ? 1.4378 1.1859 1.4457 -0.2126 -0.1371 0.5703 509 PRO A CA
|
|
2159 C C . PRO A 307 ? 1.4444 1.2129 1.5052 -0.2254 -0.1069 0.5771 509 PRO A C
|
|
2160 O O . PRO A 307 ? 1.3868 1.1491 1.5350 -0.2399 -0.1136 0.5547 509 PRO A O
|
|
2161 C CB . PRO A 307 ? 1.5087 1.2397 1.5501 -0.2141 -0.1521 0.6243 509 PRO A CB
|
|
2162 C CG . PRO A 307 ? 1.5319 1.2354 1.6489 -0.2219 -0.1858 0.5939 509 PRO A CG
|
|
2163 C CD . PRO A 307 ? 1.4311 1.1333 1.5116 -0.2162 -0.1989 0.5271 509 PRO A CD
|
|
2164 N N . GLN A 308 ? 1.4205 1.2160 1.4254 -0.2187 -0.0739 0.6033 510 GLN A N
|
|
2165 C CA . GLN A 308 ? 1.3912 1.2115 1.4372 -0.2286 -0.0424 0.6103 510 GLN A CA
|
|
2166 C C . GLN A 308 ? 1.4511 1.2767 1.5648 -0.2409 -0.0268 0.6722 510 GLN A C
|
|
2167 O O . GLN A 308 ? 1.4963 1.3147 1.5928 -0.2366 -0.0300 0.7220 510 GLN A O
|
|
2168 C CB . GLN A 308 ? 1.4174 1.2663 1.3762 -0.2150 -0.0133 0.5991 510 GLN A CB
|
|
2169 C CG . GLN A 308 ? 1.5064 1.3532 1.4334 -0.2091 -0.0227 0.5319 510 GLN A CG
|
|
2170 C CD . GLN A 308 ? 1.5629 1.4121 1.5721 -0.2238 -0.0245 0.4965 510 GLN A CD
|
|
2171 O OE1 . GLN A 308 ? 1.4574 1.3209 1.5360 -0.2366 -0.0079 0.5175 510 GLN A OE1
|
|
2172 N NE2 . GLN A 308 ? 1.3793 1.2166 1.3821 -0.2219 -0.0449 0.4419 510 GLN A NE2
|
|
2173 N N . VAL A 309 ? 1.3670 1.2065 1.5600 -0.2562 -0.0104 0.6698 511 VAL A N
|
|
2174 C CA . VAL A 309 ? 1.3888 1.2342 1.6666 -0.2717 0.0050 0.7232 511 VAL A CA
|
|
2175 C C . VAL A 309 ? 1.5171 1.3921 1.7450 -0.2650 0.0431 0.7828 511 VAL A C
|
|
2176 O O . VAL A 309 ? 1.5740 1.4441 1.8190 -0.2676 0.0468 0.8434 511 VAL A O
|
|
2177 C CB . VAL A 309 ? 1.3745 1.2258 1.7583 -0.2905 0.0062 0.6952 511 VAL A CB
|
|
2178 C CG1 . VAL A 309 ? 1.3793 1.2170 1.8763 -0.3091 0.0008 0.7364 511 VAL A CG1
|
|
2179 C CG2 . VAL A 309 ? 1.3111 1.1471 1.7050 -0.2904 -0.0229 0.6227 511 VAL A CG2
|
|
2180 N N . LEU A 310 ? 1.4621 1.3685 1.6286 -0.2555 0.0715 0.7664 512 LEU A N
|
|
2181 C CA . LEU A 310 ? 1.8317 1.7729 1.9440 -0.2468 0.1116 0.8141 512 LEU A CA
|
|
2182 C C . LEU A 310 ? 2.0252 1.9816 2.2261 -0.2639 0.1358 0.8744 512 LEU A C
|
|
2183 O O . LEU A 310 ? 1.6014 1.5938 1.7868 -0.2616 0.1742 0.9039 512 LEU A O
|
|
2184 C CB . LEU A 310 ? 1.8979 1.8376 1.9008 -0.2266 0.1094 0.8405 512 LEU A CB
|
|
#
|
|
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 GLY 1 203 ? ? ? A . n
|
|
A 1 2 PRO 2 204 ? ? ? A . n
|
|
A 1 3 LEU 3 205 ? ? ? A . n
|
|
A 1 4 GLY 4 206 ? ? ? A . n
|
|
A 1 5 SER 5 207 ? ? ? A . n
|
|
A 1 6 HIS 6 208 ? ? ? A . n
|
|
A 1 7 MET 7 209 209 MET MET A . n
|
|
A 1 8 SER 8 210 210 SER SER A . n
|
|
A 1 9 VAL 9 211 211 VAL VAL A . n
|
|
A 1 10 TYR 10 212 212 TYR TYR A . n
|
|
A 1 11 PRO 11 213 213 PRO PRO A . n
|
|
A 1 12 LYS 12 214 214 LYS LYS A . n
|
|
A 1 13 ALA 13 215 215 ALA ALA A . n
|
|
A 1 14 LEU 14 216 216 LEU LEU A . n
|
|
A 1 15 ARG 15 217 217 ARG ARG A . n
|
|
A 1 16 ASP 16 218 218 ASP ASP A . n
|
|
A 1 17 GLU 17 219 219 GLU GLU A . n
|
|
A 1 18 TYR 18 220 220 TYR TYR A . n
|
|
A 1 19 ILE 19 221 221 ILE ILE A . n
|
|
A 1 20 MET 20 222 222 MET MET A . n
|
|
A 1 21 SER 21 223 223 SER SER A . n
|
|
A 1 22 LYS 22 224 224 LYS LYS A . n
|
|
A 1 23 THR 23 225 225 THR THR A . n
|
|
A 1 24 LEU 24 226 226 LEU LEU A . n
|
|
A 1 25 GLY 25 227 227 GLY GLY A . n
|
|
A 1 26 SER 26 228 ? ? ? A . n
|
|
A 1 27 GLY 27 229 ? ? ? A . n
|
|
A 1 28 ALA 28 230 ? ? ? A . n
|
|
A 1 29 CYS 29 231 ? ? ? A . n
|
|
A 1 30 GLY 30 232 232 GLY GLY A . n
|
|
A 1 31 GLU 31 233 233 GLU GLU A . n
|
|
A 1 32 VAL 32 234 234 VAL VAL A . n
|
|
A 1 33 LYS 33 235 235 LYS LYS A . n
|
|
A 1 34 LEU 34 236 236 LEU LEU A . n
|
|
A 1 35 ALA 35 237 237 ALA ALA A . n
|
|
A 1 36 PHE 36 238 238 PHE PHE A . n
|
|
A 1 37 GLU 37 239 239 GLU GLU A . n
|
|
A 1 38 ARG 38 240 240 ARG ARG A . n
|
|
A 1 39 LYS 39 241 241 LYS LYS A . n
|
|
A 1 40 THR 40 242 242 THR THR A . n
|
|
A 1 41 CYS 41 243 243 CYS CYS A . n
|
|
A 1 42 LYS 42 244 244 LYS LYS A . n
|
|
A 1 43 LYS 43 245 245 LYS LYS A . n
|
|
A 1 44 VAL 44 246 246 VAL VAL A . n
|
|
A 1 45 ALA 45 247 247 ALA ALA A . n
