2328 lines
184 KiB
Plaintext
2328 lines
184 KiB
Plaintext
HEADER COMPLEX(SERINE PROTEINASE-INHIBITOR) 21-JAN-83 3SGB
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TITLE STRUCTURE OF THE COMPLEX OF STREPTOMYCES GRISEUS PROTEASE B
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TITLE 2 AND THE THIRD DOMAIN OF THE TURKEY OVOMUCOID INHIBITOR AT
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TITLE 3 1.8 ANGSTROMS RESOLUTION
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COMPND MOL_ID: 1;
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COMPND 2 MOLECULE: PROTEINASE B (SGPB);
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COMPND 3 CHAIN: E;
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COMPND 4 ENGINEERED: YES;
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COMPND 5 MOL_ID: 2;
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COMPND 6 MOLECULE: TURKEY OVOMUCOID INHIBITOR (OMTKY3);
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COMPND 7 CHAIN: I;
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COMPND 8 ENGINEERED: YES
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SOURCE MOL_ID: 1;
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SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES GRISEUS;
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SOURCE 3 ORGANISM_TAXID: 1911;
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SOURCE 4 ORGAN: PANCREATIC;
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SOURCE 5 MOL_ID: 2
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KEYWDS COMPLEX(SERINE PROTEINASE-INHIBITOR)
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EXPDTA X-RAY DIFFRACTION
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AUTHOR R.J.READ,M.FUJINAGA,A.R.SIELECKI,M.N.G.JAMES
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REVDAT 8 24-FEB-09 3SGB 1 VERSN
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REVDAT 7 01-APR-03 3SGB 1 JRNL
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REVDAT 6 15-JUL-90 3SGB 1 HEADER
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REVDAT 5 09-JAN-89 3SGB 3 REMARK FORMUL HETATM
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REVDAT 4 17-FEB-84 3SGB 1 JRNL
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REVDAT 3 27-OCT-83 3SGB 1 JRNL
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REVDAT 2 30-SEP-83 3SGB 1 REVDAT
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REVDAT 1 12-JUL-83 3SGB 0
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SPRSDE 12-JUL-83 3SGB 2SGB
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JRNL AUTH R.J.READ,M.FUJINAGA,A.R.SIELECKI,M.N.JAMES
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JRNL TITL STRUCTURE OF THE COMPLEX OF STREPTOMYCES GRISEUS
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JRNL TITL 2 PROTEASE B AND THE THIRD DOMAIN OF THE TURKEY
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JRNL TITL 3 OVOMUCOID INHIBITOR AT 1.8-A RESOLUTION.
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JRNL REF BIOCHEMISTRY V. 22 4420 1983
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JRNL REFN ISSN 0006-2960
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JRNL PMID 6414511
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JRNL DOI 10.1021/BI00288A012
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REMARK 1
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REMARK 1 REFERENCE 1
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REMARK 1 AUTH M.FUJINAGA,A.R.SIELECKI,R.J.READ,W.ARDELT,
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REMARK 1 AUTH 2 M.LASKOWSKIJUNIOR,M.N.G.JAMES
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REMARK 1 TITL CRYSTAL AND MOLECULAR STRUCTURES OF THE COMPLEX OF
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REMARK 1 TITL 2 ALPHA-CHYMOTRYPSIN WITH ITS INHIBITOR TURKEY
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REMARK 1 TITL 3 OVOMUCOID THIRD DOMAIN AT 1.8 ANGSTROMS RESOLUTION
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REMARK 1 REF J.MOL.BIOL. V. 195 397 1987
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REMARK 1 REFN ISSN 0022-2836
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REMARK 1 REFERENCE 2
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REMARK 1 AUTH M.FUJINAGA,R.J.READ,A.SIELECKI,W.ARDELT,
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REMARK 1 AUTH 2 M.LASKOWSKI JUNIOR,M.N.G.JAMES
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REMARK 1 TITL REFINED CRYSTAL STRUCTURE OF THE MOLECULAR COMPLEX
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REMARK 1 TITL 2 OF STREPTOMYCES GRISEUS PROTEASE B, A SERINE
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REMARK 1 TITL 3 PROTEASE, WITH THE THIRD DOMAIN OF THE OVOMUCOID
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REMARK 1 TITL 4 INHIBITOR FROM TURKEY
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REMARK 1 REF PROC.NATL.ACAD.SCI.USA V. 79 4868 1982
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REMARK 1 REFN ISSN 0027-8424
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REMARK 1 REFERENCE 3
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REMARK 1 AUTH M.N.G.JAMES,G.D.BRAYER,L.T.J.DELBAERE,A.R.SIELECKI,
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REMARK 1 AUTH 2 A.GERTLER
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REMARK 1 TITL CRYSTAL STRUCTURE STUDIES AND INHIBITION KINETICS
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REMARK 1 TITL 2 OF TRIPEPTIDE CHLOROMETHYL KETONE INHIBITORS WITH
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REMARK 1 TITL 3 STREPTOMYCES GRISEUS PROTEASE B
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REMARK 1 REF J.MOL.BIOL. V. 139 423 1980
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REMARK 1 REFN ISSN 0022-2836
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REMARK 1 REFERENCE 4
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REMARK 1 AUTH L.T.J.DELBAERE,G.D.BRAYER,M.M.G.JAMES
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REMARK 1 TITL THE 2.8 ANGSTROMS RESOLUTION STRUCTURE OF
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REMARK 1 TITL 2 STREPTOMYCES GRISEUS PROTEASE B AND ITS HOMOLOGY
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REMARK 1 TITL 3 WITH ALPHA-CHYMOTRYPSIN AND STREPTOMYCES GRISEUS
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REMARK 1 TITL 4 PROTEASE A
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REMARK 1 REF CAN.J.BIOCHEM. V. 57 135 1979
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REMARK 1 REFN ISSN 0008-4018
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REMARK 1 REFERENCE 5
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REMARK 1 AUTH M.N.G.JAMES,L.T.J.DELBAERE,G.D.BRAYER
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REMARK 1 TITL AMINO ACID SEQUENCE ALIGNMENT OF BACTERIAL AND
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REMARK 1 TITL 2 MAMMALIAN PANCREATIC SERINE PROTEASES BASED ON
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REMARK 1 TITL 3 TOPOLOGICAL EQUIVALENCES
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REMARK 1 REF CAN.J.BIOCHEM. V. 56 396 1978
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REMARK 1 REFN ISSN 0008-4018
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REMARK 1 REFERENCE 6
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REMARK 1 AUTH M.N.G.JAMES
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REMARK 1 TITL RELATIONSHIP BETWEEN THE STRUCTURES AND ACTIVITIES
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REMARK 1 TITL 2 OF SOME MICROBIAL SERINE PROTEASES. II. COMPARISON
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REMARK 1 TITL 3 OF THE TERTIARY STRUCTURES OF MICROBIAL AND
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REMARK 1 TITL 4 PANCREATIC SERINE PROTEASES
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REMARK 1 REF MIAMI WINTER SYMP. V. 11 125 1976
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REMARK 1 REFN ISSN 0097-0808
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REMARK 1 REFERENCE 7
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REMARK 1 AUTH L.T.J.DELBAERE,W.L.B.HUTCHEON,M.N.G.JAMES,
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REMARK 1 AUTH 2 W.E.THEISSEN
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REMARK 1 TITL TERTIARY STRUCTURAL DIFFERENCES BETWEEN MICROBIAL
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REMARK 1 TITL 2 SERINE PROTEASES AND PANCREATIC SERINE ENZYMES
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REMARK 1 REF NATURE V. 257 758 1975
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REMARK 1 REFN ISSN 0028-0836
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REMARK 1 REFERENCE 8
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REMARK 1 AUTH P.W.CODDING,L.T.J.DELBAERE,K.HAYAKAWA,
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REMARK 1 AUTH 2 W.L.B.HUTCHEON,M.N.G.JAMES,L.JURASEK
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REMARK 1 TITL 4.5 ANGSTROMS RESOLUTION STRUCTURE OF A BACTERIAL
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REMARK 1 TITL 2 SERINE PROTEASE FROM STREPTOMYCES GRISEUS
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REMARK 1 REF CAN.J.BIOCHEM. V. 52 208 1974
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REMARK 1 REFN ISSN 0008-4018
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REMARK 2
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REMARK 2 RESOLUTION. 1.80 ANGSTROMS.
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REMARK 3
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REMARK 3 REFINEMENT.
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REMARK 3 PROGRAM : NULL
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REMARK 3 AUTHORS : NULL
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REMARK 3
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REMARK 3 DATA USED IN REFINEMENT.
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REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.80
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REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 6.00
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REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL
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REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL
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REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL
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REMARK 3 COMPLETENESS (WORKING+TEST) (%) : NULL
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REMARK 3 NUMBER OF REFLECTIONS : NULL
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REMARK 3
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REMARK 3 FIT TO DATA USED IN REFINEMENT.
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REMARK 3 CROSS-VALIDATION METHOD : NULL
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REMARK 3 FREE R VALUE TEST SET SELECTION : NULL
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REMARK 3 R VALUE (WORKING SET) : 0.125
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REMARK 3 FREE R VALUE : NULL
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REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL
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REMARK 3 FREE R VALUE TEST SET COUNT : NULL
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REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL
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REMARK 3
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REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN.
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REMARK 3 TOTAL NUMBER OF BINS USED : NULL
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REMARK 3 BIN RESOLUTION RANGE HIGH (A) : NULL
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REMARK 3 BIN RESOLUTION RANGE LOW (A) : NULL
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REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL
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REMARK 3 REFLECTIONS IN BIN (WORKING SET) : NULL
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REMARK 3 BIN R VALUE (WORKING SET) : NULL
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REMARK 3 BIN FREE R VALUE : NULL
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REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : NULL
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REMARK 3 BIN FREE R VALUE TEST SET COUNT : NULL
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REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL
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REMARK 3
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REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.
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REMARK 3 PROTEIN ATOMS : 1690
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REMARK 3 NUCLEIC ACID ATOMS : 0
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REMARK 3 HETEROGEN ATOMS : 0
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REMARK 3 SOLVENT ATOMS : 182
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REMARK 3
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REMARK 3 B VALUES.
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REMARK 3 FROM WILSON PLOT (A**2) : NULL
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REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL
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REMARK 3 OVERALL ANISOTROPIC B VALUE.
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REMARK 3 B11 (A**2) : NULL
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REMARK 3 B22 (A**2) : NULL
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REMARK 3 B33 (A**2) : NULL
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REMARK 3 B12 (A**2) : NULL
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REMARK 3 B13 (A**2) : NULL
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REMARK 3 B23 (A**2) : NULL
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REMARK 3
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REMARK 3 ESTIMATED COORDINATE ERROR.
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REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.14
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REMARK 3 ESD FROM SIGMAA (A) : NULL
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REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL
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REMARK 3
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REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR.
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REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL
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REMARK 3 ESD FROM C-V SIGMAA (A) : NULL
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REMARK 3
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REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES.
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REMARK 3 BOND LENGTHS (A) : NULL
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REMARK 3 BOND ANGLES (DEGREES) : NULL
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REMARK 3 DIHEDRAL ANGLES (DEGREES) : NULL
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REMARK 3 IMPROPER ANGLES (DEGREES) : NULL
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REMARK 3
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REMARK 3 ISOTROPIC THERMAL MODEL : NULL
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REMARK 3
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REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA
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REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL
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REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL
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REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL
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REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL
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REMARK 3
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REMARK 3 NCS MODEL : NULL
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REMARK 3
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REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT
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REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL
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REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL
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REMARK 3
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REMARK 3 PARAMETER FILE 1 : NULL
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REMARK 3 TOPOLOGY FILE 1 : NULL
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REMARK 3
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REMARK 3 OTHER REFINEMENT REMARKS: NULL
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REMARK 4
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REMARK 4 3SGB COMPLIES WITH FORMAT V. 3.15, 01-DEC-08
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REMARK 100
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REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL.
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REMARK 200
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REMARK 200 EXPERIMENTAL DETAILS
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REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION
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REMARK 200 DATE OF DATA COLLECTION : NULL
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REMARK 200 TEMPERATURE (KELVIN) : NULL
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REMARK 200 PH : NULL
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REMARK 200 NUMBER OF CRYSTALS USED : NULL
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REMARK 200
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REMARK 200 SYNCHROTRON (Y/N) : NULL
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REMARK 200 RADIATION SOURCE : NULL
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REMARK 200 BEAMLINE : NULL
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REMARK 200 X-RAY GENERATOR MODEL : NULL
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REMARK 200 MONOCHROMATIC OR LAUE (M/L) : NULL
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REMARK 200 WAVELENGTH OR RANGE (A) : NULL
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REMARK 200 MONOCHROMATOR : NULL
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REMARK 200 OPTICS : NULL
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REMARK 200
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REMARK 200 DETECTOR TYPE : NULL
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REMARK 200 DETECTOR MANUFACTURER : NULL
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REMARK 200 INTENSITY-INTEGRATION SOFTWARE : NULL
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REMARK 200 DATA SCALING SOFTWARE : NULL
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REMARK 200
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REMARK 200 NUMBER OF UNIQUE REFLECTIONS : NULL
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REMARK 200 RESOLUTION RANGE HIGH (A) : NULL
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REMARK 200 RESOLUTION RANGE LOW (A) : NULL
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REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL
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REMARK 200
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REMARK 200 OVERALL.
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REMARK 200 COMPLETENESS FOR RANGE (%) : NULL
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REMARK 200 DATA REDUNDANCY : NULL
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REMARK 200 R MERGE (I) : NULL
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REMARK 200 R SYM (I) : NULL
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REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : NULL
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REMARK 200
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REMARK 200 IN THE HIGHEST RESOLUTION SHELL.
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REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL
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REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL
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REMARK 200 COMPLETENESS FOR SHELL (%) : NULL
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REMARK 200 DATA REDUNDANCY IN SHELL : NULL
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REMARK 200 R MERGE FOR SHELL (I) : NULL
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REMARK 200 R SYM FOR SHELL (I) : NULL
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REMARK 200 <I/SIGMA(I)> FOR SHELL : NULL
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REMARK 200
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REMARK 200 DIFFRACTION PROTOCOL: NULL
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REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL
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REMARK 200 SOFTWARE USED: NULL
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REMARK 200 STARTING MODEL: NULL
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REMARK 200
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REMARK 200 REMARK: NULL
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REMARK 280
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REMARK 280 CRYSTAL
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REMARK 280 SOLVENT CONTENT, VS (%): 38.33
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REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 1.99
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REMARK 280
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REMARK 280 CRYSTALLIZATION CONDITIONS: NULL
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REMARK 290
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REMARK 290 CRYSTALLOGRAPHIC SYMMETRY
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REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1 21 1
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REMARK 290
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REMARK 290 SYMOP SYMMETRY
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REMARK 290 NNNMMM OPERATOR
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REMARK 290 1555 X,Y,Z
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REMARK 290 2555 -X,Y+1/2,-Z
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REMARK 290
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REMARK 290 WHERE NNN -> OPERATOR NUMBER
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REMARK 290 MMM -> TRANSLATION VECTOR
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REMARK 290
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REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS
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REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM
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REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY
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REMARK 290 RELATED MOLECULES.
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REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000
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REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000
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REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000
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REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000
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REMARK 290 SMTRY2 2 0.000000 1.000000 0.000000 27.26000
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REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000
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REMARK 290
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REMARK 290 REMARK: NULL
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REMARK 300
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REMARK 300 BIOMOLECULE: 1
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REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM
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REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN
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REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON
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REMARK 300 BURIED SURFACE AREA.
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REMARK 350
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REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN
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REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE
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REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS
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REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND
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REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.
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REMARK 350
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REMARK 350 BIOMOLECULE: 1
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REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC
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REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC
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REMARK 350 SOFTWARE USED: PISA
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REMARK 350 TOTAL BURIED SURFACE AREA: 1270 ANGSTROM**2
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REMARK 350 SURFACE AREA OF THE COMPLEX: 9690 ANGSTROM**2
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REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -8.0 KCAL/MOL
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REMARK 350 APPLY THE FOLLOWING TO CHAINS: E, I
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REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000
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REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000
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REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000
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REMARK 465
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REMARK 465 MISSING RESIDUES
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REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE
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REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
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REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.)
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REMARK 465
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REMARK 465 M RES C SSSEQI
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REMARK 465 LEU I 1
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REMARK 465 ALA I 2
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REMARK 465 ALA I 3
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REMARK 465 VAL I 4
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REMARK 465 SER I 5
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REMARK 465 VAL I 6
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REMARK 500
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REMARK 500 GEOMETRY AND STEREOCHEMISTRY
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REMARK 500 SUBTOPIC: COVALENT BOND ANGLES
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REMARK 500
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REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES
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REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE
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REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN
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REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
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REMARK 500
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REMARK 500 STANDARD TABLE:
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REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)
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REMARK 500
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REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999
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REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996
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REMARK 500
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REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3
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REMARK 500 ARG E 41 NE - CZ - NH1 ANGL. DEV. = 3.9 DEGREES
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REMARK 500 ARG E 48A NE - CZ - NH1 ANGL. DEV. = 4.4 DEGREES
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REMARK 500 ARG E 48A NE - CZ - NH2 ANGL. DEV. = -4.6 DEGREES
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REMARK 500 ARG E 107 NE - CZ - NH2 ANGL. DEV. = -3.1 DEGREES
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REMARK 500 ASP E 116 CB - CG - OD2 ANGL. DEV. = -5.9 DEGREES
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REMARK 500 ARG E 138 NE - CZ - NH1 ANGL. DEV. = 6.1 DEGREES
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REMARK 500 VAL E 162 O - C - N ANGL. DEV. = 9.6 DEGREES
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REMARK 500 ARG E 182 CD - NE - CZ ANGL. DEV. = 11.2 DEGREES
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REMARK 500 GLU E 233 CA - CB - CG ANGL. DEV. = 16.7 DEGREES
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REMARK 500 ALA I 15 N - CA - CB ANGL. DEV. = 8.9 DEGREES
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REMARK 500 GLU I 19 CG - CD - OE1 ANGL. DEV. = 12.5 DEGREES
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REMARK 500 TYR I 31 CG - CD1 - CE1 ANGL. DEV. = -4.9 DEGREES
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REMARK 500 THR I 47 N - CA - CB ANGL. DEV. = -15.5 DEGREES
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REMARK 500 THR I 47 OG1 - CB - CG2 ANGL. DEV. = 14.7 DEGREES
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REMARK 500
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REMARK 500 REMARK: NULL
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REMARK 500
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REMARK 500 GEOMETRY AND STEREOCHEMISTRY
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REMARK 500 SUBTOPIC: TORSION ANGLES
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REMARK 500
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REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:
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REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
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REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
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REMARK 500
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REMARK 500 STANDARD TABLE:
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REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)
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REMARK 500
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REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-
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REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400
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REMARK 500
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REMARK 500 M RES CSSEQI PSI PHI
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REMARK 500 SER E 33 -163.43 -108.54
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REMARK 500 CYS E 42 -165.45 -126.61
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REMARK 500 PRO E 99A -154.25 -78.72
|
|
REMARK 500 ASN E 100 -66.71 79.77
|
|
REMARK 500 ASP E 102 74.12 -150.09
|
|
REMARK 500 LYS E 115 72.50 -117.36
|
|
REMARK 500
|
|
REMARK 500 REMARK: NULL
|
|
REMARK 500
|
|
REMARK 500 GEOMETRY AND STEREOCHEMISTRY
|
|
REMARK 500 SUBTOPIC: PLANAR GROUPS
|
|
REMARK 500
|
|
REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL
|
|
REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE
|
|
REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN
|
|
REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS
|
|
REMARK 500 AN RMSD GREATER THAN THIS VALUE
|
|
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;
|
|
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).
|
|
REMARK 500
|
|
REMARK 500 M RES CSSEQI RMS TYPE
|
|
REMARK 500 ARG E 81 0.09 SIDE_CHAIN
|
|
REMARK 500
|
|
REMARK 500 REMARK: NULL
|
|
REMARK 700
|
|
REMARK 700 SHEET
|
|
REMARK 700 THE SEVEN-STRANDED SHEETS BL1 AND BL2 PRESENTED ON SHEET
|
|
REMARK 700 RECORDS BELOW ARE ACTUALLY SIX-STRANDED BETA BARRELS. THIS
|
|
REMARK 700 IS DENOTED BY THE FIRST STRAND RECURRING AS THE LAST
|
|
REMARK 700 STRAND.