|
|
A 1 46 ILE 46 248 248 ILE ILE A . n
|
|
A 1 47 LYS 47 249 249 LYS LYS A . n
|
|
A 1 48 ILE 48 250 250 ILE ILE A . n
|
|
A 1 49 ILE 49 251 251 ILE ILE A . n
|
|
A 1 50 SER 50 252 252 SER SER A . n
|
|
A 1 51 LYS 51 253 253 LYS LYS A . n
|
|
A 1 52 ARG 52 254 ? ? ? A . n
|
|
A 1 53 LYS 53 255 ? ? ? A . n
|
|
A 1 54 PHE 54 256 ? ? ? A . n
|
|
A 1 55 ALA 55 257 ? ? ? A . n
|
|
A 1 56 ILE 56 258 ? ? ? A . n
|
|
A 1 57 GLY 57 259 ? ? ? A . n
|
|
A 1 58 SER 58 260 ? ? ? A . n
|
|
A 1 59 ALA 59 261 ? ? ? A . n
|
|
A 1 60 ARG 60 262 ? ? ? A . n
|
|
A 1 61 GLU 61 263 ? ? ? A . n
|
|
A 1 62 ALA 62 264 ? ? ? A . n
|
|
A 1 63 ASP 63 265 ? ? ? A . n
|
|
A 1 64 PRO 64 266 ? ? ? A . n
|
|
A 1 65 ALA 65 267 ? ? ? A . n
|
|
A 1 66 LEU 66 268 ? ? ? A . n
|
|
A 1 67 ASN 67 269 269 ASN ASN A . n
|
|
A 1 68 VAL 68 270 270 VAL VAL A . n
|
|
A 1 69 GLU 69 271 271 GLU GLU A . n
|
|
A 1 70 THR 70 272 272 THR THR A . n
|
|
A 1 71 GLU 71 273 273 GLU GLU A . n
|
|
A 1 72 ILE 72 274 274 ILE ILE A . n
|
|
A 1 73 GLU 73 275 275 GLU GLU A . n
|
|
A 1 74 ILE 74 276 276 ILE ILE A . n
|
|
A 1 75 LEU 75 277 277 LEU LEU A . n
|
|
A 1 76 LYS 76 278 278 LYS LYS A . n
|
|
A 1 77 LYS 77 279 279 LYS LYS A . n
|
|
A 1 78 LEU 78 280 280 LEU LEU A . n
|
|
A 1 79 ASN 79 281 281 ASN ASN A . n
|
|
A 1 80 HIS 80 282 282 HIS HIS A . n
|
|
A 1 81 PRO 81 283 283 PRO PRO A . n
|
|
A 1 82 CYS 82 284 284 CYS CYS A . n
|
|
A 1 83 ILE 83 285 285 ILE ILE A . n
|
|
A 1 84 ILE 84 286 286 ILE ILE A . n
|
|
A 1 85 LYS 85 287 287 LYS LYS A . n
|
|
A 1 86 ILE 86 288 288 ILE ILE A . n
|
|
A 1 87 LYS 87 289 289 LYS LYS A . n
|
|
A 1 88 ASN 88 290 290 ASN ASN A . n
|
|
A 1 89 PHE 89 291 291 PHE PHE A . n
|
|
A 1 90 PHE 90 292 292 PHE PHE A . n
|
|
A 1 91 ASP 91 293 293 ASP ASP A . n
|
|
A 1 92 ALA 92 294 294 ALA ALA A . n
|
|
A 1 93 GLU 93 295 295 GLU GLU A . n
|
|
A 1 94 ASP 94 296 296 ASP ASP A . n
|
|
A 1 95 TYR 95 297 297 TYR TYR A . n
|
|
A 1 96 TYR 96 298 298 TYR TYR A . n
|
|
A 1 97 ILE 97 299 299 ILE ILE A . n
|
|
A 1 98 VAL 98 300 300 VAL VAL A . n
|
|
A 1 99 LEU 99 301 301 LEU LEU A . n
|
|
A 1 100 GLU 100 302 302 GLU GLU A . n
|
|
A 1 101 LEU 101 303 303 LEU LEU A . n
|
|
A 1 102 MET 102 304 304 MET MET A . n
|
|
A 1 103 GLU 103 305 305 GLU GLU A . n
|
|
A 1 104 GLY 104 306 306 GLY GLY A . n
|
|
A 1 105 GLY 105 307 307 GLY GLY A . n
|
|
A 1 106 GLU 106 308 308 GLU GLU A . n
|
|
A 1 107 LEU 107 309 309 LEU LEU A . n
|
|
A 1 108 PHE 108 310 310 PHE PHE A . n
|
|
A 1 109 ASP 109 311 311 ASP ASP A . n
|
|
A 1 110 LYS 110 312 312 LYS LYS A . n
|
|
A 1 111 VAL 111 313 313 VAL VAL A . n
|
|
A 1 112 VAL 112 314 314 VAL VAL A . n
|
|
A 1 113 GLY 113 315 315 GLY GLY A . n
|
|
A 1 114 ASN 114 316 316 ASN ASN A . n
|
|
A 1 115 LYS 115 317 317 LYS LYS A . n
|
|
A 1 116 ARG 116 318 318 ARG ARG A . n
|
|
A 1 117 LEU 117 319 319 LEU LEU A . n
|
|
A 1 118 LYS 118 320 320 LYS LYS A . n
|
|
A 1 119 GLU 119 321 321 GLU GLU A . n
|
|
A 1 120 ALA 120 322 322 ALA ALA A . n
|
|
A 1 121 THR 121 323 323 THR THR A . n
|
|
A 1 122 CYS 122 324 324 CYS CYS A . n
|
|
A 1 123 LYS 123 325 325 LYS LYS A . n
|
|
A 1 124 LEU 124 326 326 LEU LEU A . n
|
|
A 1 125 TYR 125 327 327 TYR TYR A . n
|
|
A 1 126 PHE 126 328 328 PHE PHE A . n
|
|
A 1 127 TYR 127 329 329 TYR TYR A . n
|
|
A 1 128 GLN 128 330 330 GLN GLN A . n
|
|
A 1 129 MET 129 331 331 MET MET A . n
|
|
A 1 130 LEU 130 332 332 LEU LEU A . n
|
|
A 1 131 LEU 131 333 333 LEU LEU A . n
|
|
A 1 132 ALA 132 334 334 ALA ALA A . n
|
|
A 1 133 VAL 133 335 335 VAL VAL A . n
|
|
A 1 134 GLN 134 336 336 GLN GLN A . n
|
|
A 1 135 TYR 135 337 337 TYR TYR A . n
|
|
A 1 136 LEU 136 338 338 LEU LEU A . n
|
|
A 1 137 HIS 137 339 339 HIS HIS A . n
|
|
A 1 138 GLU 138 340 340 GLU GLU A . n
|
|
A 1 139 ASN 139 341 341 ASN ASN A . n
|
|
A 1 140 GLY 140 342 342 GLY GLY A . n
|
|
A 1 141 ILE 141 343 343 ILE ILE A . n
|
|
A 1 142 ILE 142 344 344 ILE ILE A . n
|
|
A 1 143 HIS 143 345 345 HIS HIS A . n
|
|
A 1 144 ARG 144 346 346 ARG ARG A . n
|
|
A 1 145 ASP 145 347 347 ASP ASP A . n
|
|
A 1 146 LEU 146 348 348 LEU LEU A . n
|
|
A 1 147 LYS 147 349 349 LYS LYS A . n
|
|
A 1 148 PRO 148 350 350 PRO PRO A . n
|
|
A 1 149 GLU 149 351 351 GLU GLU A . n
|
|
A 1 150 ASN 150 352 352 ASN ASN A . n
|
|
A 1 151 VAL 151 353 353 VAL VAL A . n
|
|
A 1 152 LEU 152 354 354 LEU LEU A . n
|
|
A 1 153 LEU 153 355 355 LEU LEU A . n
|
|
A 1 154 SER 154 356 356 SER SER A . n
|
|
A 1 155 SER 155 357 357 SER SER A . n
|
|
A 1 156 GLN 156 358 358 GLN GLN A . n
|
|
A 1 157 GLU 157 359 359 GLU GLU A . n
|
|
A 1 158 GLU 158 360 360 GLU GLU A . n
|
|
A 1 159 ASP 159 361 361 ASP ASP A . n
|
|
A 1 160 CYS 160 362 362 CYS CYS A . n
|
|
A 1 161 LEU 161 363 363 LEU LEU A . n
|
|
A 1 162 ILE 162 364 364 ILE ILE A . n
|
|
A 1 163 LYS 163 365 365 LYS LYS A . n
|
|
A 1 164 ILE 164 366 366 ILE ILE A . n
|
|
A 1 165 THR 165 367 367 THR THR A . n
|
|
A 1 166 ASP 166 368 368 ASP ASP A . n
|
|
A 1 167 PHE 167 369 369 PHE PHE A . n
|
|
A 1 168 GLY 168 370 370 GLY GLY A . n
|
|
A 1 169 HIS 169 371 371 HIS HIS A . n
|
|
A 1 170 SER 170 372 372 SER SER A . n
|
|
A 1 171 LYS 171 373 373 LYS LYS A . n
|
|
A 1 172 ILE 172 374 374 ILE ILE A . n
|
|
A 1 173 LEU 173 375 375 LEU LEU A . n
|
|
A 1 174 GLY 174 376 376 GLY GLY A . n
|
|
A 1 175 GLU 175 377 377 GLU GLU A . n
|
|
A 1 176 THR 176 378 378 THR THR A . n
|
|
A 1 177 SER 177 379 379 SER SER A . n
|
|
A 1 178 LEU 178 380 380 LEU LEU A . n
|
|
A 1 179 MET 179 381 381 MET MET A . n
|
|
A 1 180 ARG 180 382 382 ARG ARG A . n
|
|
A 1 181 THR 181 383 383 THR THR A . n
|
|
A 1 182 LEU 182 384 384 LEU LEU A . n
|
|
A 1 183 CYS 183 385 385 CYS CYS A . n
|
|
A 1 184 GLY 184 386 386 GLY GLY A . n
|
|
A 1 185 THR 185 387 387 THR THR A . n
|
|
A 1 186 PRO 186 388 388 PRO PRO A . n
|
|
A 1 187 THR 187 389 389 THR THR A . n
|
|
A 1 188 TYR 188 390 390 TYR TYR A . n
|
|
A 1 189 LEU 189 391 391 LEU LEU A . n
|
|
A 1 190 ALA 190 392 392 ALA ALA A . n
|
|
A 1 191 PRO 191 393 393 PRO PRO A . n
|
|
A 1 192 GLU 192 394 394 GLU GLU A . n
|
|
A 1 193 VAL 193 395 395 VAL VAL A . n
|
|
A 1 194 LEU 194 396 396 LEU LEU A . n
|
|
A 1 195 VAL 195 397 397 VAL VAL A . n
|
|
A 1 196 SER 196 398 398 SER SER A . n
|
|
A 1 197 VAL 197 399 399 VAL VAL A . n
|
|
A 1 198 GLY 198 400 400 GLY GLY A . n
|
|
A 1 199 THR 199 401 401 THR THR A . n
|
|
A 1 200 ALA 200 402 402 ALA ALA A . n
|
|
A 1 201 GLY 201 403 403 GLY GLY A . n
|
|
A 1 202 TYR 202 404 404 TYR TYR A . n
|
|
A 1 203 ASN 203 405 405 ASN ASN A . n
|
|
A 1 204 ARG 204 406 406 ARG ARG A . n
|
|
A 1 205 ALA 205 407 407 ALA ALA A . n
|
|
A 1 206 VAL 206 408 408 VAL VAL A . n
|
|
A 1 207 ASP 207 409 409 ASP ASP A . n
|
|
A 1 208 CYS 208 410 410 CYS CYS A . n
|
|
A 1 209 TRP 209 411 411 TRP TRP A . n
|
|
A 1 210 SER 210 412 412 SER SER A . n
|
|
A 1 211 LEU 211 413 413 LEU LEU A . n
|
|
A 1 212 GLY 212 414 414 GLY GLY A . n
|
|
A 1 213 VAL 213 415 415 VAL VAL A . n
|
|
A 1 214 ILE 214 416 416 ILE ILE A . n
|
|
A 1 215 LEU 215 417 417 LEU LEU A . n
|
|
A 1 216 PHE 216 418 418 PHE PHE A . n
|
|
A 1 217 ILE 217 419 419 ILE ILE A . n
|
|
A 1 218 CYS 218 420 420 CYS CYS A . n
|
|
A 1 219 LEU 219 421 421 LEU LEU A . n
|
|
A 1 220 SER 220 422 422 SER SER A . n
|
|
A 1 221 GLY 221 423 423 GLY GLY A . n
|
|
A 1 222 TYR 222 424 424 TYR TYR A . n
|
|
A 1 223 PRO 223 425 425 PRO PRO A . n
|
|
A 1 224 PRO 224 426 426 PRO PRO A . n
|
|
A 1 225 PHE 225 427 427 PHE PHE A . n
|
|
A 1 226 SER 226 428 428 SER SER A . n
|
|
A 1 227 GLU 227 429 429 GLU GLU A . n
|
|
A 1 228 HIS 228 430 430 HIS HIS A . n
|
|
A 1 229 ARG 229 431 431 ARG ARG A . n
|
|
A 1 230 THR 230 432 432 THR THR A . n
|
|
A 1 231 GLN 231 433 433 GLN GLN A . n
|
|
A 1 232 VAL 232 434 434 VAL VAL A . n
|
|
A 1 233 SER 233 435 435 SER SER A . n
|
|
A 1 234 LEU 234 436 436 LEU LEU A . n
|
|
A 1 235 LYS 235 437 437 LYS LYS A . n
|
|
A 1 236 ASP 236 438 438 ASP ASP A . n
|
|
A 1 237 GLN 237 439 439 GLN GLN A . n
|
|
A 1 238 ILE 238 440 440 ILE ILE A . n
|
|
A 1 239 THR 239 441 441 THR THR A . n
|
|
A 1 240 SER 240 442 442 SER SER A . n
|
|
A 1 241 GLY 241 443 443 GLY GLY A . n