|
|
DBREF 3SGB E 16 242 UNP P00777 PRTB_STRGR 115 299
|
|
DBREF 3SGB I 1 56 UNP P68390 IOVO_MELGA 130 185
|
|
SEQADV 3SGB VAL E 235A UNP P00777 SER 292 CONFLICT
|
|
SEQRES 1 E 185 ILE SER GLY GLY ASP ALA ILE TYR SER SER THR GLY ARG
|
|
SEQRES 2 E 185 CYS SER LEU GLY PHE ASN VAL ARG SER GLY SER THR TYR
|
|
SEQRES 3 E 185 TYR PHE LEU THR ALA GLY HIS CYS THR ASP GLY ALA THR
|
|
SEQRES 4 E 185 THR TRP TRP ALA ASN SER ALA ARG THR THR VAL LEU GLY
|
|
SEQRES 5 E 185 THR THR SER GLY SER SER PHE PRO ASN ASN ASP TYR GLY
|
|
SEQRES 6 E 185 ILE VAL ARG TYR THR ASN THR THR ILE PRO LYS ASP GLY
|
|
SEQRES 7 E 185 THR VAL GLY GLY GLN ASP ILE THR SER ALA ALA ASN ALA
|
|
SEQRES 8 E 185 THR VAL GLY MET ALA VAL THR ARG ARG GLY SER THR THR
|
|
SEQRES 9 E 185 GLY THR HIS SER GLY SER VAL THR ALA LEU ASN ALA THR
|
|
SEQRES 10 E 185 VAL ASN TYR GLY GLY GLY ASP VAL VAL TYR GLY MET ILE
|
|
SEQRES 11 E 185 ARG THR ASN VAL CYS ALA GLU PRO GLY ASP SER GLY GLY
|
|
SEQRES 12 E 185 PRO LEU TYR SER GLY THR ARG ALA ILE GLY LEU THR SER
|
|
SEQRES 13 E 185 GLY GLY SER GLY ASN CYS SER SER GLY GLY THR THR PHE
|
|
SEQRES 14 E 185 PHE GLN PRO VAL THR GLU ALA LEU VAL ALA TYR GLY VAL
|
|
SEQRES 15 E 185 SER VAL TYR
|
|
SEQRES 1 I 56 LEU ALA ALA VAL SER VAL ASP CYS SER GLU TYR PRO LYS
|
|
SEQRES 2 I 56 PRO ALA CYS THR LEU GLU TYR ARG PRO LEU CYS GLY SER
|
|
SEQRES 3 I 56 ASP ASN LYS THR TYR GLY ASN LYS CYS ASN PHE CYS ASN
|
|
SEQRES 4 I 56 ALA VAL VAL GLU SER ASN GLY THR LEU THR LEU SER HIS
|
|
SEQRES 5 I 56 PHE GLY LYS CYS
|
|
FORMUL 3 HOH *182(H2 O)
|
|
HELIX 1 HA PRO E 230 TYR E 237 1 9
|
|
HELIX 2 HB ASN I 33 GLU I 43 1 11
|
|
SHEET 1 BL1 7 GLY E 19 SER E 33 0
|
|
SHEET 2 BL1 7 GLY E 40 SER E 48B-1
|
|
SHEET 3 BL1 7 THR E 49 THR E 54 -1
|
|
SHEET 4 BL1 7 TYR E 103 THR E 109 -1
|
|
SHEET 5 BL1 7 THR E 83 SER E 93 -1
|
|
SHEET 6 BL1 7 THR E 64 ALA E 68 -1
|
|
SHEET 7 BL1 7 GLY E 19 SER E 33 -1
|
|
SHEET 1 BL2 7 GLY E 133 GLY E 140 0
|
|
SHEET 2 BL2 7 GLY E 156 VAL E 169 -1
|
|
SHEET 3 BL2 7 VAL E 177 ASN E 184 -1
|
|
SHEET 4 BL2 7 GLY E 223 GLN E 229 -1
|
|
SHEET 5 BL2 7 ARG E 208 ASN E 219 -1
|
|
SHEET 6 BL2 7 GLY E 196 SER E 201 -1
|
|
SHEET 7 BL2 7 GLY E 133 GLY E 140 -1
|
|
SHEET 1 SH1 3 ASN I 28 GLY I 32 0
|
|
SHEET 2 SH1 3 ARG I 21 GLY I 25 -1
|
|
SHEET 3 SH1 3 SER I 51 HIS I 52 -1
|
|
SSBOND 1 CYS E 42 CYS E 58 1555 1555 2.05
|
|
SSBOND 2 CYS E 191 CYS E 220 1555 1555 2.06
|
|
SSBOND 3 CYS I 8 CYS I 38 1555 1555 2.04
|
|
SSBOND 4 CYS I 16 CYS I 35 1555 1555 1.96
|
|
SSBOND 5 CYS I 24 CYS I 56 1555 1555 2.02
|
|
CISPEP 1 PHE E 94 PRO E 99A 0 -3.19
|
|
CISPEP 2 TYR I 11 PRO I 12 0 1.08
|
|
CRYST1 45.350 54.520 45.650 90.00 119.20 90.00 P 1 21 1 2
|
|
ORIGX1 0.022051 0.000000 0.012324 0.00000
|
|
ORIGX2 0.000000 0.018342 0.000000 0.00000
|
|
ORIGX3 0.000000 0.000000 0.025095 0.00000
|
|
SCALE1 0.022051 0.000000 0.012324 0.00000
|
|
SCALE2 0.000000 0.018342 0.000000 0.00000
|
|
SCALE3 0.000000 0.000000 0.025095 0.00000
|
|
ATOM 1 N ILE E 16 -9.947 23.613 20.817 1.00 16.42 N
|
|
ATOM 2 CA ILE E 16 -8.679 23.683 21.590 1.00 12.69 C
|
|
ATOM 3 C ILE E 16 -8.552 25.139 22.052 1.00 13.95 C
|
|
ATOM 4 O ILE E 16 -8.960 26.039 21.307 1.00 11.71 O
|
|
ATOM 5 CB ILE E 16 -7.492 23.127 20.765 1.00 14.46 C
|
|
ATOM 6 CG1 ILE E 16 -6.267 22.953 21.698 1.00 11.29 C
|
|
ATOM 7 CG2 ILE E 16 -7.113 23.951 19.502 1.00 15.46 C
|
|
ATOM 8 CD1 ILE E 16 -5.065 22.173 21.048 1.00 11.69 C
|
|
ATOM 9 N SER E 17 -8.112 25.286 23.328 1.00 10.87 N
|
|
ATOM 10 CA SER E 17 -8.078 26.688 23.826 1.00 10.79 C
|
|
ATOM 11 C SER E 17 -6.795 26.878 24.615 1.00 11.19 C
|
|
ATOM 12 O SER E 17 -5.987 25.962 24.694 1.00 7.25 O
|
|
ATOM 13 CB SER E 17 -9.371 26.955 24.607 1.00 14.18 C
|
|
ATOM 14 OG SER E 17 -9.313 26.350 25.874 1.00 14.94 O
|
|
ATOM 15 N GLY E 18 -6.622 28.100 25.125 1.00 7.17 N
|
|
ATOM 16 CA GLY E 18 -5.395 28.399 25.898 1.00 7.45 C
|
|
ATOM 17 C GLY E 18 -5.247 27.418 27.077 1.00 7.82 C
|
|
ATOM 18 O GLY E 18 -6.226 27.233 27.815 1.00 7.71 O
|
|
ATOM 19 N GLY E 19 -4.045 26.960 27.273 1.00 5.59 N
|
|
ATOM 20 CA GLY E 19 -3.762 26.001 28.388 1.00 7.08 C
|
|
ATOM 21 C GLY E 19 -3.762 24.556 27.926 1.00 8.86 C
|
|
ATOM 22 O GLY E 19 -3.253 23.743 28.703 1.00 7.39 O
|
|
ATOM 23 N ASP E 29 -4.442 24.201 26.838 1.00 5.21 N
|
|
ATOM 24 CA ASP E 29 -4.463 22.811 26.364 1.00 8.79 C
|
|
ATOM 25 C ASP E 29 -3.088 22.282 25.926 1.00 8.02 C
|
|
ATOM 26 O ASP E 29 -2.236 23.051 25.479 1.00 6.20 O
|
|
ATOM 27 CB ASP E 29 -5.517 22.637 25.264 1.00 6.42 C
|
|
ATOM 28 CG ASP E 29 -6.934 22.838 25.707 1.00 10.94 C
|
|
ATOM 29 OD1 ASP E 29 -7.793 23.057 24.810 1.00 12.19 O
|
|
ATOM 30 OD2 ASP E 29 -7.160 22.702 26.930 1.00 13.76 O
|
|
ATOM 31 N ALA E 30 -2.958 20.947 26.025 1.00 4.16 N
|
|
ATOM 32 CA ALA E 30 -1.670 20.336 25.643 1.00 6.19 C
|
|
ATOM 33 C ALA E 30 -1.447 20.494 24.140 1.00 8.64 C
|
|
ATOM 34 O ALA E 30 -2.403 20.358 23.351 1.00 6.66 O
|
|
ATOM 35 CB ALA E 30 -1.651 18.820 25.902 1.00 6.87 C
|
|
ATOM 36 N ILE E 31 -0.205 20.619 23.802 1.00 3.88 N
|
|
ATOM 37 CA ILE E 31 0.254 20.630 22.395 1.00 9.60 C
|
|
ATOM 38 C ILE E 31 1.508 19.709 22.367 1.00 6.33 C
|
|
ATOM 39 O ILE E 31 2.367 19.802 23.232 1.00 8.70 O
|
|
ATOM 40 CB ILE E 31 0.581 21.972 21.722 1.00 5.74 C
|
|
ATOM 41 CG1 ILE E 31 1.637 22.751 22.550 1.00 4.81 C
|
|
ATOM 42 CG2 ILE E 31 -0.777 22.778 21.546 1.00 6.79 C
|
|
ATOM 43 CD1 ILE E 31 2.060 24.163 21.973 1.00 9.24 C
|
|
ATOM 44 N TYR E 32 1.563 18.946 21.287 1.00 7.44 N
|
|
ATOM 45 CA TYR E 32 2.713 17.992 21.152 1.00 8.52 C
|
|
ATOM 46 C TYR E 32 3.572 18.242 19.924 1.00 10.33 C
|
|
ATOM 47 O TYR E 32 3.023 18.362 18.797 1.00 11.24 O
|
|
ATOM 48 CB TYR E 32 2.073 16.601 21.056 1.00 8.05 C
|
|
ATOM 49 CG TYR E 32 1.280 16.192 22.272 1.00 6.91 C
|
|
ATOM 50 CD1 TYR E 32 1.935 15.456 23.292 1.00 14.08 C
|
|
ATOM 51 CD2 TYR E 32 -0.024 16.580 22.447 1.00 8.81 C
|
|
ATOM 52 CE1 TYR E 32 1.211 15.086 24.423 1.00 9.41 C
|
|
ATOM 53 CE2 TYR E 32 -0.756 16.182 23.579 1.00 6.55 C
|
|
ATOM 54 CZ TYR E 32 -0.119 15.391 24.515 1.00 9.28 C
|
|
ATOM 55 OH TYR E 32 -0.901 15.069 25.591 1.00 18.55 O
|
|
ATOM 56 N SER E 33 4.850 18.242 20.136 1.00 9.35 N
|
|
ATOM 57 CA SER E 33 5.798 18.433 18.976 1.00 14.23 C
|
|
ATOM 58 C SER E 33 6.449 17.081 18.753 1.00 15.84 C
|
|
ATOM 59 O SER E 33 5.985 16.100 19.347 1.00 15.37 O
|
|
ATOM 60 CB SER E 33 6.796 19.545 19.259 1.00 13.69 C
|
|
ATOM 61 OG SER E 33 7.659 18.995 20.271 1.00 11.71 O
|
|
ATOM 62 N SER E 34 7.563 17.070 18.016 1.00 20.19 N
|
|
ATOM 63 CA SER E 34 8.258 15.784 17.828 1.00 23.20 C
|
|
ATOM 64 C SER E 34 9.071 15.451 19.084 1.00 23.19 C
|
|
ATOM 65 O SER E 34 9.327 14.262 19.291 1.00 20.42 O
|
|
ATOM 66 CB SER E 34 9.141 15.702 16.597 1.00 27.12 C
|
|
ATOM 67 OG SER E 34 8.370 14.862 15.704 1.00 33.99 O
|
|
ATOM 68 N THR E 39 9.421 16.492 19.829 1.00 20.76 N
|
|
ATOM 69 CA THR E 39 10.240 16.242 21.032 1.00 20.41 C
|
|
ATOM 70 C THR E 39 9.489 16.154 22.351 1.00 22.49 C
|
|
ATOM 71 O THR E 39 9.941 15.369 23.232 1.00 24.77 O
|
|
ATOM 72 CB THR E 39 11.306 17.392 21.080 1.00 25.24 C
|
|
ATOM 73 OG1 THR E 39 10.489 18.608 21.196 1.00 25.40 O
|
|
ATOM 74 CG2 THR E 39 12.180 17.435 19.817 1.00 30.22 C
|
|
ATOM 75 N GLY E 40 8.384 16.868 22.487 1.00 15.46 N
|
|
ATOM 76 CA GLY E 40 7.727 16.841 23.818 1.00 16.37 C
|
|
ATOM 77 C GLY E 40 6.394 17.566 23.850 1.00 12.04 C
|
|
ATOM 78 O GLY E 40 5.789 17.703 22.790 1.00 13.35 O
|
|
ATOM 79 N ARG E 41 6.016 17.904 25.101 1.00 7.26 N
|
|
ATOM 80 CA ARG E 41 4.698 18.510 25.260 1.00 6.88 C
|
|
ATOM 81 C ARG E 41 4.841 19.922 25.874 1.00 3.64 C
|
|
ATOM 82 O ARG E 41 5.616 20.025 26.790 1.00 5.97 O
|
|
ATOM 83 CB ARG E 41 3.716 17.686 26.109 1.00 6.42 C
|
|
ATOM 84 CG ARG E 41 2.419 18.368 26.555 1.00 2.74 C
|
|
ATOM 85 CD ARG E 41 1.458 17.479 27.293 1.00 5.38 C
|
|
ATOM 86 NE ARG E 41 2.027 16.618 28.329 1.00 11.70 N
|
|
ATOM 87 CZ ARG E 41 2.108 17.048 29.612 1.00 11.23 C
|
|
ATOM 88 NH1 ARG E 41 1.681 18.215 30.026 1.00 8.58 N
|
|
ATOM 89 NH2 ARG E 41 2.645 16.247 30.540 1.00 15.58 N
|
|
ATOM 90 N CYS E 42 4.065 20.821 25.240 1.00 5.05 N
|
|
ATOM 91 CA CYS E 42 4.008 22.195 25.822 1.00 5.00 C
|
|
ATOM 92 C CYS E 42 2.536 22.479 26.005 1.00 3.39 C
|
|
ATOM 93 O CYS E 42 1.706 21.524 25.966 1.00 6.85 O
|
|
ATOM 94 CB CYS E 42 4.735 23.149 24.886 1.00 4.46 C
|
|
ATOM 95 SG CYS E 42 6.516 22.882 24.953 1.00 9.23 S
|
|
ATOM 96 N SER E 43 2.187 23.711 26.225 1.00 3.47 N
|
|
ATOM 97 CA SER E 43 0.772 24.163 26.296 1.00 3.02 C
|
|
ATOM 98 C SER E 43 0.535 25.265 25.276 1.00 4.65 C
|
|
ATOM 99 O SER E 43 1.433 26.061 25.001 1.00 6.07 O
|
|
ATOM 100 CB SER E 43 0.565 24.730 27.715 1.00 4.77 C
|
|
ATOM 101 OG SER E 43 0.747 23.678 28.695 1.00 4.81 O
|
|
ATOM 102 N LEU E 44 -0.703 25.303 24.782 1.00 4.11 N
|
|
ATOM 103 CA LEU E 44 -1.116 26.399 23.881 1.00 5.36 C
|
|
ATOM 104 C LEU E 44 -1.291 27.680 24.690 1.00 5.87 C
|
|
ATOM 105 O LEU E 44 -1.804 27.620 25.818 1.00 7.58 O
|
|
ATOM 106 CB LEU E 44 -2.429 25.881 23.244 1.00 5.23 C
|
|
ATOM 107 CG LEU E 44 -2.826 26.775 22.056 1.00 6.38 C
|
|
ATOM 108 CD1 LEU E 44 -3.541 25.837 21.080 1.00 7.99 C
|
|
ATOM 109 CD2 LEU E 44 -3.688 27.936 22.479 1.00 7.36 C
|
|
ATOM 110 N GLY E 45 -0.748 28.781 24.132 1.00 6.71 N
|
|
ATOM 111 CA GLY E 45 -0.789 30.073 24.846 1.00 3.48 C
|
|
ATOM 112 C GLY E 45 -2.122 30.722 24.611 1.00 6.43 C
|
|
ATOM 113 O GLY E 45 -3.048 30.662 25.471 1.00 5.67 O
|
|
ATOM 114 N PHE E 46 -2.220 31.393 23.431 1.00 5.59 N
|
|
ATOM 115 CA PHE E 46 -3.487 32.052 23.092 1.00 5.38 C
|
|
ATOM 116 C PHE E 46 -3.699 31.780 21.574 1.00 4.71 C
|
|
ATOM 117 O PHE E 46 -2.684 31.780 20.845 1.00 7.21 O
|
|
ATOM 118 CB PHE E 46 -3.487 33.568 23.296 1.00 10.76 C
|
|
ATOM 119 CG PHE E 46 -3.239 34.020 24.718 1.00 5.20 C
|
|
ATOM 120 CD1 PHE E 46 -4.337 34.140 25.571 1.00 6.30 C
|
|
ATOM 121 CD2 PHE E 46 -1.949 34.277 25.153 1.00 6.54 C
|
|
ATOM 122 CE1 PHE E 46 -4.183 34.549 26.910 1.00 7.50 C
|
|
ATOM 123 CE2 PHE E 46 -1.767 34.718 26.492 1.00 6.91 C
|
|
ATOM 124 CZ PHE E 46 -2.881 34.816 27.332 1.00 6.77 C
|
|
ATOM 125 N ASN E 47 -4.961 31.633 21.259 1.00 7.20 N
|
|
ATOM 126 CA ASN E 47 -5.391 31.583 19.829 1.00 6.68 C
|
|
ATOM 127 C ASN E 47 -5.382 33.050 19.367 1.00 9.62 C
|
|
ATOM 128 O ASN E 47 -5.960 33.944 20.012 1.00 10.62 O
|
|
ATOM 129 CB ASN E 47 -6.757 30.946 19.669 1.00 13.59 C
|
|
ATOM 130 CG ASN E 47 -6.646 29.408 19.697 1.00 10.51 C
|
|
ATOM 131 OD1 ASN E 47 -5.612 28.868 19.259 1.00 11.65 O
|
|
ATOM 132 ND2 ASN E 47 -7.617 28.732 20.283 1.00 9.30 N
|
|
ATOM 133 N VAL E 48 -4.842 33.312 18.199 1.00 9.73 N
|
|
ATOM 134 CA VAL E 48 -4.739 34.664 17.633 1.00 10.44 C
|
|
ATOM 135 C VAL E 48 -5.034 34.598 16.115 1.00 12.76 C
|
|
ATOM 136 O VAL E 48 -5.073 33.492 15.553 1.00 9.85 O
|
|
ATOM 137 CB VAL E 48 -3.367 35.269 17.928 1.00 10.23 C
|
|
ATOM 138 CG1 VAL E 48 -3.082 35.482 19.422 1.00 10.78 C
|
|
ATOM 139 CG2 VAL E 48 -2.228 34.500 17.271 1.00 17.69 C
|
|
ATOM 140 N ARG E 48A -5.150 35.803 15.569 1.00 14.19 N
|
|
ATOM 141 CA ARG E 48A -5.370 35.754 14.063 1.00 12.36 C
|
|
ATOM 142 C ARG E 48A -4.893 37.057 13.453 1.00 13.12 C
|
|
ATOM 143 O ARG E 48A -4.698 38.060 14.126 1.00 13.84 O
|
|
ATOM 144 CB ARG E 48A -6.850 35.498 13.903 1.00 17.85 C
|
|
ATOM 145 CG ARG E 48A -7.723 36.741 14.095 1.00 25.71 C
|
|
ATOM 146 CD ARG E 48A -9.100 36.354 14.505 1.00 36.17 C
|
|
ATOM 147 NE ARG E 48A -10.080 36.790 13.517 1.00 44.35 N
|
|
ATOM 148 CZ ARG E 48A -11.327 37.183 13.776 1.00 45.84 C
|
|
ATOM 149 NH1 ARG E 48A -11.893 37.150 14.967 1.00 46.23 N
|
|
ATOM 150 NH2 ARG E 48A -12.013 37.668 12.732 1.00 51.48 N
|
|
ATOM 151 N SER E 48B -4.748 36.992 12.130 1.00 19.06 N
|
|
ATOM 152 CA SER E 48B -4.414 38.137 11.273 1.00 21.48 C
|
|
ATOM 153 C SER E 48B -5.383 37.924 10.078 1.00 24.31 C
|
|
ATOM 154 O SER E 48B -5.251 36.888 9.420 1.00 20.83 O
|
|
ATOM 155 CB SER E 48B -3.002 38.148 10.759 1.00 24.48 C
|
|
ATOM 156 OG SER E 48B -2.723 39.467 10.261 1.00 33.51 O
|
|
ATOM 157 N GLY E 48C -6.321 38.813 9.930 1.00 28.69 N
|
|
ATOM 158 CA GLY E 48C -7.352 38.666 8.878 1.00 29.44 C
|
|
ATOM 159 C GLY E 48C -8.018 37.308 9.153 1.00 32.77 C
|
|
ATOM 160 O GLY E 48C -8.549 37.025 10.257 1.00 34.68 O
|
|
ATOM 161 N SER E 48D -7.917 36.458 8.145 1.00 30.11 N
|
|
ATOM 162 CA SER E 48D -8.484 35.116 8.137 1.00 29.79 C
|
|
ATOM 163 C SER E 48D -7.524 33.993 8.488 1.00 26.90 C
|
|
ATOM 164 O SER E 48D -7.885 32.805 8.364 1.00 29.66 O
|
|
ATOM 165 CB SER E 48D -8.989 34.898 6.687 1.00 40.09 C
|
|
ATOM 166 OG SER E 48D -7.934 35.242 5.782 1.00 43.73 O
|
|
ATOM 167 N THR E 49 -6.304 34.293 8.862 1.00 24.49 N
|
|
ATOM 168 CA THR E 49 -5.299 33.257 9.165 1.00 20.34 C
|
|
ATOM 169 C THR E 49 -5.272 33.137 10.707 1.00 19.95 C
|
|
ATOM 170 O THR E 49 -4.955 34.168 11.325 1.00 20.87 O
|
|
ATOM 171 CB THR E 49 -3.874 33.606 8.619 1.00 21.41 C
|
|
ATOM 172 OG1 THR E 49 -4.038 33.988 7.201 1.00 30.38 O
|
|
ATOM 173 CG2 THR E 49 -2.821 32.499 8.723 1.00 22.36 C
|
|
ATOM 174 N TYR E 50 -5.538 31.938 11.150 1.00 18.37 N
|
|
ATOM 175 CA TYR E 50 -5.550 31.578 12.568 1.00 13.42 C
|
|
ATOM 176 C TYR E 50 -4.184 30.902 12.907 1.00 14.51 C
|
|
ATOM 177 O TYR E 50 -3.561 30.144 12.150 1.00 11.36 O
|
|
ATOM 178 CB TYR E 50 -6.674 30.591 12.899 1.00 19.46 C
|
|
ATOM 179 CG TYR E 50 -8.012 31.300 12.859 1.00 25.29 C
|
|
ATOM 180 CD1 TYR E 50 -8.766 31.382 11.684 1.00 29.91 C
|
|
ATOM 181 CD2 TYR E 50 -8.481 31.960 13.991 1.00 23.75 C
|
|
ATOM 182 CE1 TYR E 50 -9.984 32.036 11.648 1.00 34.23 C
|
|
ATOM 183 CE2 TYR E 50 -9.715 32.598 13.983 1.00 29.02 C
|
|
ATOM 184 CZ TYR E 50 -10.450 32.663 12.807 1.00 36.21 C
|
|
ATOM 185 OH TYR E 50 -11.638 33.344 12.855 1.00 38.66 O
|
|
ATOM 186 N TYR E 51 -3.748 31.300 14.107 1.00 7.79 N