|
|
A 1 242 LYS 242 444 444 LYS LYS A . n
|
|
A 1 243 TYR 243 445 445 TYR TYR A . n
|
|
A 1 244 ASN 244 446 446 ASN ASN A . n
|
|
A 1 245 PHE 245 447 447 PHE PHE A . n
|
|
A 1 246 ILE 246 448 448 ILE ILE A . n
|
|
A 1 247 PRO 247 449 449 PRO PRO A . n
|
|
A 1 248 GLU 248 450 450 GLU GLU A . n
|
|
A 1 249 VAL 249 451 451 VAL VAL A . n
|
|
A 1 250 TRP 250 452 452 TRP TRP A . n
|
|
A 1 251 ALA 251 453 453 ALA ALA A . n
|
|
A 1 252 GLU 252 454 454 GLU GLU A . n
|
|
A 1 253 VAL 253 455 455 VAL VAL A . n
|
|
A 1 254 SER 254 456 456 SER SER A . n
|
|
A 1 255 GLU 255 457 457 GLU GLU A . n
|
|
A 1 256 LYS 256 458 458 LYS LYS A . n
|
|
A 1 257 ALA 257 459 459 ALA ALA A . n
|
|
A 1 258 LEU 258 460 460 LEU LEU A . n
|
|
A 1 259 ASP 259 461 461 ASP ASP A . n
|
|
A 1 260 LEU 260 462 462 LEU LEU A . n
|
|
A 1 261 VAL 261 463 463 VAL VAL A . n
|
|
A 1 262 LYS 262 464 464 LYS LYS A . n
|
|
A 1 263 LYS 263 465 465 LYS LYS A . n
|
|
A 1 264 LEU 264 466 466 LEU LEU A . n
|
|
A 1 265 LEU 265 467 467 LEU LEU A . n
|
|
A 1 266 VAL 266 468 468 VAL VAL A . n
|
|
A 1 267 VAL 267 469 469 VAL VAL A . n
|
|
A 1 268 ASP 268 470 470 ASP ASP A . n
|
|
A 1 269 PRO 269 471 471 PRO PRO A . n
|
|
A 1 270 LYS 270 472 472 LYS LYS A . n
|
|
A 1 271 ALA 271 473 473 ALA ALA A . n
|
|
A 1 272 ARG 272 474 474 ARG ARG A . n
|
|
A 1 273 PHE 273 475 475 PHE PHE A . n
|
|
A 1 274 THR 274 476 476 THR THR A . n
|
|
A 1 275 THR 275 477 477 THR THR A . n
|
|
A 1 276 GLU 276 478 478 GLU GLU A . n
|
|
A 1 277 GLU 277 479 479 GLU GLU A . n
|
|
A 1 278 ALA 278 480 480 ALA ALA A . n
|
|
A 1 279 LEU 279 481 481 LEU LEU A . n
|
|
A 1 280 ARG 280 482 482 ARG ARG A . n
|
|
A 1 281 HIS 281 483 483 HIS HIS A . n
|
|
A 1 282 PRO 282 484 484 PRO PRO A . n
|
|
A 1 283 TRP 283 485 485 TRP TRP A . n
|
|
A 1 284 LEU 284 486 486 LEU LEU A . n
|
|
A 1 285 GLN 285 487 487 GLN GLN A . n
|
|
A 1 286 ASP 286 488 488 ASP ASP A . n
|
|
A 1 287 GLU 287 489 489 GLU GLU A . n
|
|
A 1 288 ASP 288 490 490 ASP ASP A . n
|
|
A 1 289 MET 289 491 491 MET MET A . n
|
|
A 1 290 LYS 290 492 492 LYS LYS A . n
|
|
A 1 291 ARG 291 493 493 ARG ARG A . n
|
|
A 1 292 LYS 292 494 494 LYS LYS A . n
|
|
A 1 293 PHE 293 495 495 PHE PHE A . n
|
|
A 1 294 GLN 294 496 496 GLN GLN A . n
|
|
A 1 295 ASP 295 497 497 ASP ASP A . n
|
|
A 1 296 LEU 296 498 498 LEU LEU A . n
|
|
A 1 297 LEU 297 499 499 LEU LEU A . n
|
|
A 1 298 SER 298 500 500 SER SER A . n
|
|
A 1 299 GLU 299 501 501 GLU GLU A . n
|
|
A 1 300 GLU 300 502 502 GLU GLU A . n
|
|
A 1 301 ASN 301 503 503 ASN ASN A . n
|
|
A 1 302 GLU 302 504 504 GLU GLU A . n
|
|
A 1 303 SER 303 505 505 SER SER A . n
|
|
A 1 304 THR 304 506 506 THR THR A . n
|
|
A 1 305 ALA 305 507 507 ALA ALA A . n
|
|
A 1 306 LEU 306 508 508 LEU LEU A . n
|
|
A 1 307 PRO 307 509 509 PRO PRO A . n
|
|
A 1 308 GLN 308 510 510 GLN GLN A . n
|
|
A 1 309 VAL 309 511 511 VAL VAL A . n
|
|
A 1 310 LEU 310 512 512 LEU LEU A . n
|
|
A 1 311 ALA 311 513 ? ? ? A . n
|
|
A 1 312 GLN 312 514 ? ? ? A . n
|
|
A 1 313 PRO 313 515 ? ? ? A . n
|
|
A 1 314 SER 314 516 ? ? ? A . n
|
|
A 1 315 THR 315 517 ? ? ? A . n
|
|
A 1 316 SER 316 518 ? ? ? A . n
|
|
A 1 317 ARG 317 519 ? ? ? A . n
|
|
A 1 318 LYS 318 520 ? ? ? A . n
|
|
A 1 319 ARG 319 521 ? ? ? A . n
|
|
A 1 320 PRO 320 522 ? ? ? A . n
|
|
A 1 321 ARG 321 523 ? ? ? A . n
|
|
A 1 322 GLU 322 524 ? ? ? A . n
|
|
A 1 323 GLY 323 525 ? ? ? A . n
|
|
A 1 324 GLU 324 526 ? ? ? A . n
|
|
A 1 325 ALA 325 527 ? ? ? A . n
|
|
A 1 326 GLU 326 528 ? ? ? A . n
|
|
A 1 327 GLY 327 529 ? ? ? A . n
|
|
A 1 328 ALA 328 530 ? ? ? A . n
|
|
A 1 329 GLU 329 531 ? ? ? A . n
|
|
#
|
|
loop_
|
|
_pdbx_nonpoly_scheme.asym_id
|
|
_pdbx_nonpoly_scheme.entity_id
|
|
_pdbx_nonpoly_scheme.mon_id
|
|
_pdbx_nonpoly_scheme.ndb_seq_num
|
|
_pdbx_nonpoly_scheme.pdb_seq_num
|
|
_pdbx_nonpoly_scheme.auth_seq_num
|
|
_pdbx_nonpoly_scheme.pdb_mon_id
|
|
_pdbx_nonpoly_scheme.auth_mon_id
|
|
_pdbx_nonpoly_scheme.pdb_strand_id
|
|
_pdbx_nonpoly_scheme.pdb_ins_code
|
|
B 2 H3R 1 1513 1513 H3R H3R A .