|
|
ATOM 187 CA TYR E 51 -2.477 30.837 14.640 1.00 7.27 C
|
|
ATOM 188 C TYR E 51 -2.657 30.678 16.187 1.00 6.68 C
|
|
ATOM 189 O TYR E 51 -3.699 31.125 16.689 1.00 8.35 O
|
|
ATOM 190 CB TYR E 51 -1.431 31.916 14.521 1.00 10.91 C
|
|
ATOM 191 CG TYR E 51 -0.954 32.478 13.214 1.00 10.27 C
|
|
ATOM 192 CD1 TYR E 51 -1.616 33.541 12.588 1.00 17.03 C
|
|
ATOM 193 CD2 TYR E 51 0.180 31.943 12.620 1.00 14.28 C
|
|
ATOM 194 CE1 TYR E 51 -1.148 34.059 11.377 1.00 17.05 C
|
|
ATOM 195 CE2 TYR E 51 0.685 32.456 11.409 1.00 12.79 C
|
|
ATOM 196 CZ TYR E 51 0.021 33.513 10.835 1.00 17.04 C
|
|
ATOM 197 OH TYR E 51 0.570 34.020 9.683 1.00 19.86 O
|
|
ATOM 198 N PHE E 52 -1.635 30.073 16.729 1.00 8.85 N
|
|
ATOM 199 CA PHE E 52 -1.615 30.079 18.243 1.00 8.35 C
|
|
ATOM 200 C PHE E 52 -0.217 30.498 18.613 1.00 6.81 C
|
|
ATOM 201 O PHE E 52 0.763 30.150 17.964 1.00 8.04 O
|
|
ATOM 202 CB PHE E 52 -1.966 28.830 19.000 1.00 5.75 C
|
|
ATOM 203 CG PHE E 52 -1.161 27.587 18.769 1.00 5.05 C
|
|
ATOM 204 CD1 PHE E 52 -0.024 27.282 19.494 1.00 7.23 C
|
|
ATOM 205 CD2 PHE E 52 -1.696 26.628 17.852 1.00 12.43 C
|
|
ATOM 206 CE1 PHE E 52 0.688 26.121 19.291 1.00 12.14 C
|
|
ATOM 207 CE2 PHE E 52 -0.995 25.412 17.677 1.00 8.94 C
|
|
ATOM 208 CZ PHE E 52 0.169 25.188 18.402 1.00 11.19 C
|
|
ATOM 209 N LEU E 53 -0.164 31.180 19.785 1.00 6.95 N
|
|
ATOM 210 CA LEU E 53 1.120 31.518 20.375 1.00 5.15 C
|
|
ATOM 211 C LEU E 53 1.442 30.406 21.439 1.00 6.79 C
|
|
ATOM 212 O LEU E 53 0.548 29.839 22.080 1.00 8.13 O
|
|
ATOM 213 CB LEU E 53 1.046 32.876 21.044 1.00 7.23 C
|
|
ATOM 214 CG LEU E 53 0.742 34.097 20.168 1.00 9.26 C
|
|
ATOM 215 CD1 LEU E 53 0.568 35.313 21.104 1.00 8.71 C
|
|
ATOM 216 CD2 LEU E 53 1.946 34.304 19.247 1.00 11.63 C
|
|
ATOM 217 N THR E 54 2.738 30.253 21.586 1.00 7.08 N
|
|
ATOM 218 CA THR E 54 3.325 29.386 22.614 1.00 3.03 C
|
|
ATOM 219 C THR E 54 4.684 29.899 22.941 1.00 2.02 C
|
|
ATOM 220 O THR E 54 5.235 30.956 22.467 1.00 4.94 O
|
|
ATOM 221 CB THR E 54 3.255 27.843 22.196 1.00 5.78 C
|
|
ATOM 222 OG1 THR E 54 3.630 27.091 23.423 1.00 7.00 O
|
|
ATOM 223 CG2 THR E 54 4.243 27.500 21.068 1.00 6.18 C
|
|
ATOM 224 N ALA E 55 5.438 29.174 23.774 1.00 3.19 N
|
|
ATOM 225 CA ALA E 55 6.825 29.572 24.101 1.00 3.07 C
|
|
ATOM 226 C ALA E 55 7.756 29.310 22.913 1.00 7.07 C
|
|
ATOM 227 O ALA E 55 7.649 28.274 22.212 1.00 4.75 O
|
|
ATOM 228 CB ALA E 55 7.240 28.645 25.248 1.00 8.74 C
|
|
ATOM 229 N GLY E 56 8.702 30.150 22.754 1.00 3.13 N
|
|
ATOM 230 CA GLY E 56 9.842 30.139 21.809 1.00 4.12 C
|
|
ATOM 231 C GLY E 56 10.663 28.874 22.005 1.00 7.17 C
|
|
ATOM 232 O GLY E 56 11.206 28.280 21.024 1.00 8.84 O
|
|
ATOM 233 N HIS E 57 10.945 28.536 23.276 1.00 6.86 N
|
|
ATOM 234 CA HIS E 57 11.767 27.347 23.527 1.00 4.20 C
|
|
ATOM 235 C HIS E 57 11.001 26.071 23.128 1.00 8.22 C
|
|
ATOM 236 O HIS E 57 11.687 25.052 22.857 1.00 9.42 O
|
|
ATOM 237 CB HIS E 57 12.350 27.135 24.973 1.00 4.26 C
|
|
ATOM 238 CG HIS E 57 11.270 27.036 25.997 1.00 4.21 C
|
|
ATOM 239 ND1 HIS E 57 10.738 28.045 26.763 1.00 9.04 N
|
|
ATOM 240 CD2 HIS E 57 10.669 25.870 26.464 1.00 5.85 C
|
|
ATOM 241 CE1 HIS E 57 9.807 27.538 27.544 1.00 8.51 C
|
|
ATOM 242 NE2 HIS E 57 9.715 26.240 27.392 1.00 6.45 N
|
|
ATOM 243 N CYS E 58 9.740 26.055 22.933 1.00 4.78 N
|
|
ATOM 244 CA CYS E 58 8.917 24.910 22.475 1.00 5.61 C
|
|
ATOM 245 C CYS E 58 8.988 24.894 20.945 1.00 8.82 C
|
|
ATOM 246 O CYS E 58 9.004 23.803 20.339 1.00 9.29 O
|
|
ATOM 247 CB CYS E 58 7.424 25.025 22.857 1.00 5.53 C
|
|
ATOM 248 SG CYS E 58 7.339 24.747 24.738 1.00 7.92 S
|
|
ATOM 249 N THR E 59 8.882 26.099 20.363 1.00 5.27 N
|
|
ATOM 250 CA THR E 59 8.883 26.137 18.853 1.00 7.15 C
|
|
ATOM 251 C THR E 59 10.278 26.033 18.239 1.00 12.59 C
|
|
ATOM 252 O THR E 59 10.397 25.690 17.051 1.00 12.03 O
|
|
ATOM 253 CB THR E 59 8.104 27.424 18.338 1.00 8.11 C
|
|
ATOM 254 OG1 THR E 59 8.669 28.568 18.992 1.00 7.75 O
|
|
ATOM 255 CG2 THR E 59 6.581 27.413 18.410 1.00 8.91 C
|
|
ATOM 256 N ASP E 60 11.319 26.246 18.980 1.00 11.18 N
|
|
ATOM 257 CA ASP E 60 12.718 26.153 18.474 1.00 17.46 C
|
|
ATOM 258 C ASP E 60 12.925 24.681 18.087 1.00 19.71 C
|
|
ATOM 259 O ASP E 60 12.647 23.798 18.916 1.00 23.64 O
|
|
ATOM 260 CB ASP E 60 13.606 26.644 19.570 1.00 17.76 C
|
|
ATOM 261 CG ASP E 60 15.082 26.709 19.267 1.00 26.72 C
|
|
ATOM 262 OD1 ASP E 60 15.510 27.642 18.582 1.00 31.97 O
|
|
ATOM 263 OD2 ASP E 60 15.733 25.783 19.749 1.00 29.00 O
|
|
ATOM 264 N GLY E 62 13.309 24.447 16.864 1.00 24.78 N
|
|
ATOM 265 CA GLY E 62 13.542 23.051 16.414 1.00 25.99 C
|
|
ATOM 266 C GLY E 62 12.296 22.261 16.079 1.00 27.54 C
|
|
ATOM 267 O GLY E 62 12.446 21.192 15.422 1.00 30.88 O
|
|
ATOM 268 N ALA E 63 11.119 22.697 16.450 1.00 22.49 N
|
|
ATOM 269 CA ALA E 63 9.846 22.053 16.139 1.00 20.83 C
|
|
ATOM 270 C ALA E 63 9.281 22.522 14.796 1.00 19.21 C
|
|
ATOM 271 O ALA E 63 9.359 23.694 14.405 1.00 23.25 O
|
|
ATOM 272 CB ALA E 63 8.805 22.353 17.207 1.00 20.83 C
|
|
ATOM 273 N THR E 64 8.689 21.595 14.039 1.00 15.92 N
|
|
ATOM 274 CA THR E 64 8.073 21.906 12.772 1.00 13.99 C
|
|
ATOM 275 C THR E 64 6.577 21.666 12.899 1.00 16.03 C
|
|
ATOM 276 O THR E 64 5.828 22.631 12.795 1.00 17.39 O
|
|
ATOM 277 CB THR E 64 8.645 21.137 11.512 1.00 21.41 C
|
|
ATOM 278 OG1 THR E 64 8.267 19.753 11.775 1.00 23.08 O
|
|
ATOM 279 CG2 THR E 64 10.155 21.317 11.317 1.00 20.32 C
|
|
ATOM 280 N THR E 65 6.121 20.450 13.098 1.00 12.28 N
|
|
ATOM 281 CA THR E 65 4.705 20.118 13.198 1.00 11.60 C
|
|
ATOM 282 C THR E 65 4.221 19.998 14.648 1.00 7.88 C
|
|
ATOM 283 O THR E 65 5.063 19.562 15.437 1.00 13.25 O
|
|
ATOM 284 CB THR E 65 4.414 18.706 12.477 1.00 11.50 C
|
|
ATOM 285 OG1 THR E 65 4.834 18.978 11.102 1.00 26.00 O
|
|
ATOM 286 CG2 THR E 65 2.947 18.302 12.481 1.00 12.34 C
|
|
ATOM 287 N TRP E 66 2.978 20.390 14.852 1.00 9.83 N
|
|
ATOM 288 CA TRP E 66 2.330 20.249 16.175 1.00 9.41 C
|
|
ATOM 289 C TRP E 66 1.083 19.447 16.027 1.00 10.15 C
|
|
ATOM 290 O TRP E 66 0.352 19.627 15.031 1.00 11.87 O
|
|
ATOM 291 CB TRP E 66 1.945 21.666 16.725 1.00 11.92 C
|
|
ATOM 292 CG TRP E 66 3.205 22.391 17.059 1.00 7.22 C
|
|
ATOM 293 CD1 TRP E 66 3.981 23.160 16.246 1.00 8.32 C
|
|
ATOM 294 CD2 TRP E 66 3.896 22.288 18.330 1.00 13.92 C
|
|
ATOM 295 NE1 TRP E 66 5.097 23.602 16.952 1.00 8.88 N
|
|
ATOM 296 CE2 TRP E 66 5.049 23.078 18.215 1.00 11.32 C
|
|
ATOM 297 CE3 TRP E 66 3.579 21.666 19.530 1.00 11.11 C
|
|
ATOM 298 CZ2 TRP E 66 5.957 23.231 19.275 1.00 13.14 C
|
|
ATOM 299 CZ3 TRP E 66 4.487 21.764 20.574 1.00 9.31 C
|
|
ATOM 300 CH2 TRP E 66 5.638 22.555 20.446 1.00 13.01 C
|
|
ATOM 301 N TRP E 67 0.728 18.629 17.027 1.00 9.24 N
|
|
ATOM 302 CA TRP E 67 -0.459 17.833 17.091 1.00 8.46 C
|
|
ATOM 303 C TRP E 67 -1.217 18.084 18.430 1.00 11.59 C
|
|
ATOM 304 O TRP E 67 -0.522 18.542 19.363 1.00 6.69 O
|
|
ATOM 305 CB TRP E 67 -0.001 16.334 17.099 1.00 6.84 C
|
|
ATOM 306 CG TRP E 67 0.609 15.854 15.796 1.00 9.14 C
|
|
ATOM 307 CD1 TRP E 67 -0.039 15.227 14.756 1.00 14.28 C
|
|
ATOM 308 CD2 TRP E 67 1.980 15.898 15.445 1.00 8.70 C
|
|
ATOM 309 NE1 TRP E 67 0.863 14.933 13.752 1.00 12.18 N
|
|
ATOM 310 CE2 TRP E 67 2.126 15.260 14.170 1.00 8.67 C
|
|
ATOM 311 CE3 TRP E 67 3.143 16.280 16.115 1.00 10.75 C
|
|
ATOM 312 CZ2 TRP E 67 3.337 15.162 13.545 1.00 12.88 C
|
|
ATOM 313 CZ3 TRP E 67 4.363 16.165 15.473 1.00 12.18 C
|
|
ATOM 314 CH2 TRP E 67 4.468 15.625 14.198 1.00 18.82 C
|
|
ATOM 315 N ALA E 68 -2.468 17.752 18.430 1.00 10.67 N
|
|
ATOM 316 CA ALA E 68 -3.336 17.915 19.618 1.00 10.25 C
|
|
ATOM 317 C ALA E 68 -3.340 16.754 20.574 1.00 12.99 C
|
|
ATOM 318 O ALA E 68 -3.880 16.934 21.686 1.00 14.88 O
|
|
ATOM 319 CB ALA E 68 -4.772 18.188 19.096 1.00 11.33 C
|
|
ATOM 320 N ASN E 78 -2.793 15.604 20.195 1.00 14.01 N
|
|
ATOM 321 CA ASN E 78 -2.755 14.393 21.052 1.00 14.60 C
|
|
ATOM 322 C ASN E 78 -1.419 13.695 21.064 1.00 13.33 C
|
|
ATOM 323 O ASN E 78 -0.551 13.848 20.168 1.00 16.40 O
|
|
ATOM 324 CB ASN E 78 -3.927 13.483 20.634 1.00 21.51 C
|
|
ATOM 325 CG ASN E 78 -3.853 13.003 19.195 1.00 18.59 C
|
|
ATOM 326 OD1 ASN E 78 -3.216 13.592 18.307 1.00 15.35 O
|
|
ATOM 327 ND2 ASN E 78 -4.578 11.913 18.960 1.00 21.52 N
|
|
ATOM 328 N SER E 79 -1.193 12.894 22.112 1.00 17.83 N
|
|
ATOM 329 CA SER E 79 0.054 12.142 22.331 1.00 21.75 C
|
|
ATOM 330 C SER E 79 0.367 11.111 21.243 1.00 22.41 C
|
|
ATOM 331 O SER E 79 1.551 10.817 21.000 1.00 21.59 O
|
|
ATOM 332 CB SER E 79 0.093 11.378 23.650 1.00 25.98 C
|
|
ATOM 333 OG SER E 79 -1.163 10.784 23.917 1.00 34.32 O
|
|
ATOM 334 N ALA E 80 -0.675 10.604 20.642 1.00 22.50 N
|
|
ATOM 335 CA ALA E 80 -0.620 9.645 19.530 1.00 21.09 C
|
|
ATOM 336 C ALA E 80 -0.160 10.321 18.235 1.00 23.59 C
|
|
ATOM 337 O ALA E 80 0.168 9.666 17.227 1.00 18.43 O
|
|
ATOM 338 CB ALA E 80 -2.053 9.138 19.311 1.00 16.70 C
|
|
ATOM 339 N ARG E 81 -0.175 11.662 18.263 1.00 21.64 N
|
|
ATOM 340 CA ARG E 81 0.208 12.474 17.107 1.00 17.25 C
|
|
ATOM 341 C ARG E 81 -0.707 12.103 15.936 1.00 20.04 C
|
|
ATOM 342 O ARG E 81 -0.158 11.945 14.832 1.00 25.27 O
|
|
ATOM 343 CB ARG E 81 1.624 12.343 16.593 1.00 24.66 C
|
|
ATOM 344 CG ARG E 81 2.772 13.025 17.298 1.00 27.47 C
|
|
ATOM 345 CD ARG E 81 2.712 13.008 18.777 1.00 28.09 C
|
|
ATOM 346 NE ARG E 81 4.006 13.428 19.375 1.00 25.60 N
|
|
ATOM 347 CZ ARG E 81 4.244 13.254 20.678 1.00 32.32 C
|
|
ATOM 348 NH1 ARG E 81 3.483 12.480 21.463 1.00 28.59 N
|
|
ATOM 349 NH2 ARG E 81 5.219 13.914 21.335 1.00 30.58 N
|
|
ATOM 350 N THR E 82 -1.995 12.043 16.179 1.00 17.58 N
|
|
ATOM 351 CA THR E 82 -2.888 11.705 15.067 1.00 20.55 C
|
|
ATOM 352 C THR E 82 -3.727 12.856 14.589 1.00 21.16 C
|
|
ATOM 353 O THR E 82 -4.321 12.779 13.485 1.00 24.13 O
|
|
ATOM 354 CB THR E 82 -3.710 10.381 15.362 1.00 22.98 C
|
|
ATOM 355 OG1 THR E 82 -4.812 10.751 16.270 1.00 23.94 O
|
|
ATOM 356 CG2 THR E 82 -2.812 9.236 15.800 1.00 26.14 C
|
|
ATOM 357 N THR E 83 -3.889 13.897 15.390 1.00 18.86 N
|
|
ATOM 358 CA THR E 83 -4.684 15.069 15.027 1.00 15.43 C
|
|
ATOM 359 C THR E 83 -3.706 16.247 14.852 1.00 15.19 C
|
|
ATOM 360 O THR E 83 -3.184 16.699 15.872 1.00 10.04 O
|
|
ATOM 361 CB THR E 83 -5.759 15.424 16.131 1.00 19.87 C
|
|
ATOM 362 OG1 THR E 83 -6.508 14.186 16.302 1.00 24.11 O
|
|
ATOM 363 CG2 THR E 83 -6.474 16.732 15.868 1.00 22.86 C
|
|
ATOM 364 N VAL E 84 -3.539 16.710 13.644 1.00 13.17 N
|
|
ATOM 365 CA VAL E 84 -2.611 17.779 13.345 1.00 15.68 C
|
|
ATOM 366 C VAL E 84 -3.211 19.104 13.804 1.00 12.88 C
|
|
ATOM 367 O VAL E 84 -4.456 19.235 13.824 1.00 20.81 O
|
|
ATOM 368 CB VAL E 84 -2.188 17.757 11.859 1.00 19.42 C
|
|
ATOM 369 CG1 VAL E 84 -1.066 18.766 11.596 1.00 24.00 C
|
|
ATOM 370 CG2 VAL E 84 -1.561 16.400 11.508 1.00 20.37 C
|
|
ATOM 371 N LEU E 85 -2.332 19.998 14.226 1.00 11.43 N
|
|
ATOM 372 CA LEU E 85 -2.743 21.355 14.573 1.00 11.92 C
|
|
ATOM 373 C LEU E 85 -2.219 22.271 13.481 1.00 9.27 C
|
|
ATOM 374 O LEU E 85 -3.058 23.002 12.871 1.00 13.38 O
|
|
ATOM 375 CB LEU E 85 -2.305 21.813 15.987 1.00 11.39 C
|
|
ATOM 376 CG LEU E 85 -3.078 21.137 17.135 1.00 11.32 C
|
|
ATOM 377 CD1 LEU E 85 -2.312 21.557 18.402 1.00 9.67 C
|
|
ATOM 378 CD2 LEU E 85 -4.520 21.606 17.103 1.00 8.25 C
|
|
ATOM 379 N GLY E 86 -0.908 22.271 13.302 1.00 13.77 N
|
|
ATOM 380 CA GLY E 86 -0.318 23.122 12.269 1.00 11.52 C
|
|
ATOM 381 C GLY E 86 1.204 23.089 12.281 1.00 11.65 C
|
|
ATOM 382 O GLY E 86 1.749 22.135 12.839 1.00 13.31 O
|
|
ATOM 383 N THR E 87 1.842 24.060 11.676 1.00 11.29 N
|
|
ATOM 384 CA THR E 87 3.278 24.141 11.588 1.00 10.19 C
|
|
ATOM 385 C THR E 87 3.843 25.488 12.054 1.00 9.83 C
|
|
ATOM 386 O THR E 87 3.177 26.508 11.851 1.00 10.12 O
|
|
ATOM 387 CB THR E 87 3.716 23.874 10.066 1.00 16.31 C
|
|
ATOM 388 OG1 THR E 87 2.909 24.867 9.361 1.00 26.15 O
|
|
ATOM 389 CG2 THR E 87 3.270 22.468 9.624 1.00 22.57 C
|
|
ATOM 390 N THR E 88 4.988 25.363 12.700 1.00 10.04 N
|
|
ATOM 391 CA THR E 88 5.662 26.557 13.230 1.00 9.75 C
|
|
ATOM 392 C THR E 88 5.948 27.598 12.134 1.00 14.75 C
|
|
ATOM 393 O THR E 88 6.543 27.211 11.118 1.00 8.64 O
|
|
ATOM 394 CB THR E 88 7.021 26.186 13.923 1.00 16.11 C
|
|
ATOM 395 OG1 THR E 88 6.633 25.096 14.836 1.00 12.93 O
|
|
ATOM 396 CG2 THR E 88 7.649 27.385 14.593 1.00 11.97 C
|
|
ATOM 397 N SER E 89 5.525 28.787 12.413 1.00 10.03 N
|
|
ATOM 398 CA SER E 89 5.699 29.942 11.516 1.00 9.11 C
|
|
ATOM 399 C SER E 89 6.745 30.907 12.030 1.00 10.17 C
|
|
ATOM 400 O SER E 89 7.270 31.731 11.229 1.00 9.91 O
|
|
ATOM 401 CB SER E 89 4.372 30.646 11.229 1.00 12.82 C
|
|
ATOM 402 OG SER E 89 3.495 29.784 10.544 1.00 22.28 O
|
|
ATOM 403 N GLY E 90 7.069 30.864 13.349 1.00 5.57 N
|
|
ATOM 404 CA GLY E 90 8.079 31.796 13.808 1.00 8.82 C
|
|
ATOM 405 C GLY E 90 8.510 31.387 15.226 1.00 7.71 C
|
|
ATOM 406 O GLY E 90 7.691 30.695 15.856 1.00 11.44 O
|
|
ATOM 407 N SER E 91 9.735 31.752 15.493 1.00 9.12 N
|
|
ATOM 408 CA SER E 91 10.264 31.409 16.860 1.00 9.49 C
|
|
ATOM 409 C SER E 91 11.315 32.385 17.267 1.00 13.87 C
|
|
ATOM 410 O SER E 91 12.290 32.750 16.537 1.00 9.99 O
|
|
ATOM 411 CB SER E 91 10.692 29.964 16.808 1.00 10.40 C
|
|
ATOM 412 OG SER E 91 11.329 29.517 17.972 1.00 18.23 O
|
|
ATOM 413 N SER E 93 11.165 32.843 18.518 1.00 10.46 N
|
|
ATOM 414 CA SER E 93 12.132 33.791 19.108 1.00 10.17 C
|
|
ATOM 415 C SER E 93 12.568 33.295 20.494 1.00 12.08 C
|
|
ATOM 416 O SER E 93 11.779 33.470 21.435 1.00 12.26 O
|
|
ATOM 417 CB SER E 93 11.534 35.193 19.163 1.00 10.42 C
|
|
ATOM 418 OG SER E 93 12.625 36.065 19.450 1.00 15.58 O
|
|
ATOM 419 N PHE E 94 13.709 32.636 20.522 1.00 8.55 N
|
|
ATOM 420 CA PHE E 94 14.284 32.140 21.797 1.00 9.91 C
|
|
ATOM 421 C PHE E 94 15.764 31.851 21.534 1.00 12.44 C
|
|
ATOM 422 O PHE E 94 16.053 31.207 20.506 1.00 12.59 O
|
|
ATOM 423 CB PHE E 94 13.575 30.853 22.272 1.00 8.94 C
|
|
ATOM 424 CG PHE E 94 14.186 30.259 23.515 1.00 10.44 C
|
|
ATOM 425 CD1 PHE E 94 13.831 30.760 24.766 1.00 8.53 C
|
|
ATOM 426 CD2 PHE E 94 15.124 29.245 23.419 1.00 8.70 C
|
|
ATOM 427 CE1 PHE E 94 14.419 30.253 25.954 1.00 9.81 C
|
|
ATOM 428 CE2 PHE E 94 15.777 28.743 24.563 1.00 11.57 C
|
|
ATOM 429 CZ PHE E 94 15.343 29.223 25.818 1.00 5.10 C
|
|
ATOM 430 N PRO E 99A 16.692 32.167 22.399 1.00 13.89 N
|
|
ATOM 431 CA PRO E 99A 16.505 32.876 23.674 1.00 10.14 C
|
|
ATOM 432 C PRO E 99A 16.355 34.369 23.431 1.00 8.67 C
|
|
ATOM 433 O PRO E 99A 15.954 34.795 22.323 1.00 9.56 O
|
|
ATOM 434 CB PRO E 99A 17.793 32.445 24.388 1.00 11.23 C
|
|
ATOM 435 CG PRO E 99A 18.875 32.467 23.328 1.00 10.72 C
|
|
ATOM 436 CD PRO E 99A 18.113 31.818 22.160 1.00 12.40 C
|
|
ATOM 437 N ASN E 100 16.698 35.182 24.423 1.00 10.55 N
|
|
ATOM 438 CA ASN E 100 16.566 36.659 24.336 1.00 10.80 C
|
|
ATOM 439 C ASN E 100 15.099 36.926 24.607 1.00 9.27 C
|
|
ATOM 440 O ASN E 100 14.829 37.608 25.619 1.00 13.19 O
|
|
ATOM 441 CB ASN E 100 17.127 37.379 23.128 1.00 13.68 C
|
|
ATOM 442 CG ASN E 100 18.529 36.959 22.706 1.00 31.46 C
|
|
ATOM 443 OD1 ASN E 100 19.445 36.888 23.543 1.00 37.07 O
|
|
ATOM 444 ND2 ASN E 100 18.718 36.676 21.411 1.00 34.36 N
|
|
ATOM 445 N ASN E 101 14.197 36.501 23.714 1.00 8.99 N
|
|
ATOM 446 CA ASN E 101 12.758 36.539 23.985 1.00 8.23 C
|
|
ATOM 447 C ASN E 101 12.357 35.056 24.296 1.00 6.61 C
|
|
ATOM 448 O ASN E 101 13.257 34.206 24.220 1.00 8.61 O
|
|
ATOM 449 CB ASN E 101 11.900 37.068 22.825 1.00 9.17 C
|
|
ATOM 450 CG ASN E 101 12.347 38.458 22.415 1.00 14.99 C
|
|
ATOM 451 OD1 ASN E 101 12.331 39.374 23.248 1.00 14.79 O
|
|
ATOM 452 ND2 ASN E 101 12.695 38.649 21.144 1.00 15.65 N
|
|
ATOM 453 N ASP E 102 11.044 34.849 24.463 1.00 5.85 N
|
|
ATOM 454 CA ASP E 102 10.571 33.448 24.547 1.00 7.78 C
|
|
ATOM 455 C ASP E 102 9.177 33.404 24.005 1.00 6.13 C
|
|
ATOM 456 O ASP E 102 8.197 33.263 24.778 1.00 6.03 O
|
|
ATOM 457 CB ASP E 102 10.715 32.936 26.009 1.00 4.50 C
|
|
ATOM 458 CG ASP E 102 10.675 31.420 26.073 1.00 11.75 C
|
|
ATOM 459 OD1 ASP E 102 10.903 30.793 27.117 1.00 9.40 O
|
|
ATOM 460 OD2 ASP E 102 10.414 30.782 25.021 1.00 6.82 O
|
|
ATOM 461 N TYR E 103 8.935 33.497 22.686 1.00 5.04 N
|
|
ATOM 462 CA TYR E 103 7.652 33.372 22.060 1.00 5.76 C
|
|
ATOM 463 C TYR E 103 7.851 32.712 20.658 1.00 2.72 C
|
|
ATOM 464 O TYR E 103 8.977 32.821 20.160 1.00 4.85 O
|
|
ATOM 465 CB TYR E 103 6.840 34.658 22.036 1.00 7.10 C
|
|
ATOM 466 CG TYR E 103 7.558 35.771 21.287 1.00 7.90 C
|
|
ATOM 467 CD1 TYR E 103 8.028 36.899 21.989 1.00 10.39 C
|
|
ATOM 468 CD2 TYR E 103 7.716 35.722 19.901 1.00 8.31 C
|
|
ATOM 469 CE1 TYR E 103 8.706 37.913 21.319 1.00 13.97 C
|
|
ATOM 470 CE2 TYR E 103 8.392 36.746 19.227 1.00 11.25 C
|
|
ATOM 471 CZ TYR E 103 8.821 37.853 19.920 1.00 15.37 C
|
|
ATOM 472 OH TYR E 103 9.447 38.889 19.271 1.00 14.25 O
|
|
ATOM 473 N GLY E 104 6.832 31.998 20.299 1.00 5.52 N
|
|
ATOM 474 CA GLY E 104 6.772 31.311 18.944 1.00 7.20 C
|
|
ATOM 475 C GLY E 104 5.310 31.382 18.534 1.00 8.99 C
|
|
ATOM 476 O GLY E 104 4.330 31.551 19.323 1.00 5.53 O
|
|
ATOM 477 N ILE E 105 5.055 31.044 17.255 1.00 5.46 N
|
|
ATOM 478 CA ILE E 105 3.722 31.120 16.693 1.00 5.29 C
|
|
ATOM 479 C ILE E 105 3.619 29.942 15.645 1.00 4.62 C
|
|
ATOM 480 O ILE E 105 4.614 29.664 14.983 1.00 5.66 O
|
|
ATOM 481 CB ILE E 105 3.466 32.516 16.023 1.00 8.00 C
|
|
ATOM 482 CG1 ILE E 105 1.997 32.587 15.601 1.00 6.98 C
|
|
ATOM 483 CG2 ILE E 105 4.506 32.696 14.804 1.00 7.50 C
|
|
ATOM 484 CD1 ILE E 105 1.523 34.010 15.151 1.00 12.10 C
|
|
ATOM 485 N VAL E 106 2.464 29.359 15.748 1.00 7.69 N
|
|
ATOM 486 CA VAL E 106 2.129 28.181 14.919 1.00 6.32 C
|
|
ATOM 487 C VAL E 106 0.902 28.498 14.087 1.00 8.72 C
|
|
ATOM 488 O VAL E 106 -0.178 28.847 14.609 1.00 9.78 O
|
|
ATOM 489 CB VAL E 106 1.829 26.966 15.804 1.00 6.84 C
|
|
ATOM 490 CG1 VAL E 106 1.499 25.706 14.999 1.00 9.26 C
|
|
ATOM 491 CG2 VAL E 106 3.006 26.579 16.709 1.00 6.95 C
|
|
ATOM 492 N ARG E 107 1.055 28.203 12.791 1.00 12.25 N
|
|
ATOM 493 CA ARG E 107 -0.079 28.438 11.867 1.00 12.97 C
|
|
ATOM 494 C ARG E 107 -0.985 27.227 11.783 1.00 12.48 C
|
|
ATOM 495 O ARG E 107 -0.495 26.088 11.516 1.00 14.89 O
|
|
ATOM 496 CB ARG E 107 0.489 28.814 10.476 1.00 17.05 C
|
|
ATOM 497 CG ARG E 107 -0.658 29.201 9.552 1.00 21.11 C
|
|
ATOM 498 CD ARG E 107 -0.184 29.664 8.201 1.00 31.53 C
|
|
ATOM 499 NE ARG E 107 0.742 28.688 7.631 1.00 36.68 N
|
|
ATOM 500 CZ ARG E 107 0.327 27.565 7.017 1.00 42.08 C
|
|
ATOM 501 NH1 ARG E 107 -0.968 27.391 6.754 1.00 36.18 N
|
|
ATOM 502 NH2 ARG E 107 1.254 26.638 6.746 1.00 37.06 N
|
|
ATOM 503 N TYR E 108 -2.274 27.396 12.062 1.00 12.66 N
|
|
ATOM 504 CA TYR E 108 -3.220 26.273 12.034 1.00 13.18 C
|
|
ATOM 505 C TYR E 108 -3.312 25.744 10.568 1.00 13.86 C
|
|
ATOM 506 O TYR E 108 -3.262 26.595 9.667 1.00 13.97 O
|
|
ATOM 507 CB TYR E 108 -4.624 26.731 12.461 1.00 12.64 C
|
|
ATOM 508 CG TYR E 108 -4.795 26.682 13.967 1.00 15.06 C
|
|
ATOM 509 CD1 TYR E 108 -4.712 27.854 14.720 1.00 15.32 C
|
|
ATOM 510 CD2 TYR E 108 -5.101 25.472 14.573 1.00 17.88 C
|
|
ATOM 511 CE1 TYR E 108 -4.925 27.794 16.115 1.00 12.80 C
|
|
ATOM 512 CE2 TYR E 108 -5.341 25.385 15.959 1.00 18.41 C
|
|
ATOM 513 CZ TYR E 108 -5.198 26.551 16.701 1.00 19.28 C
|
|
ATOM 514 OH TYR E 108 -5.383 26.464 18.064 1.00 12.95 O
|
|
ATOM 515 N THR E 109 -3.261 24.430 10.476 1.00 17.56 N
|
|
ATOM 516 CA THR E 109 -3.412 23.760 9.181 1.00 20.13 C
|
|
ATOM 517 C THR E 109 -4.647 22.871 9.305 1.00 21.11 C
|
|
ATOM 518 O THR E 109 -5.104 22.342 8.289 1.00 23.45 O
|
|
ATOM 519 CB THR E 109 -2.196 22.937 8.627 1.00 20.95 C
|
|
ATOM 520 OG1 THR E 109 -1.877 21.939 9.639 1.00 21.62 O
|
|
ATOM 521 CG2 THR E 109 -0.939 23.754 8.285 1.00 21.24 C
|
|
ATOM 522 N ASN E 110 -5.170 22.669 10.500 1.00 19.13 N
|
|
ATOM 523 CA ASN E 110 -6.355 21.846 10.771 1.00 18.49 C
|
|
ATOM 524 C ASN E 110 -7.624 22.691 10.624 1.00 24.51 C
|
|
ATOM 525 O ASN E 110 -7.821 23.683 11.341 1.00 22.92 O
|
|
ATOM 526 CB ASN E 110 -6.196 21.208 12.142 1.00 22.26 C
|
|
ATOM 527 CG ASN E 110 -7.346 20.341 12.560 1.00 19.84 C
|
|
ATOM 528 OD1 ASN E 110 -7.222 19.306 13.222 1.00 29.21 O
|
|
ATOM 529 ND2 ASN E 110 -8.525 20.767 12.106 1.00 21.03 N
|
|
ATOM 530 N THR E 111 -8.504 22.282 9.715 1.00 27.61 N
|
|
ATOM 531 CA THR E 111 -9.737 22.953 9.357 1.00 28.90 C
|
|
ATOM 532 C THR E 111 -10.959 22.642 10.221 1.00 29.56 C
|
|
ATOM 533 O THR E 111 -11.852 23.509 10.269 1.00 33.89 O
|
|
ATOM 534 CB THR E 111 -10.129 22.746 7.818 1.00 28.35 C
|
|
ATOM 535 OG1 THR E 111 -10.271 21.296 7.651 1.00 33.84 O
|
|
ATOM 536 CG2 THR E 111 -9.100 23.302 6.830 1.00 25.58 C
|
|
ATOM 537 N THR E 112 -11.033 21.492 10.839 1.00 30.50 N
|
|
ATOM 538 CA THR E 112 -12.149 21.083 11.668 1.00 31.89 C
|
|
ATOM 539 C THR E 112 -12.050 21.497 13.138 1.00 31.37 C
|
|
ATOM 540 O THR E 112 -13.083 21.890 13.704 1.00 32.54 O
|
|
ATOM 541 CB THR E 112 -12.370 19.518 11.544 1.00 35.71 C
|
|
ATOM 542 OG1 THR E 112 -11.047 18.902 11.628 1.00 36.53 O
|
|
ATOM 543 CG2 THR E 112 -13.097 19.137 10.249 1.00 38.39 C
|
|
ATOM 544 N ILE E 113 -10.870 21.410 13.720 1.00 28.94 N
|
|
ATOM 545 CA ILE E 113 -10.710 21.715 15.170 1.00 24.37 C
|
|
ATOM 546 C ILE E 113 -11.189 23.122 15.509 1.00 21.60 C
|
|
ATOM 547 O ILE E 113 -10.826 24.087 14.836 1.00 22.11 O
|
|
ATOM 548 CB ILE E 113 -9.209 21.421 15.545 1.00 23.11 C
|
|
ATOM 549 CG1 ILE E 113 -9.092 20.952 17.015 1.00 26.07 C
|
|
ATOM 550 CG2 ILE E 113 -8.248 22.599 15.270 1.00 24.79 C
|
|
ATOM 551 CD1 ILE E 113 -7.675 20.521 17.474 1.00 26.05 C
|
|
ATOM 552 N PRO E 114 -12.006 23.220 16.549 1.00 23.16 N
|
|
ATOM 553 CA PRO E 114 -12.507 24.523 17.039 1.00 23.03 C
|
|
ATOM 554 C PRO E 114 -11.304 25.286 17.621 1.00 20.76 C
|
|
ATOM 555 O PRO E 114 -10.409 24.648 18.187 1.00 17.58 O
|
|
ATOM 556 CB PRO E 114 -13.548 24.169 18.099 1.00 25.33 C
|
|
ATOM 557 CG PRO E 114 -13.579 22.680 18.243 1.00 22.92 C
|
|
ATOM 558 CD PRO E 114 -12.442 22.102 17.410 1.00 22.99 C
|
|
ATOM 559 N LYS E 115 -11.207 26.562 17.310 1.00 21.89 N
|
|
ATOM 560 CA LYS E 115 -10.121 27.445 17.737 1.00 18.99 C
|
|
ATOM 561 C LYS E 115 -10.670 28.568 18.613 1.00 17.89 C
|
|
ATOM 562 O LYS E 115 -10.808 29.741 18.211 1.00 18.18 O
|
|
ATOM 563 CB LYS E 115 -9.399 28.034 16.509 1.00 19.43 C
|
|
ATOM 564 CG LYS E 115 -8.705 26.949 15.657 1.00 23.10 C
|
|
ATOM 565 CD LYS E 115 -8.558 27.429 14.226 1.00 26.90 C
|
|
ATOM 566 CE LYS E 115 -8.135 26.371 13.226 1.00 29.23 C
|
|
ATOM 567 NZ LYS E 115 -9.226 25.385 12.987 1.00 30.12 N
|
|
ATOM 568 N ASP E 116 -11.034 28.170 19.817 1.00 17.57 N
|
|
ATOM 569 CA ASP E 116 -11.643 29.070 20.825 1.00 16.10 C
|
|
ATOM 570 C ASP E 116 -10.729 30.210 21.275 1.00 14.71 C
|
|
ATOM 571 O ASP E 116 -9.563 29.981 21.566 1.00 12.31 O
|
|
ATOM 572 CB ASP E 116 -12.137 28.247 21.969 1.00 20.85 C
|
|
ATOM 573 CG ASP E 116 -13.252 27.276 21.626 1.00 32.16 C
|
|
ATOM 574 OD1 ASP E 116 -13.918 27.385 20.586 1.00 33.02 O
|
|
ATOM 575 OD2 ASP E 116 -13.390 26.382 22.491 1.00 32.74 O
|
|
ATOM 576 N GLY E 117 -11.347 31.376 21.399 1.00 15.16 N
|
|
ATOM 577 CA GLY E 117 -10.656 32.608 21.817 1.00 12.28 C
|
|
ATOM 578 C GLY E 117 -10.774 32.712 23.351 1.00 15.47 C
|
|
ATOM 579 O GLY E 117 -11.195 33.770 23.854 1.00 16.03 O
|
|
ATOM 580 N THR E 118 -10.457 31.605 23.977 1.00 14.10 N
|
|
ATOM 581 CA THR E 118 -10.558 31.507 25.440 1.00 14.03 C
|
|
ATOM 582 C THR E 118 -9.362 30.787 26.009 1.00 13.07 C
|
|
ATOM 583 O THR E 118 -8.480 30.302 25.284 1.00 15.30 O
|
|
ATOM 584 CB THR E 118 -11.866 30.684 25.866 1.00 15.93 C
|
|
ATOM 585 OG1 THR E 118 -11.588 29.261 25.571 1.00 19.03 O
|
|
ATOM 586 CG2 THR E 118 -13.164 31.109 25.185 1.00 13.38 C
|
|
ATOM 587 N VAL E 119 -9.348 30.782 27.340 1.00 11.91 N
|
|
ATOM 588 CA VAL E 119 -8.372 30.057 28.149 1.00 10.44 C
|
|
ATOM 589 C VAL E 119 -9.271 29.086 28.946 1.00 12.13 C
|
|
ATOM 590 O VAL E 119 -9.914 29.523 29.927 1.00 11.02 O
|
|
ATOM 591 CB VAL E 119 -7.521 30.956 29.054 1.00 7.58 C
|
|
ATOM 592 CG1 VAL E 119 -6.610 30.057 29.923 1.00 8.81 C
|
|
ATOM 593 CG2 VAL E 119 -6.686 31.949 28.273 1.00 11.35 C
|
|
ATOM 594 N GLY E 120 -9.305 27.827 28.480 1.00 12.67 N
|
|
ATOM 595 CA GLY E 120 -10.218 26.878 29.213 1.00 14.16 C
|
|
ATOM 596 C GLY E 120 -11.572 27.571 28.966 1.00 20.13 C
|
|
ATOM 597 O GLY E 120 -11.806 28.040 27.819 1.00 21.82 O
|
|
ATOM 598 N GLY E 121 -12.469 27.582 29.915 1.00 19.82 N
|
|
ATOM 599 CA GLY E 121 -13.743 28.301 29.508 1.00 24.79 C
|
|
ATOM 600 C GLY E 121 -13.687 29.822 29.464 1.00 23.61 C
|
|
ATOM 601 O GLY E 121 -14.703 30.466 29.050 1.00 26.17 O
|
|
ATOM 602 N GLN E 122 -12.599 30.439 29.895 1.00 18.45 N
|
|
ATOM 603 CA GLN E 122 -12.542 31.900 30.086 1.00 17.05 C
|
|
ATOM 604 C GLN E 122 -12.332 32.788 28.898 1.00 15.32 C
|
|
ATOM 605 O GLN E 122 -11.269 32.728 28.261 1.00 13.28 O
|
|
ATOM 606 CB GLN E 122 -11.558 32.150 31.261 1.00 14.59 C
|
|
ATOM 607 CG GLN E 122 -11.150 33.601 31.481 1.00 21.08 C
|
|
ATOM 608 CD GLN E 122 -12.237 34.484 32.046 1.00 26.47 C
|
|
ATOM 609 OE1 GLN E 122 -12.946 34.075 32.959 1.00 29.67 O
|
|
ATOM 610 NE2 GLN E 122 -12.422 35.672 31.477 1.00 26.76 N
|
|
ATOM 611 N ASP E 123 -13.257 33.742 28.719 1.00 13.53 N
|
|
ATOM 612 CA ASP E 123 -13.146 34.680 27.579 1.00 15.41 C
|
|
ATOM 613 C ASP E 123 -11.955 35.607 27.655 1.00 14.33 C
|
|
ATOM 614 O ASP E 123 -11.613 36.098 28.755 1.00 13.72 O
|
|
ATOM 615 CB ASP E 123 -14.491 35.438 27.528 1.00 18.76 C
|
|
ATOM 616 CG ASP E 123 -14.653 36.043 26.137 1.00 33.21 C
|
|
ATOM 617 OD1 ASP E 123 -15.071 37.210 26.057 1.00 40.82 O
|
|
ATOM 618 OD2 ASP E 123 -14.340 35.280 25.196 1.00 33.90 O
|
|
ATOM 619 N ILE E 124 -11.270 35.847 26.583 1.00 11.41 N
|
|
ATOM 620 CA ILE E 124 -10.105 36.741 26.480 1.00 11.55 C
|
|
ATOM 621 C ILE E 124 -10.476 37.793 25.424 1.00 12.73 C
|
|
ATOM 622 O ILE E 124 -10.902 37.324 24.360 1.00 15.46 O
|
|
ATOM 623 CB ILE E 124 -8.806 35.978 26.069 1.00 12.60 C
|
|
ATOM 624 CG1 ILE E 124 -8.363 35.067 27.249 1.00 13.28 C
|
|
ATOM 625 CG2 ILE E 124 -7.729 36.975 25.579 1.00 15.40 C
|
|
ATOM 626 CD1 ILE E 124 -7.846 35.814 28.524 1.00 14.87 C
|
|
ATOM 627 N THR E 125 -10.423 39.058 25.766 1.00 12.70 N
|
|
ATOM 628 CA THR E 125 -10.902 40.067 24.790 1.00 16.26 C
|
|
ATOM 629 C THR E 125 -9.876 41.097 24.463 1.00 17.43 C
|
|
ATOM 630 O THR E 125 -10.124 41.866 23.503 1.00 19.55 O
|
|
ATOM 631 CB THR E 125 -12.211 40.737 25.404 1.00 18.76 C
|
|
ATOM 632 OG1 THR E 125 -11.717 41.533 26.531 1.00 21.96 O
|
|
ATOM 633 CG2 THR E 125 -13.291 39.751 25.834 1.00 23.07 C
|
|
ATOM 634 N SER E 126 -8.796 41.239 25.200 1.00 16.71 N
|
|
ATOM 635 CA SER E 126 -7.740 42.209 24.957 1.00 14.38 C
|
|
ATOM 636 C SER E 126 -6.430 41.708 25.543 1.00 12.22 C
|
|
ATOM 637 O SER E 126 -6.371 40.666 26.185 1.00 14.94 O
|
|
ATOM 638 CB SER E 126 -8.049 43.600 25.551 1.00 18.73 C
|
|
ATOM 639 OG SER E 126 -8.123 43.403 26.974 1.00 18.33 O
|
|
ATOM 640 N ALA E 127 -5.381 42.438 25.248 1.00 11.28 N
|
|
ATOM 641 CA ALA E 127 -4.025 42.155 25.734 1.00 13.10 C
|
|
ATOM 642 C ALA E 127 -3.655 43.371 26.591 1.00 13.02 C
|
|
ATOM 643 O ALA E 127 -4.115 44.488 26.229 1.00 15.84 O
|
|
ATOM 644 CB ALA E 127 -3.063 41.855 24.631 1.00 11.62 C
|
|
ATOM 645 N ALA E 128 -2.899 43.196 27.639 1.00 11.75 N
|
|
ATOM 646 CA ALA E 128 -2.547 44.319 28.536 1.00 11.53 C
|
|
ATOM 647 C ALA E 128 -1.127 44.178 29.022 1.00 16.20 C
|
|
ATOM 648 O ALA E 128 -0.623 43.027 28.898 1.00 12.15 O
|
|
ATOM 649 CB ALA E 128 -3.611 44.401 29.644 1.00 9.93 C