|
|
C 3 NO3 1 1514 1514 NO3 NO3 A .
|
|
D 4 EDO 1 1515 1515 EDO EDO A .
|
|
E 4 EDO 1 1516 1516 EDO EDO A .
|
|
F 5 HOH 1 2001 2001 HOH HOH A .
|
|
F 5 HOH 2 2002 2002 HOH HOH A .
|
|
F 5 HOH 3 2003 2003 HOH HOH A .
|
|
F 5 HOH 4 2004 2004 HOH HOH A .
|
|
F 5 HOH 5 2005 2005 HOH HOH A .
|
|
F 5 HOH 6 2006 2006 HOH HOH A .
|
|
F 5 HOH 7 2007 2007 HOH HOH A .
|
|
F 5 HOH 8 2008 2008 HOH HOH A .
|
|
F 5 HOH 9 2009 2009 HOH HOH A .
|
|
F 5 HOH 10 2010 2010 HOH HOH A .
|
|
F 5 HOH 11 2011 2011 HOH HOH A .
|
|
F 5 HOH 12 2012 2012 HOH HOH A .
|
|
F 5 HOH 13 2013 2013 HOH HOH A .
|
|
F 5 HOH 14 2014 2014 HOH HOH A .
|
|
F 5 HOH 15 2015 2015 HOH HOH A .
|
|
F 5 HOH 16 2016 2016 HOH HOH A .
|
|
F 5 HOH 17 2017 2017 HOH HOH A .
|
|
F 5 HOH 18 2018 2018 HOH HOH A .
|
|
F 5 HOH 19 2019 2019 HOH HOH A .
|
|
F 5 HOH 20 2020 2020 HOH HOH A .
|
|
F 5 HOH 21 2021 2021 HOH HOH A .
|
|
F 5 HOH 22 2022 2022 HOH HOH A .
|
|
F 5 HOH 23 2023 2023 HOH HOH A .
|
|
F 5 HOH 24 2024 2024 HOH HOH A .
|
|
F 5 HOH 25 2025 2025 HOH HOH A .
|
|
F 5 HOH 26 2026 2026 HOH HOH A .
|
|
F 5 HOH 27 2027 2027 HOH HOH A .
|
|
F 5 HOH 28 2028 2028 HOH HOH A .
|
|
F 5 HOH 29 2029 2029 HOH HOH A .
|
|
F 5 HOH 30 2030 2030 HOH HOH A .
|
|
F 5 HOH 31 2031 2031 HOH HOH A .
|
|
F 5 HOH 32 2032 2032 HOH HOH A .
|
|
F 5 HOH 33 2033 2033 HOH HOH A .
|
|
F 5 HOH 34 2034 2034 HOH HOH A .
|
|
F 5 HOH 35 2035 2035 HOH HOH A .
|
|
F 5 HOH 36 2036 2036 HOH HOH A .
|
|
F 5 HOH 37 2037 2037 HOH HOH A .
|
|
F 5 HOH 38 2038 2038 HOH HOH A .
|
|
F 5 HOH 39 2039 2039 HOH HOH A .
|
|
F 5 HOH 40 2040 2040 HOH HOH A .
|
|
F 5 HOH 41 2041 2041 HOH HOH A .
|
|
F 5 HOH 42 2042 2042 HOH HOH A .
|
|
F 5 HOH 43 2043 2043 HOH HOH A .
|
|
F 5 HOH 44 2044 2044 HOH HOH A .
|
|
F 5 HOH 45 2045 2045 HOH HOH A .
|
|
F 5 HOH 46 2046 2046 HOH HOH A .
|
|
F 5 HOH 47 2047 2047 HOH HOH A .
|
|
F 5 HOH 48 2048 2048 HOH HOH A .
|
|
F 5 HOH 49 2049 2049 HOH HOH A .
|
|
F 5 HOH 50 2050 2050 HOH HOH A .
|
|
#
|
|
_pdbx_struct_assembly.id 1
|
|
_pdbx_struct_assembly.details author_and_software_defined_assembly
|
|
_pdbx_struct_assembly.method_details PISA
|
|
_pdbx_struct_assembly.oligomeric_details dimeric
|
|
_pdbx_struct_assembly.oligomeric_count 2
|
|
#
|
|
_pdbx_struct_assembly_gen.assembly_id 1
|
|
_pdbx_struct_assembly_gen.oper_expression 1,2
|
|
_pdbx_struct_assembly_gen.asym_id_list A,B,C,D,E,F
|
|
#
|
|
loop_
|
|
_pdbx_struct_assembly_prop.biol_id
|
|
_pdbx_struct_assembly_prop.type
|
|
_pdbx_struct_assembly_prop.value
|
|
_pdbx_struct_assembly_prop.details
|
|
1 'ABSA (A^2)' 3470 ?
|
|
1 MORE -4.5 ?
|
|
1 'SSA (A^2)' 28750 ?
|
|
#
|
|
loop_
|
|
_pdbx_struct_oper_list.id
|
|
_pdbx_struct_oper_list.type
|
|
_pdbx_struct_oper_list.name
|
|
_pdbx_struct_oper_list.symmetry_operation
|
|
_pdbx_struct_oper_list.matrix[1][1]
|
|
_pdbx_struct_oper_list.matrix[1][2]
|
|
_pdbx_struct_oper_list.matrix[1][3]
|
|
_pdbx_struct_oper_list.vector[1]
|
|
_pdbx_struct_oper_list.matrix[2][1]
|
|
_pdbx_struct_oper_list.matrix[2][2]
|
|
_pdbx_struct_oper_list.matrix[2][3]
|
|
_pdbx_struct_oper_list.vector[2]
|
|
_pdbx_struct_oper_list.matrix[3][1]
|
|
_pdbx_struct_oper_list.matrix[3][2]
|
|
_pdbx_struct_oper_list.matrix[3][3]
|
|
_pdbx_struct_oper_list.vector[3]
|
|
1 'identity operation' 1_555 x,y,z 1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000
|
|
1.0000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 1.0000000000 0.0000000000
|
|
2 'crystal symmetry operation' 6_555 -x,-x+y,-z+2/3 -0.5000000000 -0.8660254038 0.0000000000 0.0000000000 -0.8660254038
|
|
0.5000000000 0.0000000000 0.0000000000 0.0000000000 0.0000000000 -1.0000000000 62.0200000000
|
|
#
|
|
_pdbx_audit_revision_history.ordinal 1
|
|
_pdbx_audit_revision_history.data_content_type 'Structure model'
|
|
_pdbx_audit_revision_history.major_revision 1
|
|
_pdbx_audit_revision_history.minor_revision 0
|
|
_pdbx_audit_revision_history.revision_date 2013-06-26
|
|
#
|
|
_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 ?