|
|
ATOM 650 N ASN E 129 -0.528 45.235 29.580 1.00 12.93 N
|
|
ATOM 651 CA ASN E 129 0.852 45.044 30.090 1.00 13.41 C
|
|
ATOM 652 C ASN E 129 0.742 44.663 31.584 1.00 9.53 C
|
|
ATOM 653 O ASN E 129 -0.227 45.148 32.158 1.00 8.23 O
|
|
ATOM 654 CB ASN E 129 1.792 46.211 29.835 1.00 23.00 C
|
|
ATOM 655 CG ASN E 129 2.208 46.211 28.352 1.00 29.63 C
|
|
ATOM 656 OD1 ASN E 129 2.865 45.273 27.858 1.00 32.77 O
|
|
ATOM 657 ND2 ASN E 129 1.764 47.280 27.711 1.00 29.65 N
|
|
ATOM 658 N ALA E 130 1.662 43.823 31.999 1.00 11.97 N
|
|
ATOM 659 CA ALA E 130 1.625 43.431 33.453 1.00 12.15 C
|
|
ATOM 660 C ALA E 130 2.103 44.641 34.254 1.00 10.49 C
|
|
ATOM 661 O ALA E 130 2.886 45.453 33.752 1.00 9.38 O
|
|
ATOM 662 CB ALA E 130 2.599 42.286 33.624 1.00 11.02 C
|
|
ATOM 663 N THR E 131 1.664 44.706 35.509 1.00 6.62 N
|
|
ATOM 664 CA THR E 131 2.122 45.742 36.442 1.00 6.66 C
|
|
ATOM 665 C THR E 131 2.449 45.055 37.757 1.00 8.17 C
|
|
ATOM 666 O THR E 131 1.826 43.998 38.052 1.00 5.23 O
|
|
ATOM 667 CB THR E 131 0.972 46.838 36.561 1.00 7.35 C
|
|
ATOM 668 OG1 THR E 131 -0.232 46.140 36.996 1.00 6.30 O
|
|
ATOM 669 CG2 THR E 131 0.820 47.640 35.258 1.00 10.68 C
|
|
ATOM 670 N VAL E 132 3.334 45.650 38.534 1.00 7.44 N
|
|
ATOM 671 CA VAL E 132 3.640 45.006 39.853 1.00 9.29 C
|
|
ATOM 672 C VAL E 132 2.372 45.017 40.718 1.00 8.81 C
|
|
ATOM 673 O VAL E 132 1.697 46.058 40.742 1.00 9.52 O
|
|
ATOM 674 CB VAL E 132 4.870 45.720 40.427 1.00 10.07 C
|
|
ATOM 675 CG1 VAL E 132 5.064 45.306 41.897 1.00 14.59 C
|
|
ATOM 676 CG2 VAL E 132 6.127 45.546 39.622 1.00 17.29 C
|
|
ATOM 677 N GLY E 133 2.018 43.889 41.343 1.00 7.90 N
|
|
ATOM 678 CA GLY E 133 0.770 43.856 42.156 1.00 6.78 C
|
|
ATOM 679 C GLY E 133 -0.441 43.305 41.443 1.00 4.66 C
|
|
ATOM 680 O GLY E 133 -1.483 43.011 42.049 1.00 7.36 O
|
|
ATOM 681 N MET E 134 -0.389 43.114 40.116 1.00 5.04 N
|
|
ATOM 682 CA MET E 134 -1.517 42.629 39.335 1.00 4.45 C
|
|
ATOM 683 C MET E 134 -1.799 41.119 39.678 1.00 6.92 C
|
|
ATOM 684 O MET E 134 -0.882 40.378 39.821 1.00 11.19 O
|
|
ATOM 685 CB MET E 134 -1.201 42.793 37.829 1.00 7.03 C
|
|
ATOM 686 CG MET E 134 -2.438 42.400 37.048 1.00 8.58 C
|
|
ATOM 687 SD MET E 134 -1.951 42.308 35.234 1.00 13.14 S
|
|
ATOM 688 CE MET E 134 -2.300 44.003 34.772 1.00 14.34 C
|
|
ATOM 689 N ALA E 135 -3.073 40.868 39.960 1.00 5.79 N
|
|
ATOM 690 CA ALA E 135 -3.526 39.483 40.219 1.00 2.98 C
|
|
ATOM 691 C ALA E 135 -3.638 38.846 38.821 1.00 4.15 C
|
|
ATOM 692 O ALA E 135 -4.289 39.402 37.908 1.00 8.38 O
|
|
ATOM 693 CB ALA E 135 -4.909 39.582 40.893 1.00 7.74 C
|
|
ATOM 694 N VAL E 136 -3.022 37.684 38.701 1.00 7.26 N
|
|
ATOM 695 CA VAL E 136 -2.995 36.975 37.378 1.00 5.39 C
|
|
ATOM 696 C VAL E 136 -3.266 35.487 37.653 1.00 7.20 C
|
|
ATOM 697 O VAL E 136 -3.265 34.936 38.737 1.00 8.04 O
|
|
ATOM 698 CB VAL E 136 -1.593 37.194 36.769 1.00 5.92 C
|
|
ATOM 699 CG1 VAL E 136 -1.283 38.622 36.247 1.00 5.26 C
|
|
ATOM 700 CG2 VAL E 136 -0.513 36.670 37.733 1.00 7.67 C
|
|
ATOM 701 N THR E 137 -3.521 34.811 36.510 1.00 4.61 N
|
|
ATOM 702 CA THR E 137 -3.845 33.383 36.522 1.00 6.69 C
|
|
ATOM 703 C THR E 137 -3.094 32.712 35.406 1.00 6.76 C
|
|
ATOM 704 O THR E 137 -3.066 33.355 34.350 1.00 5.05 O
|
|
ATOM 705 CB THR E 137 -5.401 33.263 36.231 1.00 10.76 C
|
|
ATOM 706 OG1 THR E 137 -6.130 34.102 37.203 1.00 11.63 O
|
|
ATOM 707 CG2 THR E 137 -5.933 31.823 36.346 1.00 8.48 C
|
|
ATOM 708 N ARG E 138 -2.672 31.502 35.649 1.00 5.86 N
|
|
ATOM 709 CA ARG E 138 -1.926 30.738 34.597 1.00 5.46 C
|
|
ATOM 710 C ARG E 138 -2.747 29.452 34.354 1.00 10.00 C
|
|
ATOM 711 O ARG E 138 -3.315 28.847 35.282 1.00 10.88 O
|
|
ATOM 712 CB ARG E 138 -0.529 30.373 35.043 1.00 7.16 C
|
|
ATOM 713 CG ARG E 138 0.371 29.539 34.107 1.00 3.62 C
|
|
ATOM 714 CD ARG E 138 1.618 29.032 34.788 1.00 4.76 C
|
|
ATOM 715 NE ARG E 138 1.297 28.023 35.808 1.00 2.79 N
|
|
ATOM 716 CZ ARG E 138 0.569 26.949 35.756 1.00 7.12 C
|
|
ATOM 717 NH1 ARG E 138 0.036 26.409 34.665 1.00 7.56 N
|
|
ATOM 718 NH2 ARG E 138 0.286 26.279 36.936 1.00 8.77 N
|
|
ATOM 719 N ARG E 139 -2.703 28.961 33.114 1.00 5.83 N
|
|
ATOM 720 CA ARG E 139 -3.329 27.620 32.839 1.00 2.88 C
|
|
ATOM 721 C ARG E 139 -2.276 26.851 32.035 1.00 4.85 C
|
|
ATOM 722 O ARG E 139 -1.685 27.456 31.090 1.00 4.11 O
|
|
ATOM 723 CB ARG E 139 -4.665 27.723 32.130 1.00 6.51 C
|
|
ATOM 724 CG ARG E 139 -5.349 26.317 31.991 1.00 5.62 C
|
|
ATOM 725 CD ARG E 139 -6.689 26.551 31.289 1.00 7.94 C
|
|
ATOM 726 NE ARG E 139 -7.435 25.275 31.325 1.00 11.57 N
|
|
ATOM 727 CZ ARG E 139 -7.593 24.452 30.285 1.00 19.02 C
|
|
ATOM 728 NH1 ARG E 139 -8.183 23.253 30.433 1.00 15.18 N
|
|
ATOM 729 NH2 ARG E 139 -7.190 24.785 29.070 1.00 12.83 N
|
|
ATOM 730 N GLY E 140 -2.082 25.575 32.409 1.00 5.16 N
|
|
ATOM 731 CA GLY E 140 -1.046 24.796 31.676 1.00 5.97 C
|
|
ATOM 732 C GLY E 140 -1.564 23.345 31.588 1.00 4.93 C
|
|
ATOM 733 O GLY E 140 -2.426 22.964 32.401 1.00 4.68 O
|
|
ATOM 734 N SER E 141 -0.877 22.604 30.723 1.00 4.32 N
|
|
ATOM 735 CA SER E 141 -1.410 21.236 30.453 1.00 6.87 C
|
|
ATOM 736 C SER E 141 -1.027 20.221 31.520 1.00 7.29 C
|
|
ATOM 737 O SER E 141 -1.677 19.131 31.564 1.00 10.39 O
|
|
ATOM 738 CB SER E 141 -1.016 20.827 29.010 1.00 5.89 C
|
|
ATOM 739 OG SER E 141 0.335 20.532 28.970 1.00 9.01 O
|
|
ATOM 740 N THR E 142 -0.084 20.614 32.397 1.00 4.14 N
|
|
ATOM 741 CA THR E 142 0.267 19.660 33.497 1.00 5.92 C
|
|
ATOM 742 C THR E 142 -0.548 19.992 34.752 1.00 7.89 C
|
|
ATOM 743 O THR E 142 -1.131 19.109 35.382 1.00 5.96 O
|
|
ATOM 744 CB THR E 142 1.770 19.627 33.860 1.00 3.02 C
|
|
ATOM 745 OG1 THR E 142 2.417 19.115 32.620 1.00 9.59 O
|
|
ATOM 746 CG2 THR E 142 2.237 18.722 35.027 1.00 4.77 C
|
|
ATOM 747 N THR E 143 -0.469 21.268 35.163 1.00 8.63 N
|
|
ATOM 748 CA THR E 143 -1.066 21.683 36.442 1.00 9.57 C
|
|
ATOM 749 C THR E 143 -2.426 22.288 36.442 1.00 7.56 C
|
|
ATOM 750 O THR E 143 -2.959 22.566 37.574 1.00 9.65 O
|
|
ATOM 751 CB THR E 143 0.006 22.528 37.251 1.00 4.55 C
|
|
ATOM 752 OG1 THR E 143 0.293 23.738 36.462 1.00 5.79 O
|
|
ATOM 753 CG2 THR E 143 1.326 21.770 37.542 1.00 7.31 C
|
|
ATOM 754 N GLY E 156 -2.953 22.577 35.298 1.00 5.39 N
|
|
ATOM 755 CA GLY E 156 -4.266 23.220 35.206 1.00 6.02 C
|
|
ATOM 756 C GLY E 156 -4.064 24.703 35.517 1.00 4.54 C
|
|
ATOM 757 O GLY E 156 -3.044 25.325 35.242 1.00 9.84 O
|
|
ATOM 758 N THR E 157 -5.056 25.188 36.255 1.00 6.19 N
|
|
ATOM 759 CA THR E 157 -5.112 26.628 36.589 1.00 4.31 C
|
|
ATOM 760 C THR E 157 -4.633 27.020 37.972 1.00 7.16 C
|
|
ATOM 761 O THR E 157 -5.167 26.409 38.952 1.00 6.93 O
|
|
ATOM 762 CB THR E 157 -6.614 27.069 36.430 1.00 7.28 C
|
|
ATOM 763 OG1 THR E 157 -7.036 26.786 35.075 1.00 10.49 O
|
|
ATOM 764 CG2 THR E 157 -6.865 28.547 36.725 1.00 6.24 C
|
|
ATOM 765 N HIS E 158 -3.734 27.980 38.012 1.00 9.38 N
|
|
ATOM 766 CA HIS E 158 -3.164 28.449 39.303 1.00 7.76 C
|
|
ATOM 767 C HIS E 158 -3.130 29.981 39.259 1.00 12.53 C
|
|
ATOM 768 O HIS E 158 -2.901 30.515 38.151 1.00 9.19 O
|
|
ATOM 769 CB HIS E 158 -1.785 27.849 39.554 1.00 5.07 C
|
|
ATOM 770 CG HIS E 158 -1.856 26.382 39.853 1.00 10.79 C
|
|
ATOM 771 ND1 HIS E 158 -1.957 25.870 41.120 1.00 14.48 N
|
|
ATOM 772 CD2 HIS E 158 -1.988 25.325 38.984 1.00 10.22 C
|
|
ATOM 773 CE1 HIS E 158 -2.069 24.556 41.052 1.00 12.74 C
|
|
ATOM 774 NE2 HIS E 158 -2.052 24.201 39.781 1.00 10.54 N
|
|
ATOM 775 N SER E 159 -3.293 30.586 40.451 1.00 8.30 N
|
|
ATOM 776 CA SER E 159 -3.342 32.090 40.451 1.00 8.93 C
|
|
ATOM 777 C SER E 159 -2.291 32.723 41.319 1.00 10.36 C
|
|
ATOM 778 O SER E 159 -1.663 32.014 42.120 1.00 11.93 O
|
|
ATOM 779 CB SER E 159 -4.700 32.581 40.957 1.00 11.32 C
|
|
ATOM 780 OG SER E 159 -5.721 32.216 40.008 1.00 10.37 O
|
|
ATOM 781 N GLY E 160 -2.110 34.048 41.224 1.00 7.36 N
|
|
ATOM 782 CA GLY E 160 -1.040 34.653 42.068 1.00 6.69 C
|
|
ATOM 783 C GLY E 160 -0.895 36.125 41.614 1.00 4.38 C
|
|
ATOM 784 O GLY E 160 -1.914 36.588 41.156 1.00 5.84 O
|
|
ATOM 785 N SER E 161 0.263 36.676 41.845 1.00 8.04 N
|
|
ATOM 786 CA SER E 161 0.412 38.115 41.491 1.00 6.68 C
|
|
ATOM 787 C SER E 161 1.777 38.317 40.849 1.00 4.84 C
|
|
ATOM 788 O SER E 161 2.683 37.515 41.005 1.00 5.29 O
|
|
ATOM 789 CB SER E 161 0.108 38.922 42.814 1.00 12.30 C
|
|
ATOM 790 OG SER E 161 1.189 38.676 43.686 1.00 19.79 O
|
|
ATOM 791 N VAL E 162 1.858 39.413 40.096 1.00 6.37 N
|
|
ATOM 792 CA VAL E 162 3.117 39.870 39.458 1.00 5.45 C
|
|
ATOM 793 C VAL E 162 3.940 40.525 40.614 1.00 6.85 C
|
|
ATOM 794 O VAL E 162 3.341 41.397 41.271 1.00 9.64 O
|
|
ATOM 795 CB VAL E 162 2.874 40.890 38.335 1.00 4.66 C
|
|
ATOM 796 CG1 VAL E 162 4.188 41.522 37.793 1.00 2.93 C
|
|
ATOM 797 CG2 VAL E 162 2.071 40.296 37.199 1.00 8.43 C
|
|
ATOM 798 N THR E 163 5.168 40.039 40.690 1.00 7.39 N
|
|
ATOM 799 CA THR E 163 6.063 40.568 41.750 1.00 12.71 C
|
|
ATOM 800 C THR E 163 7.207 41.397 41.244 1.00 12.16 C
|
|
ATOM 801 O THR E 163 7.842 42.095 42.080 1.00 15.52 O
|
|
ATOM 802 CB THR E 163 6.578 39.369 42.646 1.00 11.20 C
|
|
ATOM 803 OG1 THR E 163 7.460 38.562 41.805 1.00 11.20 O
|
|
ATOM 804 CG2 THR E 163 5.460 38.567 43.332 1.00 8.09 C
|
|
ATOM 805 N ALA E 164 7.484 41.343 39.952 1.00 8.92 N
|
|
ATOM 806 CA ALA E 164 8.576 42.155 39.363 1.00 8.69 C
|
|
ATOM 807 C ALA E 164 8.429 42.106 37.848 1.00 11.85 C
|
|
ATOM 808 O ALA E 164 7.795 41.184 37.303 1.00 7.98 O
|
|
ATOM 809 CB ALA E 164 9.959 41.642 39.785 1.00 13.97 C
|
|
ATOM 810 N LEU E 165 8.987 43.136 37.199 1.00 11.82 N
|
|
ATOM 811 CA LEU E 165 8.993 43.262 35.744 1.00 10.60 C
|
|
ATOM 812 C LEU E 165 10.446 43.338 35.246 1.00 10.42 C
|
|
ATOM 813 O LEU E 165 11.356 43.632 36.043 1.00 10.99 O
|
|
ATOM 814 CB LEU E 165 8.306 44.597 35.358 1.00 12.45 C
|
|
ATOM 815 CG LEU E 165 6.832 44.701 35.788 1.00 15.97 C
|
|
ATOM 816 CD1 LEU E 165 6.278 46.080 35.434 1.00 18.89 C
|
|
ATOM 817 CD2 LEU E 165 5.977 43.649 35.095 1.00 16.52 C
|
|
ATOM 818 N ASN E 166 10.578 43.120 33.963 1.00 8.94 N
|
|
ATOM 819 CA ASN E 166 11.891 43.229 33.294 1.00 10.90 C
|
|
ATOM 820 C ASN E 166 12.949 42.367 33.947 1.00 12.94 C
|
|
ATOM 821 O ASN E 166 14.078 42.858 34.119 1.00 12.56 O
|
|
ATOM 822 CB ASN E 166 12.337 44.695 33.234 1.00 19.83 C
|
|
ATOM 823 CG ASN E 166 13.344 44.984 32.122 1.00 31.24 C
|
|
ATOM 824 OD1 ASN E 166 14.257 45.830 32.298 1.00 38.60 O
|
|
ATOM 825 ND2 ASN E 166 13.209 44.363 30.951 1.00 27.68 N
|
|
ATOM 826 N ALA E 167 12.622 41.114 34.266 1.00 8.21 N
|
|
ATOM 827 CA ALA E 167 13.651 40.263 34.900 1.00 10.79 C
|
|
ATOM 828 C ALA E 167 14.502 39.527 33.911 1.00 9.81 C
|
|
ATOM 829 O ALA E 167 14.020 39.200 32.820 1.00 10.55 O
|
|
ATOM 830 CB ALA E 167 12.862 39.254 35.792 1.00 10.59 C
|
|
ATOM 831 N THR E 168 15.762 39.282 34.222 1.00 9.17 N
|
|
ATOM 832 CA THR E 168 16.651 38.491 33.354 1.00 8.75 C
|
|
ATOM 833 C THR E 168 16.666 37.057 33.919 1.00 9.91 C
|
|
ATOM 834 O THR E 168 16.857 36.970 35.167 1.00 12.89 O
|
|
ATOM 835 CB THR E 168 18.143 39.031 33.385 1.00 13.15 C
|
|
ATOM 836 OG1 THR E 168 17.992 40.367 32.843 1.00 12.26 O
|
|
ATOM 837 CG2 THR E 168 19.144 38.159 32.624 1.00 11.42 C
|
|
ATOM 838 N VAL E 169 16.476 36.098 33.083 1.00 9.08 N
|
|
ATOM 839 CA VAL E 169 16.481 34.675 33.569 1.00 9.68 C
|
|
ATOM 840 C VAL E 169 17.560 33.971 32.684 1.00 14.60 C
|
|
ATOM 841 O VAL E 169 17.391 33.950 31.461 1.00 12.86 O
|
|
ATOM 842 CB VAL E 169 15.116 34.026 33.389 1.00 11.27 C
|
|
ATOM 843 CG1 VAL E 169 15.020 32.619 34.015 1.00 15.61 C
|
|
ATOM 844 CG2 VAL E 169 13.996 34.893 33.884 1.00 11.82 C
|
|
ATOM 845 N ASN E 170 18.479 33.372 33.401 1.00 16.20 N
|
|
ATOM 846 CA ASN E 170 19.571 32.657 32.696 1.00 14.74 C
|
|
ATOM 847 C ASN E 170 19.294 31.158 32.804 1.00 15.53 C
|
|
ATOM 848 O ASN E 170 19.397 30.586 33.876 1.00 17.56 O
|
|
ATOM 849 CB ASN E 170 20.910 33.137 33.238 1.00 21.23 C
|
|
ATOM 850 CG ASN E 170 22.131 32.467 32.636 1.00 18.90 C
|
|
ATOM 851 OD1 ASN E 170 22.101 31.622 31.724 1.00 24.23 O
|
|
ATOM 852 ND2 ASN E 170 23.313 32.837 33.150 1.00 26.29 N
|
|
ATOM 853 N TYR E 171 18.892 30.580 31.696 1.00 15.35 N
|
|
ATOM 854 CA TYR E 171 18.599 29.141 31.644 1.00 19.31 C
|
|
ATOM 855 C TYR E 171 19.886 28.372 31.321 1.00 17.16 C
|
|
ATOM 856 O TYR E 171 19.727 27.173 31.094 1.00 21.39 O
|
|
ATOM 857 CB TYR E 171 17.530 28.803 30.604 1.00 10.62 C
|
|
ATOM 858 CG TYR E 171 16.154 29.364 30.915 1.00 13.03 C
|
|
ATOM 859 CD1 TYR E 171 15.562 30.215 29.970 1.00 8.88 C
|
|
ATOM 860 CD2 TYR E 171 15.472 29.135 32.094 1.00 9.39 C
|
|
ATOM 861 CE1 TYR E 171 14.288 30.760 30.182 1.00 6.16 C
|
|
ATOM 862 CE2 TYR E 171 14.173 29.626 32.325 1.00 8.05 C
|
|
ATOM 863 CZ TYR E 171 13.599 30.460 31.333 1.00 10.22 C
|
|
ATOM 864 OH TYR E 171 12.370 31.006 31.616 1.00 11.11 O
|
|
ATOM 865 N GLY E 172 21.031 29.026 31.269 1.00 19.03 N
|
|
ATOM 866 CA GLY E 172 22.259 28.296 30.971 1.00 21.84 C
|
|
ATOM 867 C GLY E 172 22.525 28.045 29.496 1.00 24.26 C
|
|
ATOM 868 O GLY E 172 21.698 28.127 28.600 1.00 22.80 O
|
|
ATOM 869 N GLY E 173 23.779 27.707 29.257 1.00 29.67 N
|
|
ATOM 870 CA GLY E 173 24.328 27.369 27.942 1.00 29.76 C
|
|
ATOM 871 C GLY E 173 24.214 28.590 27.026 1.00 30.25 C
|
|
ATOM 872 O GLY E 173 24.313 28.389 25.802 1.00 32.22 O
|
|
ATOM 873 N GLY E 174 24.060 29.757 27.627 1.00 27.78 N
|
|
ATOM 874 CA GLY E 174 23.915 30.978 26.814 1.00 23.94 C
|
|
ATOM 875 C GLY E 174 22.436 31.196 26.500 1.00 25.34 C
|
|
ATOM 876 O GLY E 174 22.155 32.052 25.655 1.00 25.94 O
|
|
ATOM 877 N ASP E 175 21.540 30.449 27.153 1.00 20.50 N
|
|
ATOM 878 CA ASP E 175 20.109 30.689 26.922 1.00 17.71 C
|
|
ATOM 879 C ASP E 175 19.599 31.665 28.014 1.00 14.93 C
|
|
ATOM 880 O ASP E 175 19.029 31.284 29.066 1.00 17.11 O
|
|
ATOM 881 CB ASP E 175 19.260 29.446 26.826 1.00 14.53 C
|
|
ATOM 882 CG ASP E 175 19.486 28.514 25.651 1.00 25.13 C
|
|
ATOM 883 OD1 ASP E 175 19.179 27.320 25.770 1.00 25.85 O
|
|
ATOM 884 OD2 ASP E 175 19.950 28.983 24.603 1.00 27.62 O
|
|
ATOM 885 N VAL E 176 19.793 32.930 27.723 1.00 12.13 N
|
|
ATOM 886 CA VAL E 176 19.339 34.042 28.552 1.00 13.03 C
|
|
ATOM 887 C VAL E 176 18.153 34.746 27.866 1.00 9.51 C
|
|
ATOM 888 O VAL E 176 18.184 35.095 26.675 1.00 13.20 O
|
|
ATOM 889 CB VAL E 176 20.467 35.029 28.918 1.00 13.50 C
|
|
ATOM 890 CG1 VAL E 176 19.953 36.065 29.887 1.00 17.34 C
|
|
ATOM 891 CG2 VAL E 176 21.716 34.260 29.297 1.00 12.47 C
|
|
ATOM 892 N VAL E 177 17.166 34.980 28.699 1.00 8.80 N
|
|
ATOM 893 CA VAL E 177 15.931 35.705 28.360 1.00 9.25 C
|
|
ATOM 894 C VAL E 177 15.879 36.970 29.273 1.00 9.78 C
|
|
ATOM 895 O VAL E 177 16.286 36.975 30.445 1.00 12.02 O
|
|
ATOM 896 CB VAL E 177 14.657 34.887 28.384 1.00 10.50 C
|
|
ATOM 897 CG1 VAL E 177 14.717 33.721 27.352 1.00 11.31 C
|
|
ATOM 898 CG2 VAL E 177 14.335 34.331 29.763 1.00 11.64 C
|
|
ATOM 899 N TYR E 178 15.428 37.995 28.564 1.00 7.87 N
|
|
ATOM 900 CA TYR E 178 15.371 39.331 29.209 1.00 9.84 C
|
|
ATOM 901 C TYR E 178 13.978 39.930 29.217 1.00 9.28 C
|
|
ATOM 902 O TYR E 178 13.196 39.560 28.321 1.00 8.37 O
|
|
ATOM 903 CB TYR E 178 16.266 40.225 28.297 1.00 7.43 C
|
|
ATOM 904 CG TYR E 178 17.696 39.772 28.245 1.00 10.79 C
|
|
ATOM 905 CD1 TYR E 178 18.546 40.061 29.321 1.00 12.73 C
|
|
ATOM 906 CD2 TYR E 178 18.200 39.102 27.125 1.00 11.07 C
|
|
ATOM 907 CE1 TYR E 178 19.873 39.641 29.325 1.00 12.08 C
|
|
ATOM 908 CE2 TYR E 178 19.562 38.747 27.089 1.00 9.21 C
|
|
ATOM 909 CZ TYR E 178 20.360 38.982 28.201 1.00 12.06 C
|
|
ATOM 910 OH TYR E 178 21.661 38.611 28.145 1.00 16.19 O
|
|
ATOM 911 N GLY E 179 13.715 40.923 30.102 1.00 7.36 N
|
|
ATOM 912 CA GLY E 179 12.381 41.566 30.030 1.00 8.20 C
|
|
ATOM 913 C GLY E 179 11.177 40.754 30.480 1.00 5.22 C
|
|
ATOM 914 O GLY E 179 10.021 41.015 30.034 1.00 8.73 O
|
|
ATOM 915 N MET E 180 11.444 39.751 31.317 1.00 5.39 N
|
|
ATOM 916 CA MET E 180 10.378 38.835 31.732 1.00 6.23 C
|
|
ATOM 917 C MET E 180 9.597 39.342 32.959 1.00 6.09 C
|
|
ATOM 918 O MET E 180 10.105 40.034 33.860 1.00 9.15 O
|
|
ATOM 919 CB MET E 180 10.999 37.477 32.082 1.00 6.98 C
|
|
ATOM 920 CG MET E 180 11.858 36.894 30.998 1.00 10.90 C
|
|
ATOM 921 SD MET E 180 10.883 36.670 29.448 1.00 22.30 S
|
|
ATOM 922 CE MET E 180 10.230 35.051 29.903 1.00 17.98 C
|
|
ATOM 923 N ILE E 181 8.371 38.846 33.027 1.00 4.03 N
|
|
ATOM 924 CA ILE E 181 7.460 39.134 34.154 1.00 7.81 C
|
|
ATOM 925 C ILE E 181 7.738 38.066 35.222 1.00 6.55 C
|
|
ATOM 926 O ILE E 181 7.721 36.861 34.872 1.00 7.58 O
|
|
ATOM 927 CB ILE E 181 5.963 39.015 33.700 1.00 5.52 C
|
|
ATOM 928 CG1 ILE E 181 5.709 40.029 32.549 1.00 4.80 C
|
|
ATOM 929 CG2 ILE E 181 4.975 39.200 34.924 1.00 4.82 C
|
|
ATOM 930 CD1 ILE E 181 4.469 39.625 31.700 1.00 9.22 C
|
|
ATOM 931 N ARG E 182 7.995 38.507 36.458 1.00 5.41 N
|
|
ATOM 932 CA ARG E 182 8.168 37.570 37.562 1.00 6.61 C
|
|
ATOM 933 C ARG E 182 6.877 37.439 38.378 1.00 4.77 C
|
|
ATOM 934 O ARG E 182 6.215 38.437 38.653 1.00 7.15 O
|
|
ATOM 935 CB ARG E 182 9.313 38.039 38.490 1.00 7.93 C
|
|
ATOM 936 CG ARG E 182 9.618 36.899 39.526 1.00 12.10 C
|
|
ATOM 937 CD ARG E 182 10.437 37.570 40.626 1.00 19.20 C
|
|
ATOM 938 NE ARG E 182 10.894 36.719 41.674 1.00 25.00 N
|
|
ATOM 939 CZ ARG E 182 12.061 36.207 42.013 1.00 32.46 C
|
|
ATOM 940 NH1 ARG E 182 13.195 36.490 41.355 1.00 34.15 N
|
|
ATOM 941 NH2 ARG E 182 12.144 35.351 43.057 1.00 35.04 N
|
|
ATOM 942 N THR E 183 6.545 36.185 38.769 1.00 4.27 N
|
|
ATOM 943 CA THR E 183 5.313 36.049 39.562 1.00 3.96 C
|
|
ATOM 944 C THR E 183 5.573 35.007 40.662 1.00 3.31 C
|
|
ATOM 945 O THR E 183 6.565 34.239 40.558 1.00 5.96 O
|
|
ATOM 946 CB THR E 183 4.075 35.569 38.733 1.00 6.87 C
|
|
ATOM 947 OG1 THR E 183 4.356 34.146 38.434 1.00 7.41 O
|
|
ATOM 948 CG2 THR E 183 3.939 36.338 37.362 1.00 7.23 C
|
|
ATOM 949 N ASN E 184 4.564 34.920 41.495 1.00 5.10 N
|
|
ATOM 950 CA ASN E 184 4.652 33.868 42.563 1.00 7.64 C
|
|
ATOM 951 C ASN E 184 3.678 32.761 42.212 1.00 9.59 C
|
|
ATOM 952 O ASN E 184 3.213 32.036 43.140 1.00 8.45 O
|
|
ATOM 953 CB ASN E 184 4.377 34.506 43.929 1.00 10.79 C
|
|
ATOM 954 CG ASN E 184 3.007 35.089 44.053 1.00 13.16 C
|
|
ATOM 955 OD1 ASN E 184 2.125 35.056 43.204 1.00 8.12 O
|
|
ATOM 956 ND2 ASN E 184 2.667 35.667 45.236 1.00 19.11 N
|
|
ATOM 957 N VAL E 190 3.338 32.608 40.937 1.00 8.31 N
|
|
ATOM 958 CA VAL E 190 2.416 31.469 40.558 1.00 6.44 C
|
|
ATOM 959 C VAL E 190 3.327 30.242 40.291 1.00 8.31 C
|
|
ATOM 960 O VAL E 190 4.407 30.449 39.705 1.00 9.50 O
|
|
ATOM 961 CB VAL E 190 1.706 31.845 39.223 1.00 11.50 C
|
|
ATOM 962 CG1 VAL E 190 0.875 30.722 38.602 1.00 15.75 C
|
|
ATOM 963 CG2 VAL E 190 0.763 33.034 39.419 1.00 9.92 C
|
|
ATOM 964 N CYS E 191 2.886 29.032 40.650 1.00 7.72 N
|
|
ATOM 965 CA CYS E 191 3.758 27.849 40.347 1.00 9.74 C
|
|
ATOM 966 C CYS E 191 3.526 27.413 38.881 1.00 4.68 C
|
|
ATOM 967 O CYS E 191 2.495 27.756 38.275 1.00 7.70 O
|
|
ATOM 968 CB CYS E 191 3.360 26.693 41.311 1.00 10.42 C
|
|
ATOM 969 SG CYS E 191 1.642 26.202 41.116 1.00 11.64 S
|
|
ATOM 970 N ALA E 192 4.410 26.524 38.426 1.00 5.44 N
|
|
ATOM 971 CA ALA E 192 4.272 25.897 37.107 1.00 3.79 C
|
|
ATOM 972 C ALA E 192 5.268 24.719 37.127 1.00 6.52 C
|
|
ATOM 973 O ALA E 192 6.228 24.670 37.916 1.00 8.48 O
|
|
ATOM 974 CB ALA E 192 4.591 26.829 35.912 1.00 7.66 C
|
|
ATOM 975 N GLU E 192A 4.964 23.727 36.274 1.00 6.68 N
|
|
ATOM 976 CA GLU E 192A 5.793 22.528 36.211 1.00 4.42 C
|
|
ATOM 977 C GLU E 192A 5.894 22.102 34.716 1.00 6.05 C
|
|
ATOM 978 O GLU E 192A 5.090 22.539 33.907 1.00 5.42 O
|
|
ATOM 979 CB GLU E 192A 5.012 21.383 36.944 1.00 7.11 C
|
|
ATOM 980 CG GLU E 192A 5.141 21.644 38.458 1.00 7.84 C
|
|
ATOM 981 CD GLU E 192A 4.302 20.854 39.407 1.00 12.72 C
|
|
ATOM 982 OE1 GLU E 192A 4.064 21.214 40.570 1.00 11.70 O
|
|
ATOM 983 OE2 GLU E 192A 3.860 19.785 38.940 1.00 7.99 O
|
|
ATOM 984 N PRO E 192B 6.810 21.208 34.481 1.00 5.81 N
|
|
ATOM 985 CA PRO E 192B 7.100 20.739 33.095 1.00 4.98 C
|
|
ATOM 986 C PRO E 192B 5.848 20.331 32.413 1.00 7.01 C
|
|
ATOM 987 O PRO E 192B 5.010 19.589 32.931 1.00 7.99 O
|
|
ATOM 988 CB PRO E 192B 8.156 19.665 33.274 1.00 5.07 C
|
|
ATOM 989 CG PRO E 192B 8.903 20.140 34.517 1.00 6.43 C
|
|
ATOM 990 CD PRO E 192B 7.783 20.609 35.418 1.00 5.25 C
|
|
ATOM 991 N GLY E 193 5.702 20.832 31.190 1.00 3.85 N
|
|
ATOM 992 CA GLY E 193 4.476 20.663 30.381 1.00 3.34 C
|
|
ATOM 993 C GLY E 193 3.697 21.999 30.281 1.00 3.87 C
|
|
ATOM 994 O GLY E 193 2.804 22.130 29.404 1.00 5.90 O
|
|
ATOM 995 N ASP E 194 3.955 22.817 31.297 1.00 5.06 N
|
|
ATOM 996 CA ASP E 194 3.221 24.098 31.393 1.00 2.29 C
|
|
ATOM 997 C ASP E 194 3.778 25.210 30.468 1.00 3.87 C
|
|
ATOM 998 O ASP E 194 3.083 26.257 30.317 1.00 3.08 O
|
|
ATOM 999 CB ASP E 194 3.120 24.583 32.863 1.00 2.20 C
|
|
ATOM 1000 CG ASP E 194 2.206 23.754 33.744 1.00 4.16 C
|
|
ATOM 1001 OD1 ASP E 194 2.382 23.836 34.979 1.00 6.06 O
|
|
ATOM 1002 OD2 ASP E 194 1.288 23.067 33.270 1.00 5.91 O
|
|
ATOM 1003 N SER E 195 4.952 24.959 29.958 1.00 2.82 N
|
|
ATOM 1004 CA SER E 195 5.567 25.984 29.054 1.00 7.81 C
|
|
ATOM 1005 C SER E 195 4.574 26.404 27.950 1.00 4.68 C
|
|
ATOM 1006 O SER E 195 3.818 25.586 27.436 1.00 4.44 O
|
|
ATOM 1007 CB SER E 195 6.775 25.439 28.313 1.00 6.20 C
|
|
ATOM 1008 OG SER E 195 7.941 25.472 29.050 1.00 6.85 O
|
|
ATOM 1009 N GLY E 196 4.625 27.696 27.655 1.00 2.00 N
|
|
ATOM 1010 CA GLY E 196 3.776 28.345 26.667 1.00 4.31 C
|
|
ATOM 1011 C GLY E 196 2.335 28.645 27.022 1.00 5.63 C
|
|
ATOM 1012 O GLY E 196 1.650 29.359 26.276 1.00 9.12 O
|
|
ATOM 1013 N GLY E 197 1.887 28.170 28.165 1.00 6.14 N
|
|
ATOM 1014 CA GLY E 197 0.499 28.410 28.596 1.00 3.99 C
|
|
ATOM 1015 C GLY E 197 0.275 29.915 28.890 1.00 5.13 C
|
|
ATOM 1016 O GLY E 197 1.287 30.602 29.189 1.00 5.37 O
|
|
ATOM 1017 N PRO E 198 -0.979 30.286 28.886 1.00 5.22 N
|
|
ATOM 1018 CA PRO E 198 -1.303 31.687 29.118 1.00 4.19 C
|
|
ATOM 1019 C PRO E 198 -1.218 32.183 30.556 1.00 5.06 C
|
|
ATOM 1020 O PRO E 198 -1.563 31.420 31.481 1.00 6.47 O
|
|
ATOM 1021 CB PRO E 198 -2.784 31.791 28.691 1.00 4.62 C
|
|
ATOM 1022 CG PRO E 198 -3.349 30.422 29.022 1.00 4.14 C
|
|
ATOM 1023 CD PRO E 198 -2.187 29.452 28.711 1.00 4.03 C
|
|
ATOM 1024 N LEU E 199 -0.882 33.470 30.628 1.00 5.06 N
|
|
ATOM 1025 CA LEU E 199 -0.991 34.173 31.959 1.00 3.43 C
|
|
ATOM 1026 C LEU E 199 -2.063 35.209 31.596 1.00 8.41 C
|
|
ATOM 1027 O LEU E 199 -1.826 35.972 30.588 1.00 6.51 O
|
|
ATOM 1028 CB LEU E 199 0.362 34.735 32.353 1.00 4.28 C
|
|
ATOM 1029 CG LEU E 199 0.219 35.476 33.704 1.00 10.60 C
|
|
ATOM 1030 CD1 LEU E 199 0.292 34.413 34.848 1.00 9.05 C
|
|
ATOM 1031 CD2 LEU E 199 1.323 36.501 33.816 1.00 8.81 C
|
|
ATOM 1032 N TYR E 200 -3.173 35.253 32.302 1.00 4.71 N
|
|
ATOM 1033 CA TYR E 200 -4.231 36.223 31.979 1.00 7.56 C
|
|
ATOM 1034 C TYR E 200 -4.708 36.894 33.270 1.00 7.09 C
|
|
ATOM 1035 O TYR E 200 -4.241 36.479 34.334 1.00 5.03 O
|
|
ATOM 1036 CB TYR E 200 -5.347 35.465 31.257 1.00 6.15 C
|
|
ATOM 1037 CG TYR E 200 -6.115 34.429 32.046 1.00 7.76 C
|
|
ATOM 1038 CD1 TYR E 200 -7.363 34.735 32.608 1.00 5.11 C
|
|
ATOM 1039 CD2 TYR E 200 -5.656 33.094 32.134 1.00 9.01 C
|
|
ATOM 1040 CE1 TYR E 200 -8.097 33.770 33.298 1.00 9.04 C
|
|
ATOM 1041 CE2 TYR E 200 -6.431 32.134 32.800 1.00 6.74 C
|
|
ATOM 1042 CZ TYR E 200 -7.577 32.467 33.413 1.00 5.59 C
|
|
ATOM 1043 OH TYR E 200 -8.323 31.453 34.043 1.00 10.26 O
|
|
ATOM 1044 N SER E 201 -5.501 37.902 33.035 1.00 5.67 N
|
|
ATOM 1045 CA SER E 201 -6.042 38.633 34.278 1.00 5.48 C
|
|
ATOM 1046 C SER E 201 -7.477 39.009 33.899 1.00 6.24 C
|
|
ATOM 1047 O SER E 201 -7.677 39.996 33.178 1.00 7.34 O
|
|
ATOM 1048 CB SER E 201 -5.132 39.794 34.589 1.00 6.96 C
|
|
ATOM 1049 OG SER E 201 -5.648 40.514 35.764 1.00 8.11 O
|
|
ATOM 1050 N GLY E 202 -8.417 38.273 34.398 1.00 7.34 N
|
|
ATOM 1051 CA GLY E 202 -9.843 38.475 34.027 1.00 11.45 C
|
|
ATOM 1052 C GLY E 202 -9.872 38.180 32.513 1.00 12.84 C
|
|
ATOM 1053 O GLY E 202 -9.449 37.063 32.146 1.00 16.13 O
|
|
ATOM 1054 N THR E 207 -10.336 39.107 31.688 1.00 11.61 N
|
|
ATOM 1055 CA THR E 207 -10.412 38.856 30.241 1.00 13.56 C
|
|
ATOM 1056 C THR E 207 -9.170 39.342 29.488 1.00 14.63 C
|
|
ATOM 1057 O THR E 207 -9.214 39.369 28.253 1.00 15.86 O
|
|
ATOM 1058 CB THR E 207 -11.679 39.609 29.636 1.00 14.70 C
|
|
ATOM 1059 OG1 THR E 207 -11.436 41.043 29.891 1.00 14.56 O
|
|
ATOM 1060 CG2 THR E 207 -12.977 39.053 30.213 1.00 13.90 C
|
|
ATOM 1061 N ARG E 208 -8.151 39.751 30.205 1.00 11.01 N
|
|
ATOM 1062 CA ARG E 208 -6.961 40.279 29.552 1.00 7.55 C
|
|
ATOM 1063 C ARG E 208 -5.835 39.287 29.452 1.00 9.02 C
|
|
ATOM 1064 O ARG E 208 -5.444 38.666 30.464 1.00 8.82 O
|
|
ATOM 1065 CB ARG E 208 -6.368 41.506 30.317 1.00 11.89 C
|
|
ATOM 1066 CG ARG E 208 -7.454 42.504 30.735 1.00 17.55 C
|
|
ATOM 1067 CD ARG E 208 -6.869 43.496 31.708 1.00 26.22 C
|
|
ATOM 1068 NE ARG E 208 -6.737 42.945 33.063 1.00 28.28 N
|
|
ATOM 1069 CZ ARG E 208 -6.345 43.627 34.154 1.00 38.38 C
|
|
ATOM 1070 NH1 ARG E 208 -5.979 44.924 34.035 1.00 29.37 N
|
|
ATOM 1071 NH2 ARG E 208 -6.323 43.044 35.382 1.00 22.72 N
|
|
ATOM 1072 N ALA E 209 -5.309 39.124 28.277 1.00 5.90 N
|
|
ATOM 1073 CA ALA E 209 -4.101 38.366 28.006 1.00 6.58 C
|
|
ATOM 1074 C ALA E 209 -2.854 39.118 28.444 1.00 9.25 C
|
|
ATOM 1075 O ALA E 209 -2.589 40.247 27.994 1.00 9.21 O
|
|
ATOM 1076 CB ALA E 209 -4.083 38.088 26.472 1.00 6.38 C
|
|
ATOM 1077 N ILE E 210 -2.025 38.480 29.273 1.00 5.57 N
|
|
ATOM 1078 CA ILE E 210 -0.807 39.091 29.787 1.00 3.29 C
|
|
ATOM 1079 C ILE E 210 0.513 38.480 29.301 1.00 4.29 C
|
|
ATOM 1080 O ILE E 210 1.471 39.189 28.974 1.00 9.59 O
|
|
ATOM 1081 CB ILE E 210 -0.892 39.025 31.393 1.00 5.54 C
|
|
ATOM 1082 CG1 ILE E 210 -2.205 39.680 31.907 1.00 5.81 C
|
|
ATOM 1083 CG2 ILE E 210 0.342 39.816 31.903 1.00 3.31 C
|
|
ATOM 1084 CD1 ILE E 210 -2.390 41.184 31.516 1.00 8.26 C
|
|
ATOM 1085 N GLY E 211 0.618 37.117 29.412 1.00 4.85 N
|
|
ATOM 1086 CA GLY E 211 1.961 36.561 29.070 1.00 3.51 C
|
|
ATOM 1087 C GLY E 211 1.896 35.095 28.683 1.00 3.70 C
|
|
ATOM 1088 O GLY E 211 0.782 34.549 28.584 1.00 4.23 O
|
|
ATOM 1089 N LEU E 212 3.077 34.582 28.356 1.00 4.54 N
|
|
ATOM 1090 CA LEU E 212 3.236 33.159 27.998 1.00 3.76 C
|
|
ATOM 1091 C LEU E 212 4.280 32.581 28.986 1.00 2.48 C
|
|
ATOM 1092 O LEU E 212 5.321 33.235 29.225 1.00 3.57 O
|
|
ATOM 1093 CB LEU E 212 3.784 33.061 26.563 1.00 9.12 C
|
|
ATOM 1094 CG LEU E 212 2.971 33.830 25.527 1.00 5.50 C
|
|
ATOM 1095 CD1 LEU E 212 3.794 33.944 24.216 1.00 11.01 C
|
|
ATOM 1096 CD2 LEU E 212 1.677 33.121 25.204 1.00 11.59 C
|
|
ATOM 1097 N THR E 213 3.911 31.387 29.428 1.00 3.37 N
|
|
ATOM 1098 CA THR E 213 4.826 30.766 30.453 1.00 2.78 C
|
|
ATOM 1099 C THR E 213 6.196 30.428 29.883 1.00 5.48 C
|
|
ATOM 1100 O THR E 213 6.277 29.670 28.894 1.00 5.73 O
|
|
ATOM 1101 CB THR E 213 4.155 29.435 30.955 1.00 9.40 C
|
|
ATOM 1102 OG1 THR E 213 2.861 29.812 31.509 1.00 4.29 O
|
|
ATOM 1103 CG2 THR E 213 4.881 28.776 32.114 1.00 4.63 C
|
|
ATOM 1104 N SER E 214 7.260 30.853 30.536 1.00 3.03 N
|
|
ATOM 1105 CA SER E 214 8.608 30.569 30.054 1.00 3.07 C
|
|
ATOM 1106 C SER E 214 9.291 29.544 30.943 1.00 6.78 C
|
|
ATOM 1107 O SER E 214 9.818 28.547 30.389 1.00 9.31 O
|
|
ATOM 1108 CB SER E 214 9.437 31.867 29.950 1.00 5.41 C
|
|
ATOM 1109 OG SER E 214 10.810 31.622 29.596 1.00 6.92 O
|
|
ATOM 1110 N GLY E 215 9.408 29.882 32.210 1.00 7.13 N
|
|