|
|
#
|
|
loop_
|
|
_pdbx_refine_tls.pdbx_refine_id
|
|
_pdbx_refine_tls.id
|
|
_pdbx_refine_tls.details
|
|
_pdbx_refine_tls.method
|
|
_pdbx_refine_tls.origin_x
|
|
_pdbx_refine_tls.origin_y
|
|
_pdbx_refine_tls.origin_z
|
|
_pdbx_refine_tls.T[1][1]
|
|
_pdbx_refine_tls.T[2][2]
|
|
_pdbx_refine_tls.T[3][3]
|
|
_pdbx_refine_tls.T[1][2]
|
|
_pdbx_refine_tls.T[1][3]
|
|
_pdbx_refine_tls.T[2][3]
|
|
_pdbx_refine_tls.L[1][1]
|
|
_pdbx_refine_tls.L[2][2]
|
|
_pdbx_refine_tls.L[3][3]
|
|
_pdbx_refine_tls.L[1][2]
|
|
_pdbx_refine_tls.L[1][3]
|
|
_pdbx_refine_tls.L[2][3]
|
|
_pdbx_refine_tls.S[1][1]
|
|
_pdbx_refine_tls.S[1][2]
|
|
_pdbx_refine_tls.S[1][3]
|
|
_pdbx_refine_tls.S[2][1]
|
|
_pdbx_refine_tls.S[2][2]
|
|
_pdbx_refine_tls.S[2][3]
|
|
_pdbx_refine_tls.S[3][1]
|
|
_pdbx_refine_tls.S[3][2]
|
|
_pdbx_refine_tls.S[3][3]
|
|
'X-RAY DIFFRACTION' 1 ? refined -39.4145 42.5794 12.2710 0.3123 0.2481 0.1396 0.0959 -0.0021 0.0523 7.0578 2.0348 0.0000 -3.9969
|
|
-1.1058 0.6698 -0.6104 -0.6790 -0.0752 0.5344 0.4034 0.0187 0.3152 -0.1791 0.2070
|
|
'X-RAY DIFFRACTION' 2 ? refined -26.9905 28.4498 6.1579 0.2235 0.1455 0.1377 0.0117 -0.0029 -0.0698 3.5893 2.5946 3.5405 -0.5877
|
|
0.4118 0.1940 -0.0309 0.2984 -0.1893 -0.5250 -0.1927 0.3460 -0.1088 -0.4004 0.2236
|
|
'X-RAY DIFFRACTION' 3 ? refined -16.5239 21.1278 22.4613 0.2384 0.2078 0.3976 0.0160 0.1380 0.0450 1.3365 0.8051 3.5981 -1.3899
|
|
0.7902 -0.2914 -0.2727 0.0536 -0.4006 -0.2414 0.2080 0.1111 0.2219 0.2050 0.0647
|
|
'X-RAY DIFFRACTION' 4 ? refined -17.1894 24.6354 0.7700 0.4814 0.2976 0.0613 -0.0266 0.0668 -0.1247 4.4934 2.4473 1.2535 -0.7257
|
|
0.3141 0.0747 0.0560 0.7136 -0.2760 -0.8886 -0.3035 -0.2523 0.3716 0.5392 0.2475
|
|
#
|
|
loop_
|
|
_pdbx_refine_tls_group.pdbx_refine_id
|
|
_pdbx_refine_tls_group.id
|
|
_pdbx_refine_tls_group.refine_tls_id
|
|
_pdbx_refine_tls_group.beg_auth_asym_id
|
|
_pdbx_refine_tls_group.beg_auth_seq_id
|
|
_pdbx_refine_tls_group.beg_label_asym_id
|
|
_pdbx_refine_tls_group.beg_label_seq_id
|
|
_pdbx_refine_tls_group.end_auth_asym_id
|
|
_pdbx_refine_tls_group.end_auth_seq_id
|
|
_pdbx_refine_tls_group.end_label_asym_id
|
|
_pdbx_refine_tls_group.end_label_seq_id
|
|
_pdbx_refine_tls_group.selection
|
|
_pdbx_refine_tls_group.selection_details
|
|
'X-RAY DIFFRACTION' 1 1 ? ? ? ? ? ? ? ? ? 'CHAIN A AND RESID 210-301'
|
|
'X-RAY DIFFRACTION' 2 2 ? ? ? ? ? ? ? ? ? 'CHAIN A AND RESID 302-375'
|
|
'X-RAY DIFFRACTION' 3 3 ? ? ? ? ? ? ? ? ? 'CHAIN A AND RESID 376-445'
|
|
'X-RAY DIFFRACTION' 4 4 ? ? ? ? ? ? ? ? ? 'CHAIN A AND RESID 446-512'
|
|
#
|
|
loop_
|
|
_software.name
|
|
_software.classification
|
|
_software.version
|
|
_software.citation_id
|
|
_software.pdbx_ordinal
|
|
BUSTER refinement 2.11.2 ? 1
|
|
MOSFLM 'data reduction' . ? 2
|
|
SCALA 'data scaling' . ? 3
|
|
PHASER phasing . ? 4
|
|
#
|
|
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 SER A 223 ? ? -126.03 -165.59
|
|
2 1 ASN A 281 ? ? -152.79 89.19
|
|
3 1 ALA A 294 ? ? -112.17 -148.25
|
|
4 1 ARG A 346 ? ? 71.21 -3.61
|
|
5 1 ASP A 347 ? ? -145.17 46.27
|
|
6 1 ASP A 368 ? ? 63.53 80.46
|
|
7 1 ALA A 402 ? ? -38.40 129.81
|
|
8 1 LEU A 467 ? ? -86.88 36.00
|
|
9 1 ALA A 507 ? ? -44.85 109.40
|
|
#
|
|
loop_
|
|
_pdbx_unobs_or_zero_occ_atoms.id
|
|
_pdbx_unobs_or_zero_occ_atoms.PDB_model_num
|
|
_pdbx_unobs_or_zero_occ_atoms.polymer_flag
|
|
_pdbx_unobs_or_zero_occ_atoms.occupancy_flag
|
|
_pdbx_unobs_or_zero_occ_atoms.auth_asym_id
|
|
_pdbx_unobs_or_zero_occ_atoms.auth_comp_id
|
|
_pdbx_unobs_or_zero_occ_atoms.auth_seq_id
|
|
_pdbx_unobs_or_zero_occ_atoms.PDB_ins_code
|
|
_pdbx_unobs_or_zero_occ_atoms.auth_atom_id
|
|
_pdbx_unobs_or_zero_occ_atoms.label_alt_id
|
|
_pdbx_unobs_or_zero_occ_atoms.label_asym_id
|
|
_pdbx_unobs_or_zero_occ_atoms.label_comp_id
|
|
_pdbx_unobs_or_zero_occ_atoms.label_seq_id
|
|
_pdbx_unobs_or_zero_occ_atoms.label_atom_id
|
|
1 1 Y 1 A MET 209 ? CG ? A MET 7 CG
|
|
2 1 Y 1 A MET 209 ? SD ? A MET 7 SD
|
|
3 1 Y 1 A MET 209 ? CE ? A MET 7 CE
|
|
4 1 Y 1 A LYS 224 ? CG ? A LYS 22 CG
|
|
5 1 Y 1 A LYS 224 ? CD ? A LYS 22 CD
|
|
6 1 Y 1 A LYS 224 ? CE ? A LYS 22 CE
|
|
7 1 Y 1 A LYS 224 ? NZ ? A LYS 22 NZ
|
|
8 1 Y 1 A GLU 233 ? CG ? A GLU 31 CG
|
|
9 1 Y 1 A GLU 233 ? CD ? A GLU 31 CD
|
|
10 1 Y 1 A GLU 233 ? OE1 ? A GLU 31 OE1
|
|
11 1 Y 1 A GLU 233 ? OE2 ? A GLU 31 OE2
|
|
12 1 Y 1 A LYS 235 ? CE ? A LYS 33 CE
|
|
13 1 Y 1 A LYS 235 ? NZ ? A LYS 33 NZ
|
|
14 1 Y 1 A LYS 241 ? CD ? A LYS 39 CD
|
|
15 1 Y 1 A LYS 241 ? CE ? A LYS 39 CE
|
|
16 1 Y 1 A LYS 241 ? NZ ? A LYS 39 NZ
|
|
17 1 Y 1 A LYS 245 ? CE ? A LYS 43 CE
|
|
18 1 Y 1 A LYS 245 ? NZ ? A LYS 43 NZ
|
|
19 1 Y 1 A LYS 249 ? CD ? A LYS 47 CD
|
|
20 1 Y 1 A LYS 249 ? CE ? A LYS 47 CE
|
|
21 1 Y 1 A LYS 249 ? NZ ? A LYS 47 NZ
|
|
22 1 Y 1 A SER 252 ? OG ? A SER 50 OG
|
|
23 1 Y 1 A GLU 271 ? CG ? A GLU 69 CG
|
|
24 1 Y 1 A GLU 271 ? CD ? A GLU 69 CD
|
|
25 1 Y 1 A GLU 271 ? OE1 ? A GLU 69 OE1
|
|
26 1 Y 1 A GLU 271 ? OE2 ? A GLU 69 OE2
|
|
27 1 Y 1 A THR 272 ? OG1 ? A THR 70 OG1
|
|
28 1 Y 1 A THR 272 ? CG2 ? A THR 70 CG2
|
|
29 1 Y 1 A GLU 275 ? CG ? A GLU 73 CG
|
|
30 1 Y 1 A GLU 275 ? CD ? A GLU 73 CD
|
|
31 1 Y 1 A GLU 275 ? OE1 ? A GLU 73 OE1
|
|
32 1 Y 1 A GLU 275 ? OE2 ? A GLU 73 OE2
|
|
33 1 Y 1 A ILE 276 ? CG1 ? A ILE 74 CG1
|
|
34 1 Y 1 A ILE 276 ? CG2 ? A ILE 74 CG2
|
|
35 1 Y 1 A ILE 276 ? CD1 ? A ILE 74 CD1
|
|
36 1 Y 1 A LYS 278 ? CD ? A LYS 76 CD
|
|
37 1 Y 1 A LYS 278 ? CE ? A LYS 76 CE
|
|
38 1 Y 1 A LYS 278 ? NZ ? A LYS 76 NZ
|
|
39 1 Y 1 A LYS 279 ? CG ? A LYS 77 CG
|
|
40 1 Y 1 A LYS 279 ? CD ? A LYS 77 CD
|
|
41 1 Y 1 A LYS 279 ? CE ? A LYS 77 CE
|
|
42 1 Y 1 A LYS 279 ? NZ ? A LYS 77 NZ
|
|
43 1 Y 1 A GLU 295 ? CG ? A GLU 93 CG
|
|
44 1 Y 1 A GLU 295 ? CD ? A GLU 93 CD
|
|
45 1 Y 1 A GLU 295 ? OE1 ? A GLU 93 OE1
|
|
46 1 Y 1 A GLU 295 ? OE2 ? A GLU 93 OE2
|
|
47 1 Y 1 A LYS 312 ? CE ? A LYS 110 CE
|
|
48 1 Y 1 A LYS 312 ? NZ ? A LYS 110 NZ
|
|
49 1 Y 1 A LYS 373 ? CG ? A LYS 171 CG
|
|
50 1 Y 1 A LYS 373 ? CD ? A LYS 171 CD
|
|
51 1 Y 1 A LYS 373 ? CE ? A LYS 171 CE
|
|
52 1 Y 1 A LYS 373 ? NZ ? A LYS 171 NZ
|
|
53 1 Y 1 A GLU 377 ? CG ? A GLU 175 CG
|
|
54 1 Y 1 A GLU 377 ? CD ? A GLU 175 CD
|
|
55 1 Y 1 A GLU 377 ? OE1 ? A GLU 175 OE1
|
|
56 1 Y 1 A GLU 377 ? OE2 ? A GLU 175 OE2
|
|
57 1 Y 1 A ARG 382 ? CG ? A ARG 180 CG
|
|
58 1 Y 1 A ARG 382 ? CD ? A ARG 180 CD
|
|
59 1 Y 1 A ARG 382 ? NE ? A ARG 180 NE
|
|
60 1 Y 1 A ARG 382 ? CZ ? A ARG 180 CZ
|
|
61 1 Y 1 A ARG 382 ? NH1 ? A ARG 180 NH1
|
|
62 1 Y 1 A ARG 382 ? NH2 ? A ARG 180 NH2
|
|
63 1 Y 1 A ARG 431 ? CG ? A ARG 229 CG
|
|
64 1 Y 1 A ARG 431 ? CD ? A ARG 229 CD
|
|
65 1 Y 1 A ARG 431 ? NE ? A ARG 229 NE
|
|
66 1 Y 1 A ARG 431 ? CZ ? A ARG 229 CZ
|
|
67 1 Y 1 A ARG 431 ? NH1 ? A ARG 229 NH1
|
|
68 1 Y 1 A ARG 431 ? NH2 ? A ARG 229 NH2
|
|
69 1 Y 1 A THR 432 ? OG1 ? A THR 230 OG1
|
|
70 1 Y 1 A THR 432 ? CG2 ? A THR 230 CG2
|
|
71 1 Y 1 A GLN 433 ? CG ? A GLN 231 CG
|
|
72 1 Y 1 A GLN 433 ? CD ? A GLN 231 CD
|
|
73 1 Y 1 A GLN 433 ? OE1 ? A GLN 231 OE1
|
|
74 1 Y 1 A GLN 433 ? NE2 ? A GLN 231 NE2
|
|
75 1 Y 1 A LYS 444 ? CG ? A LYS 242 CG
|
|