ATOM 1111 CA GLY E 215 10.201 28.945 33.063 1.00 5.17 C
|
|
ATOM 1112 C GLY E 215 10.001 29.332 34.525 1.00 8.42 C
|
|
ATOM 1113 O GLY E 215 9.343 30.313 34.784 1.00 7.92 O
|
|
ATOM 1114 N GLY E 216 10.624 28.519 35.374 1.00 10.59 N
|
|
ATOM 1115 CA GLY E 216 10.505 28.890 36.820 1.00 11.64 C
|
|
ATOM 1116 C GLY E 216 11.203 27.838 37.681 1.00 10.22 C
|
|
ATOM 1117 O GLY E 216 11.946 26.949 37.211 1.00 9.71 O
|
|
ATOM 1118 N SER E 217 10.953 28.029 38.980 1.00 10.94 N
|
|
ATOM 1119 CA SER E 217 11.591 27.096 39.941 1.00 10.19 C
|
|
ATOM 1120 C SER E 217 10.510 26.748 40.957 1.00 10.57 C
|
|
ATOM 1121 O SER E 217 9.455 27.380 41.036 1.00 10.69 O
|
|
ATOM 1122 CB SER E 217 12.782 27.734 40.650 1.00 18.16 C
|
|
ATOM 1123 OG SER E 217 12.245 28.907 41.228 1.00 15.59 O
|
|
ATOM 1124 N GLY E 218 10.835 25.673 41.706 1.00 13.69 N
|
|
ATOM 1125 CA GLY E 218 9.814 25.259 42.722 1.00 11.75 C
|
|
ATOM 1126 C GLY E 218 8.741 24.420 42.037 1.00 12.40 C
|
|
ATOM 1127 O GLY E 218 8.993 23.836 40.945 1.00 13.70 O
|
|
ATOM 1128 N ASN E 219 7.601 24.261 42.682 1.00 13.92 N
|
|
ATOM 1129 CA ASN E 219 6.545 23.389 42.112 1.00 9.64 C
|
|
ATOM 1130 C ASN E 219 5.271 23.880 42.834 1.00 10.87 C
|
|
ATOM 1131 O ASN E 219 5.261 24.818 43.654 1.00 11.66 O
|
|
ATOM 1132 CB ASN E 219 6.889 21.917 42.300 1.00 12.65 C
|
|
ATOM 1133 CG ASN E 219 7.070 21.574 43.786 1.00 15.19 C
|
|
ATOM 1134 OD1 ASN E 219 6.109 21.732 44.531 1.00 15.46 O
|
|
ATOM 1135 ND2 ASN E 219 8.282 21.192 44.165 1.00 18.76 N
|
|
ATOM 1136 N CYS E 220 4.208 23.220 42.407 1.00 9.30 N
|
|
ATOM 1137 CA CYS E 220 2.861 23.574 42.846 1.00 9.25 C
|
|
ATOM 1138 C CYS E 220 2.553 23.067 44.264 1.00 10.38 C
|
|
ATOM 1139 O CYS E 220 1.625 23.667 44.870 1.00 11.31 O
|
|
ATOM 1140 CB CYS E 220 1.799 23.215 41.857 1.00 10.26 C
|
|
ATOM 1141 SG CYS E 220 1.811 24.289 40.375 1.00 10.69 S
|
|
ATOM 1142 N SER E 221 3.294 22.086 44.691 1.00 10.67 N
|
|
ATOM 1143 CA SER E 221 3.072 21.530 46.045 1.00 13.33 C
|
|
ATOM 1144 C SER E 221 3.747 22.424 47.077 1.00 12.38 C
|
|
ATOM 1145 O SER E 221 3.041 22.757 48.042 1.00 17.76 O
|
|
ATOM 1146 CB SER E 221 3.614 20.107 46.189 1.00 18.83 C
|
|
ATOM 1147 OG SER E 221 3.262 19.638 47.476 1.00 18.87 O
|
|
ATOM 1148 N SER E 222 4.969 22.855 46.854 1.00 13.72 N
|
|
ATOM 1149 CA SER E 222 5.644 23.700 47.847 1.00 15.38 C
|
|
ATOM 1150 C SER E 222 5.600 25.199 47.528 1.00 18.42 C
|
|
ATOM 1151 O SER E 222 5.987 25.973 48.408 1.00 18.61 O
|
|
ATOM 1152 CB SER E 222 7.142 23.345 47.819 1.00 23.35 C
|
|
ATOM 1153 OG SER E 222 7.343 22.059 48.353 1.00 33.91 O
|
|
ATOM 1154 N GLY E 223 5.220 25.548 46.316 1.00 15.02 N
|
|
ATOM 1155 CA GLY E 223 5.255 26.976 45.930 1.00 12.18 C
|
|
ATOM 1156 C GLY E 223 6.442 27.118 44.958 1.00 11.39 C
|
|
ATOM 1157 O GLY E 223 7.467 26.426 44.950 1.00 12.86 O
|
|
ATOM 1158 N GLY E 224 6.261 28.149 44.105 1.00 8.67 N
|
|
ATOM 1159 CA GLY E 224 7.401 28.361 43.113 1.00 11.40 C
|
|
ATOM 1160 C GLY E 224 7.292 29.812 42.626 1.00 8.65 C
|
|
ATOM 1161 O GLY E 224 6.430 30.569 43.073 1.00 10.07 O
|
|
ATOM 1162 N THR E 225 8.137 30.041 41.682 1.00 9.13 N
|
|
ATOM 1163 CA THR E 225 8.289 31.354 41.012 1.00 5.49 C
|
|
ATOM 1164 C THR E 225 8.283 31.000 39.514 1.00 5.57 C
|
|
ATOM 1165 O THR E 225 9.086 30.117 39.092 1.00 7.61 O
|
|
ATOM 1166 CB THR E 225 9.685 31.943 41.379 1.00 13.60 C
|
|
ATOM 1167 OG1 THR E 225 9.624 32.194 42.810 1.00 17.15 O
|
|
ATOM 1168 CG2 THR E 225 9.997 33.268 40.682 1.00 12.78 C
|
|
ATOM 1169 N THR E 226 7.489 31.785 38.809 1.00 4.75 N
|
|
ATOM 1170 CA THR E 226 7.428 31.529 37.334 1.00 3.22 C
|
|
ATOM 1171 C THR E 226 7.579 32.854 36.585 1.00 6.94 C
|
|
ATOM 1172 O THR E 226 7.072 33.873 37.032 1.00 4.98 O
|
|
ATOM 1173 CB THR E 226 6.086 30.842 36.928 1.00 3.84 C
|
|
ATOM 1174 OG1 THR E 226 5.969 29.610 37.689 1.00 7.91 O
|
|
ATOM 1175 CG2 THR E 226 6.007 30.449 35.398 1.00 7.28 C
|
|
ATOM 1176 N PHE E 227 8.287 32.761 35.450 1.00 5.78 N
|
|
ATOM 1177 CA PHE E 227 8.564 33.950 34.637 1.00 3.92 C
|
|
ATOM 1178 C PHE E 227 7.825 33.786 33.322 1.00 5.06 C
|
|
ATOM 1179 O PHE E 227 7.675 32.679 32.796 1.00 4.83 O
|
|
ATOM 1180 CB PHE E 227 10.064 34.037 34.330 1.00 2.65 C
|
|
ATOM 1181 CG PHE E 227 10.903 34.162 35.581 1.00 6.47 C
|
|
ATOM 1182 CD1 PHE E 227 11.387 33.006 36.199 1.00 8.52 C
|
|
ATOM 1183 CD2 PHE E 227 11.212 35.389 36.091 1.00 7.91 C
|
|
ATOM 1184 CE1 PHE E 227 12.190 33.094 37.334 1.00 15.26 C
|
|
ATOM 1185 CE2 PHE E 227 12.030 35.542 37.239 1.00 11.10 C
|
|
ATOM 1186 CZ PHE E 227 12.506 34.359 37.809 1.00 10.34 C
|
|
ATOM 1187 N PHE E 228 7.295 34.953 32.875 1.00 4.53 N
|
|
ATOM 1188 CA PHE E 228 6.443 34.876 31.640 1.00 3.36 C
|
|
ATOM 1189 C PHE E 228 6.943 35.956 30.656 1.00 9.68 C
|
|
ATOM 1190 O PHE E 228 7.410 37.063 31.046 1.00 3.73 O
|
|
ATOM 1191 CB PHE E 228 5.007 35.253 32.019 1.00 9.53 C
|
|
ATOM 1192 CG PHE E 228 4.382 34.304 32.999 1.00 8.41 C
|
|
ATOM 1193 CD1 PHE E 228 3.516 33.323 32.513 1.00 2.54 C
|
|
ATOM 1194 CD2 PHE E 228 4.725 34.402 34.374 1.00 7.24 C
|
|
ATOM 1195 CE1 PHE E 228 2.988 32.358 33.433 1.00 5.00 C
|
|
ATOM 1196 CE2 PHE E 228 4.151 33.470 35.238 1.00 5.14 C
|
|
ATOM 1197 CZ PHE E 228 3.233 32.527 34.788 1.00 5.51 C
|
|
ATOM 1198 N GLN E 229 6.786 35.552 29.397 1.00 3.85 N
|
|
ATOM 1199 CA GLN E 229 7.146 36.512 28.289 1.00 5.74 C
|
|
ATOM 1200 C GLN E 229 5.925 37.384 28.121 1.00 3.93 C
|
|
ATOM 1201 O GLN E 229 4.809 36.866 27.926 1.00 5.68 O
|
|
ATOM 1202 CB GLN E 229 7.373 35.656 27.006 1.00 8.28 C
|
|
ATOM 1203 CG GLN E 229 7.219 36.436 25.659 1.00 5.93 C
|
|
ATOM 1204 CD GLN E 229 8.310 37.433 25.467 1.00 5.40 C
|
|
ATOM 1205 OE1 GLN E 229 9.518 37.172 25.595 1.00 6.10 O
|
|
ATOM 1206 NE2 GLN E 229 7.988 38.698 25.177 1.00 7.02 N
|
|
ATOM 1207 N PRO E 230 6.081 38.720 28.109 1.00 4.87 N
|
|
ATOM 1208 CA PRO E 230 4.940 39.631 27.894 1.00 3.82 C
|
|
ATOM 1209 C PRO E 230 4.285 39.331 26.543 1.00 6.27 C
|
|
ATOM 1210 O PRO E 230 4.955 39.293 25.491 1.00 7.59 O
|
|
ATOM 1211 CB PRO E 230 5.623 41.021 27.890 1.00 4.89 C
|
|
ATOM 1212 CG PRO E 230 6.751 40.797 28.882 1.00 7.87 C
|
|
ATOM 1213 CD PRO E 230 7.302 39.418 28.472 1.00 5.50 C
|
|
ATOM 1214 N VAL E 231 3.006 39.085 26.503 1.00 5.47 N
|
|
ATOM 1215 CA VAL E 231 2.319 38.775 25.232 1.00 5.89 C
|
|
ATOM 1216 C VAL E 231 2.223 39.958 24.268 1.00 9.40 C
|
|
ATOM 1217 O VAL E 231 2.268 39.685 23.045 1.00 8.51 O
|
|
ATOM 1218 CB VAL E 231 0.930 38.159 25.503 1.00 8.60 C
|
|
ATOM 1219 CG1 VAL E 231 -0.155 39.124 25.894 1.00 7.45 C
|
|
ATOM 1220 CG2 VAL E 231 0.569 37.194 24.388 1.00 13.08 C
|
|
ATOM 1221 N THR E 232 2.238 41.179 24.762 1.00 10.12 N
|
|
ATOM 1222 CA THR E 232 2.123 42.308 23.790 1.00 10.90 C
|
|
ATOM 1223 C THR E 232 3.299 42.297 22.821 1.00 8.63 C
|
|
ATOM 1224 O THR E 232 3.013 42.646 21.662 1.00 12.95 O
|
|
ATOM 1225 CB THR E 232 1.975 43.692 24.559 1.00 12.14 C
|
|
ATOM 1226 OG1 THR E 232 3.064 43.578 25.515 1.00 12.71 O
|
|
ATOM 1227 CG2 THR E 232 0.617 43.867 25.284 1.00 18.53 C
|
|
ATOM 1228 N GLU E 233 4.465 41.926 23.292 1.00 12.12 N
|
|
ATOM 1229 CA GLU E 233 5.660 41.893 22.435 1.00 12.56 C
|
|
ATOM 1230 C GLU E 233 5.436 40.879 21.311 1.00 11.07 C
|
|
ATOM 1231 O GLU E 233 5.844 41.130 20.152 1.00 13.14 O
|
|
ATOM 1232 CB GLU E 233 6.906 41.479 23.200 1.00 19.39 C
|
|
ATOM 1233 CG GLU E 233 7.813 42.291 24.093 1.00 33.55 C
|
|
ATOM 1234 CD GLU E 233 8.964 41.501 24.686 1.00 42.18 C
|
|
ATOM 1235 OE1 GLU E 233 9.233 41.430 25.886 1.00 47.53 O
|
|
ATOM 1236 OE2 GLU E 233 9.684 40.841 23.885 1.00 41.23 O
|
|
ATOM 1237 N ALA E 234 4.852 39.723 21.666 1.00 10.94 N
|
|
ATOM 1238 CA ALA E 234 4.601 38.704 20.614 1.00 11.67 C
|
|
ATOM 1239 C ALA E 234 3.571 39.173 19.602 1.00 11.18 C
|
|
ATOM 1240 O ALA E 234 3.769 38.922 18.386 1.00 13.29 O
|
|
ATOM 1241 CB ALA E 234 4.284 37.368 21.287 1.00 11.45 C
|
|
ATOM 1242 N LEU E 235 2.460 39.740 20.048 1.00 10.90 N
|
|
ATOM 1243 CA LEU E 235 1.376 40.209 19.171 1.00 13.16 C
|
|
ATOM 1244 C LEU E 235 1.908 41.255 18.171 1.00 11.78 C
|
|
ATOM 1245 O LEU E 235 1.449 41.168 16.996 1.00 14.74 O
|
|
ATOM 1246 CB LEU E 235 0.194 40.726 19.980 1.00 11.00 C
|
|
ATOM 1247 CG LEU E 235 -0.497 39.827 20.980 1.00 11.63 C
|
|
ATOM 1248 CD1 LEU E 235 -1.591 40.606 21.746 1.00 16.86 C
|
|
ATOM 1249 CD2 LEU E 235 -1.203 38.698 20.207 1.00 12.96 C
|
|
ATOM 1250 N VAL E 235A 2.808 42.089 18.661 1.00 14.14 N
|
|
ATOM 1251 CA VAL E 235A 3.398 43.136 17.793 1.00 14.54 C
|
|
ATOM 1252 C VAL E 235A 4.365 42.531 16.792 1.00 15.32 C
|
|
ATOM 1253 O VAL E 235A 4.290 42.875 15.589 1.00 17.62 O
|
|
ATOM 1254 CB VAL E 235A 4.103 44.178 18.705 1.00 16.92 C
|
|
ATOM 1255 CG1 VAL E 235A 5.266 44.859 17.988 1.00 28.64 C
|
|
ATOM 1256 CG2 VAL E 235A 3.136 45.192 19.211 1.00 19.74 C
|
|
ATOM 1257 N ALA E 236 5.236 41.659 17.239 1.00 13.61 N
|
|
ATOM 1258 CA ALA E 236 6.187 40.950 16.398 1.00 13.61 C
|
|
ATOM 1259 C ALA E 236 5.465 40.252 15.230 1.00 16.38 C
|
|
ATOM 1260 O ALA E 236 6.098 40.339 14.146 1.00 19.52 O
|
|
ATOM 1261 CB ALA E 236 6.956 39.832 17.099 1.00 13.63 C
|
|
ATOM 1262 N TYR E 237 4.335 39.603 15.418 1.00 14.55 N
|
|
ATOM 1263 CA TYR E 237 3.678 38.884 14.346 1.00 12.39 C
|
|
ATOM 1264 C TYR E 237 2.522 39.538 13.664 1.00 14.62 C
|
|
ATOM 1265 O TYR E 237 1.975 38.949 12.704 1.00 14.83 O
|
|
ATOM 1266 CB TYR E 237 3.294 37.466 14.872 1.00 13.61 C
|
|
ATOM 1267 CG TYR E 237 4.476 36.697 15.394 1.00 13.77 C
|
|
ATOM 1268 CD1 TYR E 237 5.629 36.556 14.644 1.00 11.13 C
|
|
ATOM 1269 CD2 TYR E 237 4.423 36.038 16.641 1.00 9.09 C
|
|
ATOM 1270 CE1 TYR E 237 6.727 35.825 15.115 1.00 16.34 C
|
|
ATOM 1271 CE2 TYR E 237 5.491 35.274 17.099 1.00 11.10 C
|
|
ATOM 1272 CZ TYR E 237 6.633 35.160 16.354 1.00 19.09 C
|
|
ATOM 1273 OH TYR E 237 7.703 34.457 16.792 1.00 11.55 O
|
|
ATOM 1274 N GLY E 238 2.154 40.721 14.110 1.00 15.31 N
|
|
ATOM 1275 CA GLY E 238 0.999 41.468 13.549 1.00 14.38 C
|
|
ATOM 1276 C GLY E 238 -0.307 40.737 13.728 1.00 16.71 C
|
|
ATOM 1277 O GLY E 238 -1.232 40.726 12.899 1.00 17.79 O
|
|
ATOM 1278 N VAL E 239 -0.482 40.023 14.860 1.00 13.69 N
|
|
ATOM 1279 CA VAL E 239 -1.660 39.254 15.198 1.00 10.97 C
|
|
ATOM 1280 C VAL E 239 -2.384 39.881 16.422 1.00 10.40 C
|
|
ATOM 1281 O VAL E 239 -1.781 40.699 17.111 1.00 14.16 O
|
|
ATOM 1282 CB VAL E 239 -1.317 37.761 15.461 1.00 7.95 C
|
|
ATOM 1283 CG1 VAL E 239 -0.802 37.144 14.126 1.00 12.37 C
|
|
ATOM 1284 CG2 VAL E 239 -0.317 37.466 16.553 1.00 11.97 C
|
|
ATOM 1285 N SER E 240 -3.630 39.462 16.525 1.00 11.80 N
|
|
ATOM 1286 CA SER E 240 -4.506 39.952 17.605 1.00 13.49 C
|
|
ATOM 1287 C SER E 240 -5.289 38.796 18.227 1.00 11.89 C
|
|
ATOM 1288 O SER E 240 -5.610 37.771 17.641 1.00 12.86 O
|
|
ATOM 1289 CB SER E 240 -5.497 40.939 16.976 1.00 24.24 C
|
|
ATOM 1290 OG SER E 240 -4.689 41.959 16.358 1.00 31.47 O
|
|
ATOM 1291 N VAL E 241 -5.641 39.015 19.498 1.00 17.02 N
|
|
ATOM 1292 CA VAL E 241 -6.447 38.039 20.251 1.00 20.20 C
|
|
ATOM 1293 C VAL E 241 -7.848 38.268 19.673 1.00 23.62 C
|
|
ATOM 1294 O VAL E 241 -8.105 39.331 19.104 1.00 25.50 O
|
|
ATOM 1295 CB VAL E 241 -6.384 38.197 21.785 1.00 22.24 C
|
|
ATOM 1296 CG1 VAL E 241 -5.031 37.870 22.415 1.00 18.84 C
|
|
ATOM 1297 CG2 VAL E 241 -6.933 39.538 22.208 1.00 23.34 C
|
|
ATOM 1298 N TYR E 242 -8.657 37.254 19.749 1.00 26.66 N
|
|
ATOM 1299 CA TYR E 242 -10.058 37.335 19.303 1.00 28.34 C
|
|
ATOM 1300 C TYR E 242 -10.877 36.539 20.323 1.00 26.91 C
|
|
ATOM 1301 O TYR E 242 -12.105 36.725 20.191 1.00 28.88 O
|
|
ATOM 1302 CB TYR E 242 -10.231 36.883 17.852 1.00 23.27 C
|
|
ATOM 1303 CG TYR E 242 -9.858 35.422 17.729 1.00 25.71 C
|
|
ATOM 1304 CD1 TYR E 242 -8.544 35.035 17.390 1.00 23.13 C
|
|
ATOM 1305 CD2 TYR E 242 -10.815 34.446 17.980 1.00 26.40 C
|
|
ATOM 1306 CE1 TYR E 242 -8.251 33.688 17.255 1.00 21.39 C
|
|
ATOM 1307 CE2 TYR E 242 -10.514 33.099 17.888 1.00 23.85 C
|
|
ATOM 1308 CZ TYR E 242 -9.228 32.728 17.494 1.00 22.48 C
|
|
ATOM 1309 OH TYR E 242 -8.946 31.387 17.410 1.00 21.89 O
|
|
ATOM 1310 OXT TYR E 242 -10.317 35.858 21.204 1.00 29.02 O
|
|
TER 1311 TYR E 242
|
|
ATOM 1312 N ASP I 7 25.100 14.110 33.198 1.00 41.61 N
|
|
ATOM 1313 CA ASP I 7 25.863 15.369 33.122 1.00 40.76 C
|
|
ATOM 1314 C ASP I 7 24.994 16.520 33.648 1.00 37.64 C
|
|
ATOM 1315 O ASP I 7 24.229 17.136 32.891 1.00 39.51 O
|
|
ATOM 1316 CB ASP I 7 26.448 15.691 31.744 1.00 43.59 C
|
|
ATOM 1317 CG ASP I 7 27.315 16.950 31.799 1.00 49.89 C
|
|
ATOM 1318 OD1 ASP I 7 26.961 17.932 32.473 1.00 52.41 O
|
|
ATOM 1319 OD2 ASP I 7 28.399 16.939 31.166 1.00 52.25 O
|
|
ATOM 1320 N CYS I 8 25.147 16.749 34.924 1.00 35.85 N
|
|
ATOM 1321 CA CYS I 8 24.470 17.801 35.681 1.00 34.01 C
|
|
ATOM 1322 C CYS I 8 25.616 18.684 36.195 1.00 38.94 C
|
|
ATOM 1323 O CYS I 8 25.616 19.077 37.362 1.00 39.68 O
|
|
ATOM 1324 CB CYS I 8 23.639 17.294 36.868 1.00 22.78 C
|
|
ATOM 1325 SG CYS I 8 22.288 16.160 36.462 1.00 21.61 S
|
|
ATOM 1326 N SER I 9 26.570 18.935 35.290 1.00 43.69 N
|
|
ATOM 1327 CA SER I 9 27.749 19.736 35.729 1.00 47.65 C
|
|
ATOM 1328 C SER I 9 27.390 21.219 35.812 1.00 47.83 C
|
|
ATOM 1329 O SER I 9 27.879 21.933 36.705 1.00 47.59 O
|
|
ATOM 1330 CB SER I 9 28.995 19.393 34.928 1.00 43.39 C
|
|
ATOM 1331 OG SER I 9 28.911 19.823 33.585 1.00 46.33 O
|
|
ATOM 1332 N GLU I 10 26.539 21.623 34.892 1.00 49.12 N
|
|
ATOM 1333 CA GLU I 10 26.078 23.007 34.800 1.00 48.99 C
|
|
ATOM 1334 C GLU I 10 24.986 23.351 35.812 1.00 46.85 C
|
|
ATOM 1335 O GLU I 10 24.258 24.349 35.581 1.00 45.46 O
|
|
ATOM 1336 CB GLU I 10 25.501 23.280 33.413 1.00 56.95 C
|
|
ATOM 1337 CG GLU I 10 26.027 22.500 32.206 1.00 66.13 C
|
|
ATOM 1338 CD GLU I 10 25.186 22.675 30.967 1.00 71.54 C
|
|
ATOM 1339 OE1 GLU I 10 25.312 23.580 30.150 1.00 74.97 O
|
|