76 1 Y 1 A LYS 444 ? CD ? A LYS 242 CD
|
|
77 1 Y 1 A LYS 444 ? CE ? A LYS 242 CE
|
|
78 1 Y 1 A LYS 444 ? NZ ? A LYS 242 NZ
|
|
79 1 Y 1 A GLU 454 ? CD ? A GLU 252 CD
|
|
80 1 Y 1 A GLU 454 ? OE1 ? A GLU 252 OE1
|
|
81 1 Y 1 A GLU 454 ? OE2 ? A GLU 252 OE2
|
|
82 1 Y 1 A GLU 457 ? CG ? A GLU 255 CG
|
|
83 1 Y 1 A GLU 457 ? CD ? A GLU 255 CD
|
|
84 1 Y 1 A GLU 457 ? OE1 ? A GLU 255 OE1
|
|
85 1 Y 1 A GLU 457 ? OE2 ? A GLU 255 OE2
|
|
86 1 Y 1 A LYS 494 ? CD ? A LYS 292 CD
|
|
87 1 Y 1 A LYS 494 ? CE ? A LYS 292 CE
|
|
88 1 Y 1 A LYS 494 ? NZ ? A LYS 292 NZ
|
|
89 1 Y 1 A GLU 501 ? CG ? A GLU 299 CG
|
|
90 1 Y 1 A GLU 501 ? CD ? A GLU 299 CD
|
|
91 1 Y 1 A GLU 501 ? OE1 ? A GLU 299 OE1
|
|
92 1 Y 1 A GLU 501 ? OE2 ? A GLU 299 OE2
|
|
93 1 Y 1 A GLU 504 ? CG ? A GLU 302 CG
|
|
94 1 Y 1 A GLU 504 ? CD ? A GLU 302 CD
|
|
95 1 Y 1 A GLU 504 ? OE1 ? A GLU 302 OE1
|
|
96 1 Y 1 A GLU 504 ? OE2 ? A GLU 302 OE2
|
|
97 1 Y 1 A SER 505 ? OG ? A SER 303 OG
|
|
98 1 Y 1 A THR 506 ? OG1 ? A THR 304 OG1
|
|
99 1 Y 1 A THR 506 ? CG2 ? A THR 304 CG2
|
|
100 1 Y 1 A LEU 508 ? CD1 ? A LEU 306 CD1
|
|
101 1 Y 1 A LEU 508 ? CD2 ? A LEU 306 CD2
|
|
102 1 Y 1 A LEU 512 ? CG ? A LEU 310 CG
|
|
103 1 Y 1 A LEU 512 ? CD1 ? A LEU 310 CD1
|
|
104 1 Y 1 A LEU 512 ? CD2 ? A LEU 310 CD2
|
|
#
|
|
loop_
|
|
_pdbx_unobs_or_zero_occ_residues.id
|
|
_pdbx_unobs_or_zero_occ_residues.PDB_model_num
|
|
_pdbx_unobs_or_zero_occ_residues.polymer_flag
|
|
_pdbx_unobs_or_zero_occ_residues.occupancy_flag
|
|
_pdbx_unobs_or_zero_occ_residues.auth_asym_id
|
|
_pdbx_unobs_or_zero_occ_residues.auth_comp_id
|
|
_pdbx_unobs_or_zero_occ_residues.auth_seq_id
|
|
_pdbx_unobs_or_zero_occ_residues.PDB_ins_code
|
|
_pdbx_unobs_or_zero_occ_residues.label_asym_id
|
|
_pdbx_unobs_or_zero_occ_residues.label_comp_id
|
|
_pdbx_unobs_or_zero_occ_residues.label_seq_id
|
|
1 1 Y 1 A GLY 203 ? A GLY 1
|
|
2 1 Y 1 A PRO 204 ? A PRO 2
|
|
3 1 Y 1 A LEU 205 ? A LEU 3
|
|
4 1 Y 1 A GLY 206 ? A GLY 4
|
|
5 1 Y 1 A SER 207 ? A SER 5
|
|
6 1 Y 1 A HIS 208 ? A HIS 6
|
|
7 1 Y 1 A SER 228 ? A SER 26
|
|
8 1 Y 1 A GLY 229 ? A GLY 27
|
|
9 1 Y 1 A ALA 230 ? A ALA 28
|
|
10 1 Y 1 A CYS 231 ? A CYS 29
|
|
11 1 Y 1 A ARG 254 ? A ARG 52
|
|
12 1 Y 1 A LYS 255 ? A LYS 53
|
|
13 1 Y 1 A PHE 256 ? A PHE 54
|
|
14 1 Y 1 A ALA 257 ? A ALA 55
|
|
15 1 Y 1 A ILE 258 ? A ILE 56
|
|
16 1 Y 1 A GLY 259 ? A GLY 57
|
|
17 1 Y 1 A SER 260 ? A SER 58
|
|
18 1 Y 1 A ALA 261 ? A ALA 59
|
|
19 1 Y 1 A ARG 262 ? A ARG 60
|
|
20 1 Y 1 A GLU 263 ? A GLU 61
|
|
21 1 Y 1 A ALA 264 ? A ALA 62
|
|
22 1 Y 1 A ASP 265 ? A ASP 63
|
|
23 1 Y 1 A PRO 266 ? A PRO 64
|
|
24 1 Y 1 A ALA 267 ? A ALA 65
|
|
25 1 Y 1 A LEU 268 ? A LEU 66
|
|
26 1 Y 1 A ALA 513 ? A ALA 311
|
|
27 1 Y 1 A GLN 514 ? A GLN 312
|
|
28 1 Y 1 A PRO 515 ? A PRO 313
|
|
29 1 Y 1 A SER 516 ? A SER 314
|
|
30 1 Y 1 A THR 517 ? A THR 315
|
|
31 1 Y 1 A SER 518 ? A SER 316
|
|
32 1 Y 1 A ARG 519 ? A ARG 317
|
|
33 1 Y 1 A LYS 520 ? A LYS 318
|
|
34 1 Y 1 A ARG 521 ? A ARG 319
|
|
35 1 Y 1 A PRO 522 ? A PRO 320
|
|
36 1 Y 1 A ARG 523 ? A ARG 321
|
|
37 1 Y 1 A GLU 524 ? A GLU 322
|
|
38 1 Y 1 A GLY 525 ? A GLY 323
|
|
39 1 Y 1 A GLU 526 ? A GLU 324
|
|
40 1 Y 1 A ALA 527 ? A ALA 325
|
|
41 1 Y 1 A GLU 528 ? A GLU 326
|
|
42 1 Y 1 A GLY 529 ? A GLY 327
|
|
43 1 Y 1 A ALA 530 ? A ALA 328
|
|
44 1 Y 1 A GLU 531 ? A GLU 329
|
|
#
|
|
loop_
|
|
_pdbx_entity_nonpoly.entity_id
|
|
_pdbx_entity_nonpoly.name
|
|
_pdbx_entity_nonpoly.comp_id
|
|
2 5-METHYL-3-PHENYL-1H-PYRAZOLE H3R
|
|
3 'NITRATE ION' NO3
|
|
4 1,2-ETHANEDIOL EDO
|
|
5 water HOH
|
|
#
|