ATOM 1340 OE2 GLU I 10 24.308 21.775 30.875 1.00 75.04 O
|
|
ATOM 1341 N TYR I 11 24.870 22.555 36.880 1.00 41.50 N
|
|
ATOM 1342 CA TYR I 11 23.812 22.822 37.872 1.00 34.92 C
|
|
ATOM 1343 C TYR I 11 24.375 23.057 39.259 1.00 34.57 C
|
|
ATOM 1344 O TYR I 11 25.545 22.708 39.502 1.00 33.64 O
|
|
ATOM 1345 CB TYR I 11 22.813 21.650 37.956 1.00 33.49 C
|
|
ATOM 1346 CG TYR I 11 21.993 21.563 36.681 1.00 26.15 C
|
|
ATOM 1347 CD1 TYR I 11 20.666 22.015 36.653 1.00 27.71 C
|
|
ATOM 1348 CD2 TYR I 11 22.566 21.077 35.509 1.00 23.81 C
|
|
ATOM 1349 CE1 TYR I 11 19.926 21.950 35.477 1.00 26.48 C
|
|
ATOM 1350 CE2 TYR I 11 21.826 20.990 34.334 1.00 25.85 C
|
|
ATOM 1351 CZ TYR I 11 20.515 21.459 34.318 1.00 27.07 C
|
|
ATOM 1352 OH TYR I 11 19.848 21.345 33.134 1.00 27.85 O
|
|
ATOM 1353 N PRO I 12 23.565 23.596 40.164 1.00 31.74 N
|
|
ATOM 1354 CA PRO I 12 22.178 23.972 39.984 1.00 31.43 C
|
|
ATOM 1355 C PRO I 12 21.922 25.221 39.144 1.00 30.70 C
|
|
ATOM 1356 O PRO I 12 22.825 26.055 38.956 1.00 29.52 O
|
|
ATOM 1357 CB PRO I 12 21.680 24.169 41.419 1.00 31.51 C
|
|
ATOM 1358 CG PRO I 12 22.917 24.632 42.160 1.00 32.68 C
|
|
ATOM 1359 CD PRO I 12 24.049 23.825 41.538 1.00 32.58 C
|
|
ATOM 1360 N LYS I 13 20.649 25.286 38.737 1.00 28.11 N
|
|
ATOM 1361 CA LYS I 13 20.144 26.415 37.920 1.00 26.00 C
|
|
ATOM 1362 C LYS I 13 19.006 27.058 38.697 1.00 25.49 C
|
|
ATOM 1363 O LYS I 13 18.180 26.350 39.283 1.00 23.40 O
|
|
ATOM 1364 CB LYS I 13 19.633 25.941 36.577 1.00 31.54 C
|
|
ATOM 1365 CG LYS I 13 20.835 25.526 35.701 1.00 35.60 C
|
|
ATOM 1366 CD LYS I 13 20.508 25.712 34.226 1.00 31.80 C
|
|
ATOM 1367 CE LYS I 13 21.017 24.501 33.477 1.00 30.51 C
|
|
ATOM 1368 NZ LYS I 13 20.599 24.529 32.066 1.00 38.74 N
|
|
ATOM 1369 N PRO I 14 18.961 28.383 38.641 1.00 25.24 N
|
|
ATOM 1370 CA PRO I 14 17.918 29.119 39.363 1.00 24.48 C
|
|
ATOM 1371 C PRO I 14 16.538 28.890 38.781 1.00 20.51 C
|
|
ATOM 1372 O PRO I 14 15.532 28.939 39.526 1.00 25.17 O
|
|
ATOM 1373 CB PRO I 14 18.470 30.542 39.430 1.00 26.34 C
|
|
ATOM 1374 CG PRO I 14 19.479 30.651 38.331 1.00 28.83 C
|
|
ATOM 1375 CD PRO I 14 19.892 29.245 37.908 1.00 25.90 C
|
|
ATOM 1376 N ALA I 15 16.446 28.503 37.518 1.00 15.33 N
|
|
ATOM 1377 CA ALA I 15 15.153 28.290 36.860 1.00 10.93 C
|
|
ATOM 1378 C ALA I 15 15.384 27.353 35.653 1.00 12.26 C
|
|
ATOM 1379 O ALA I 15 16.506 27.265 35.147 1.00 11.98 O
|
|
ATOM 1380 CB ALA I 15 14.379 29.501 36.338 1.00 18.53 C
|
|
ATOM 1381 N CYS I 16 14.244 26.753 35.306 1.00 7.33 N
|
|
ATOM 1382 CA CYS I 16 14.219 25.815 34.198 1.00 7.47 C
|
|
ATOM 1383 C CYS I 16 13.101 26.213 33.238 1.00 4.73 C
|
|
ATOM 1384 O CYS I 16 11.981 26.557 33.708 1.00 6.80 O
|
|
ATOM 1385 CB CYS I 16 13.805 24.381 34.665 1.00 10.04 C
|
|
ATOM 1386 SG CYS I 16 15.088 23.683 35.776 1.00 10.27 S
|
|
ATOM 1387 N THR I 17 13.351 25.962 31.923 1.00 4.73 N
|
|
ATOM 1388 CA THR I 17 12.225 26.077 30.983 1.00 4.32 C
|
|
ATOM 1389 C THR I 17 11.260 24.916 31.289 1.00 7.59 C
|
|
ATOM 1390 O THR I 17 11.698 23.923 31.927 1.00 8.04 O
|
|
ATOM 1391 CB THR I 17 12.707 26.028 29.464 1.00 5.15 C
|
|
ATOM 1392 OG1 THR I 17 13.478 24.839 29.253 1.00 9.07 O
|
|
ATOM 1393 CG2 THR I 17 13.483 27.320 29.074 1.00 6.44 C
|
|
ATOM 1394 N LEU I 18 10.009 24.959 30.923 1.00 4.93 N
|
|
ATOM 1395 CA LEU I 18 9.011 23.923 31.273 1.00 3.59 C
|
|
ATOM 1396 C LEU I 18 8.358 23.106 30.217 1.00 5.92 C
|
|
ATOM 1397 O LEU I 18 7.135 22.828 30.321 1.00 5.75 O
|
|
ATOM 1398 CB LEU I 18 7.982 24.681 32.214 1.00 6.82 C
|
|
ATOM 1399 CG LEU I 18 8.643 25.341 33.433 1.00 7.44 C
|
|
ATOM 1400 CD1 LEU I 18 7.631 26.290 34.059 1.00 11.03 C
|
|
ATOM 1401 CD2 LEU I 18 9.120 24.300 34.453 1.00 15.31 C
|
|
ATOM 1402 N GLU I 19 9.156 22.593 29.253 1.00 3.98 N
|
|
ATOM 1403 CA GLU I 19 8.638 21.655 28.233 1.00 5.11 C
|
|
ATOM 1404 C GLU I 19 8.677 20.292 28.942 1.00 7.44 C
|
|
ATOM 1405 O GLU I 19 9.475 20.102 29.907 1.00 7.80 O
|
|
ATOM 1406 CB GLU I 19 9.610 21.563 27.053 1.00 10.83 C
|
|
ATOM 1407 CG GLU I 19 11.056 21.077 27.225 1.00 12.27 C
|
|
ATOM 1408 CD GLU I 19 12.033 21.792 28.089 1.00 19.20 C
|
|
ATOM 1409 OE1 GLU I 19 11.964 22.882 28.643 1.00 13.20 O
|
|
ATOM 1410 OE2 GLU I 19 13.064 21.077 28.305 1.00 24.06 O
|
|
ATOM 1411 N TYR I 20 7.822 19.382 28.548 1.00 4.80 N
|
|
ATOM 1412 CA TYR I 20 7.767 18.041 29.149 1.00 8.70 C
|
|
ATOM 1413 C TYR I 20 8.516 17.016 28.297 1.00 9.54 C
|
|
ATOM 1414 O TYR I 20 7.992 16.809 27.205 1.00 8.15 O
|
|
ATOM 1415 CB TYR I 20 6.323 17.626 29.397 1.00 9.12 C
|
|
ATOM 1416 CG TYR I 20 6.101 16.296 30.078 1.00 5.79 C
|
|
ATOM 1417 CD1 TYR I 20 5.629 15.189 29.381 1.00 7.16 C
|
|
ATOM 1418 CD2 TYR I 20 6.253 16.220 31.485 1.00 10.54 C
|
|
ATOM 1419 CE1 TYR I 20 5.382 13.984 30.050 1.00 12.30 C
|
|
ATOM 1420 CE2 TYR I 20 6.011 15.015 32.162 1.00 12.76 C
|
|
ATOM 1421 CZ TYR I 20 5.559 13.914 31.437 1.00 12.07 C
|
|
ATOM 1422 OH TYR I 20 5.346 12.752 32.126 1.00 14.99 O
|
|
ATOM 1423 N ARG I 21 9.573 16.487 28.839 1.00 4.93 N
|
|
ATOM 1424 CA ARG I 21 10.330 15.396 28.093 1.00 9.17 C
|
|
ATOM 1425 C ARG I 21 10.859 14.579 29.289 1.00 3.64 C
|
|
ATOM 1426 O ARG I 21 11.981 14.851 29.731 1.00 9.04 O
|
|
ATOM 1427 CB ARG I 21 11.495 16.089 27.372 1.00 9.29 C
|
|
ATOM 1428 CG ARG I 21 11.086 16.918 26.173 1.00 24.58 C
|
|
ATOM 1429 CD ARG I 21 12.174 17.904 25.874 1.00 34.11 C
|
|
ATOM 1430 NE ARG I 21 12.962 17.506 24.730 1.00 41.71 N
|
|
ATOM 1431 CZ ARG I 21 13.376 16.296 24.348 1.00 50.99 C
|
|
ATOM 1432 NH1 ARG I 21 14.124 16.160 23.228 1.00 49.02 N
|
|
ATOM 1433 NH2 ARG I 21 13.057 15.217 25.081 1.00 50.18 N
|
|
ATOM 1434 N PRO I 22 10.058 13.559 29.628 1.00 5.83 N
|
|
ATOM 1435 CA PRO I 22 10.345 12.899 30.947 1.00 7.25 C
|
|
ATOM 1436 C PRO I 22 11.508 12.016 31.138 1.00 10.13 C
|
|
ATOM 1437 O PRO I 22 11.949 11.411 30.130 1.00 9.44 O
|
|
ATOM 1438 CB PRO I 22 8.990 12.262 31.277 1.00 8.10 C
|
|
ATOM 1439 CG PRO I 22 8.292 12.060 29.938 1.00 9.10 C
|
|
ATOM 1440 CD PRO I 22 8.730 13.265 29.122 1.00 9.95 C
|
|
ATOM 1441 N LEU I 23 12.017 11.929 32.361 1.00 8.59 N
|
|
ATOM 1442 CA LEU I 23 13.118 11.008 32.720 1.00 8.28 C
|
|
ATOM 1443 C LEU I 23 12.687 10.255 33.987 1.00 10.69 C
|
|
ATOM 1444 O LEU I 23 11.955 10.909 34.720 1.00 10.00 O
|
|
ATOM 1445 CB LEU I 23 14.372 11.825 33.098 1.00 11.21 C
|
|
ATOM 1446 CG LEU I 23 14.969 12.736 32.062 1.00 18.03 C
|
|
ATOM 1447 CD1 LEU I 23 16.291 13.330 32.513 1.00 18.98 C
|
|
ATOM 1448 CD2 LEU I 23 15.186 11.798 30.863 1.00 25.19 C
|
|
ATOM 1449 N CYS I 24 13.219 9.072 34.194 1.00 6.90 N
|
|
ATOM 1450 CA CYS I 24 12.739 8.303 35.378 1.00 5.95 C
|
|
ATOM 1451 C CYS I 24 13.885 8.194 36.362 1.00 9.15 C
|
|
ATOM 1452 O CYS I 24 14.947 7.671 36.003 1.00 10.84 O
|
|
ATOM 1453 CB CYS I 24 12.290 6.913 34.884 1.00 9.96 C
|
|
ATOM 1454 SG CYS I 24 11.809 5.975 36.378 1.00 10.57 S
|
|
ATOM 1455 N GLY I 25 13.691 8.745 37.562 1.00 6.36 N
|
|
ATOM 1456 CA GLY I 25 14.747 8.756 38.594 1.00 7.00 C
|
|
ATOM 1457 C GLY I 25 14.823 7.420 39.351 1.00 10.04 C
|
|
ATOM 1458 O GLY I 25 13.836 6.679 39.307 1.00 8.28 O
|
|
ATOM 1459 N SER I 26 15.952 7.295 40.016 1.00 8.11 N
|
|
ATOM 1460 CA SER I 26 16.212 6.063 40.841 1.00 9.17 C
|
|
ATOM 1461 C SER I 26 15.265 6.063 42.049 1.00 10.42 C
|
|
ATOM 1462 O SER I 26 15.147 5.016 42.730 1.00 10.18 O
|
|
ATOM 1463 CB SER I 26 17.665 6.057 41.244 1.00 10.44 C
|
|
ATOM 1464 OG SER I 26 18.027 7.169 42.025 1.00 11.10 O
|
|
ATOM 1465 N ASP I 27 14.610 7.169 42.280 1.00 9.05 N
|
|
ATOM 1466 CA ASP I 27 13.600 7.327 43.356 1.00 9.19 C
|
|
ATOM 1467 C ASP I 27 12.232 6.957 42.842 1.00 11.55 C
|
|
ATOM 1468 O ASP I 27 11.244 7.088 43.579 1.00 10.71 O
|
|
ATOM 1469 CB ASP I 27 13.757 8.712 44.001 1.00 6.74 C
|
|
ATOM 1470 CG ASP I 27 13.413 9.825 42.985 1.00 12.86 C
|
|
ATOM 1471 OD1 ASP I 27 13.238 9.541 41.790 1.00 7.50 O
|
|
ATOM 1472 OD2 ASP I 27 13.444 11.002 43.368 1.00 9.59 O
|
|
ATOM 1473 N ASN I 28 12.120 6.477 41.598 1.00 8.60 N
|
|
ATOM 1474 CA ASN I 28 10.919 6.068 40.957 1.00 9.08 C
|
|
ATOM 1475 C ASN I 28 9.982 7.295 40.694 1.00 7.84 C
|
|
ATOM 1476 O ASN I 28 8.802 7.022 40.427 1.00 9.63 O
|
|
ATOM 1477 CB ASN I 28 10.076 5.010 41.686 1.00 9.63 C
|
|
ATOM 1478 CG ASN I 28 10.873 3.784 42.061 1.00 18.39 C
|
|
ATOM 1479 OD1 ASN I 28 11.374 3.129 41.156 1.00 15.28 O
|
|
ATOM 1480 ND2 ASN I 28 11.000 3.467 43.360 1.00 20.71 N
|
|
ATOM 1481 N LYS I 29 10.571 8.456 40.686 1.00 8.75 N
|
|
ATOM 1482 CA LYS I 29 9.745 9.645 40.379 1.00 7.64 C
|
|
ATOM 1483 C LYS I 29 10.007 10.032 38.904 1.00 5.89 C
|
|
ATOM 1484 O LYS I 29 11.198 9.983 38.526 1.00 8.71 O
|
|
ATOM 1485 CB LYS I 29 10.148 10.844 41.256 1.00 8.02 C
|
|
ATOM 1486 CG LYS I 29 9.444 12.163 40.877 1.00 10.57 C
|
|
ATOM 1487 CD LYS I 29 9.683 13.243 41.925 1.00 14.51 C
|
|
ATOM 1488 CE LYS I 29 8.841 14.464 41.582 1.00 21.51 C
|
|
ATOM 1489 NZ LYS I 29 9.216 15.522 42.606 1.00 30.38 N
|
|
ATOM 1490 N THR I 30 8.925 10.321 38.211 1.00 7.37 N
|
|
ATOM 1491 CA THR I 30 9.119 10.888 36.840 1.00 6.73 C
|
|
ATOM 1492 C THR I 30 9.511 12.371 36.984 1.00 8.34 C
|
|
ATOM 1493 O THR I 30 8.714 13.112 37.589 1.00 8.60 O
|
|
ATOM 1494 CB THR I 30 7.863 10.740 35.924 1.00 11.47 C
|
|
ATOM 1495 OG1 THR I 30 7.687 9.296 35.800 1.00 10.97 O
|
|
ATOM 1496 CG2 THR I 30 8.117 11.476 34.553 1.00 6.73 C
|
|
ATOM 1497 N TYR I 31 10.639 12.747 36.426 1.00 6.84 N
|
|
ATOM 1498 CA TYR I 31 11.149 14.126 36.366 1.00 4.52 C
|
|
ATOM 1499 C TYR I 31 10.708 14.688 34.971 1.00 7.69 C
|
|
ATOM 1500 O TYR I 31 10.914 14.012 33.995 1.00 9.27 O
|
|
ATOM 1501 CB TYR I 31 12.634 14.290 36.621 1.00 5.12 C
|
|
ATOM 1502 CG TYR I 31 12.858 14.033 38.135 1.00 5.93 C
|
|
ATOM 1503 CD1 TYR I 31 12.765 15.129 39.024 1.00 7.19 C
|
|
ATOM 1504 CD2 TYR I 31 13.126 12.763 38.582 1.00 7.90 C
|
|
ATOM 1505 CE1 TYR I 31 12.974 14.851 40.379 1.00 8.84 C
|
|
ATOM 1506 CE2 TYR I 31 13.305 12.507 39.941 1.00 7.97 C
|
|
ATOM 1507 CZ TYR I 31 13.201 13.565 40.833 1.00 10.80 C
|
|
ATOM 1508 OH TYR I 31 13.386 13.254 42.156 1.00 11.70 O
|
|
ATOM 1509 N GLY I 32 10.099 15.860 35.031 1.00 4.78 N
|
|
ATOM 1510 CA GLY I 32 9.495 16.460 33.816 1.00 7.46 C
|
|
ATOM 1511 C GLY I 32 10.447 16.809 32.712 1.00 5.53 C
|
|
ATOM 1512 O GLY I 32 9.990 16.830 31.509 1.00 9.38 O
|
|
ATOM 1513 N ASN I 33 11.674 17.136 32.983 1.00 6.54 N
|
|
ATOM 1514 CA ASN I 33 12.696 17.425 31.991 1.00 9.42 C
|
|
ATOM 1515 C ASN I 33 14.047 17.316 32.624 1.00 9.47 C
|
|
ATOM 1516 O ASN I 33 14.146 17.163 33.852 1.00 10.69 O
|
|
ATOM 1517 CB ASN I 33 12.427 18.755 31.214 1.00 8.26 C
|
|
ATOM 1518 CG ASN I 33 12.468 19.976 32.106 1.00 11.52 C
|
|
ATOM 1519 OD1 ASN I 33 13.145 20.052 33.150 1.00 9.00 O
|
|
ATOM 1520 ND2 ASN I 33 11.723 21.007 31.712 1.00 6.41 N
|
|
ATOM 1521 N LYS I 34 15.109 17.403 31.827 1.00 7.75 N
|
|
ATOM 1522 CA LYS I 34 16.462 17.234 32.369 1.00 10.89 C
|
|
ATOM 1523 C LYS I 34 16.832 18.302 33.369 1.00 10.38 C
|
|
ATOM 1524 O LYS I 34 17.574 17.997 34.306 1.00 10.75 O
|
|
ATOM 1525 CB LYS I 34 17.475 17.141 31.230 1.00 16.16 C
|
|
ATOM 1526 CG LYS I 34 18.857 16.787 31.807 1.00 30.18 C
|
|
ATOM 1527 CD LYS I 34 19.677 15.980 30.803 1.00 42.77 C
|
|
ATOM 1528 CE LYS I 34 21.170 16.029 31.134 1.00 48.50 C
|
|
ATOM 1529 NZ LYS I 34 21.711 17.386 30.799 1.00 54.07 N
|
|
ATOM 1530 N CYS I 35 16.356 19.551 33.126 1.00 7.32 N
|
|
ATOM 1531 CA CYS I 35 16.702 20.636 34.115 1.00 10.19 C
|
|
ATOM 1532 C CYS I 35 16.049 20.320 35.469 1.00 10.35 C
|
|
ATOM 1533 O CYS I 35 16.744 20.538 36.490 1.00 9.03 O
|
|
ATOM 1534 CB CYS I 35 16.292 21.999 33.557 1.00 13.47 C
|
|
ATOM 1535 SG CYS I 35 16.652 23.449 34.617 1.00 12.26 S
|
|
ATOM 1536 N ASN I 36 14.790 19.823 35.450 1.00 8.75 N
|
|
ATOM 1537 CA ASN I 36 14.196 19.480 36.757 1.00 8.06 C
|
|
ATOM 1538 C ASN I 36 14.966 18.341 37.422 1.00 8.12 C
|
|
ATOM 1539 O ASN I 36 15.228 18.357 38.649 1.00 8.46 O
|
|
ATOM 1540 CB ASN I 36 12.695 19.202 36.609 1.00 10.71 C
|
|
ATOM 1541 CG ASN I 36 11.880 20.472 36.705 1.00 24.31 C
|
|
ATOM 1542 OD1 ASN I 36 12.003 21.426 35.908 1.00 27.49 O
|
|
ATOM 1543 ND2 ASN I 36 10.962 20.489 37.649 1.00 17.04 N
|
|
ATOM 1544 N PHE I 37 15.276 17.299 36.617 1.00 7.69 N
|
|
ATOM 1545 CA PHE I 37 16.066 16.160 37.143 1.00 7.85 C
|
|
ATOM 1546 C PHE I 37 17.407 16.640 37.713 1.00 9.36 C
|
|
ATOM 1547 O PHE I 37 17.763 16.274 38.853 1.00 12.19 O
|
|
ATOM 1548 CB PHE I 37 16.281 15.146 36.011 1.00 8.91 C
|
|
ATOM 1549 CG PHE I 37 17.158 13.984 36.406 1.00 8.98 C
|
|
ATOM 1550 CD1 PHE I 37 16.607 13.030 37.287 1.00 12.59 C
|
|
ATOM 1551 CD2 PHE I 37 18.483 13.952 36.023 1.00 8.85 C
|
|
ATOM 1552 CE1 PHE I 37 17.450 11.967 37.693 1.00 12.27 C
|
|
ATOM 1553 CE2 PHE I 37 19.331 12.910 36.454 1.00 14.69 C
|
|
ATOM 1554 CZ PHE I 37 18.777 11.934 37.283 1.00 14.71 C
|
|
ATOM 1555 N CYS I 38 18.209 17.414 36.960 1.00 8.52 N
|
|
ATOM 1556 CA CYS I 38 19.509 17.839 37.498 1.00 14.24 C
|
|
ATOM 1557 C CYS I 38 19.415 18.662 38.761 1.00 14.45 C
|
|
ATOM 1558 O CYS I 38 20.282 18.591 39.670 1.00 14.71 O
|
|
ATOM 1559 CB CYS I 38 20.277 18.510 36.358 1.00 12.76 C
|
|
ATOM 1560 SG CYS I 38 21.108 17.337 35.278 1.00 18.35 S
|
|
ATOM 1561 N ASN I 39 18.407 19.496 38.885 1.00 13.01 N
|
|
ATOM 1562 CA ASN I 39 18.161 20.303 40.088 1.00 17.25 C
|
|
ATOM 1563 C ASN I 39 17.926 19.300 41.240 1.00 14.69 C
|
|
ATOM 1564 O ASN I 39 18.517 19.605 42.284 1.00 13.34 O
|
|
ATOM 1565 CB ASN I 39 17.044 21.334 39.968 1.00 17.10 C
|
|
ATOM 1566 CG ASN I 39 17.573 22.642 39.355 1.00 17.38 C
|
|
ATOM 1567 OD1 ASN I 39 18.778 22.849 39.243 1.00 20.42 O
|
|
ATOM 1568 ND2 ASN I 39 16.660 23.525 38.952 1.00 19.69 N
|
|
ATOM 1569 N ALA I 40 17.148 18.264 41.072 1.00 12.48 N
|
|
ATOM 1570 CA ALA I 40 16.898 17.261 42.112 1.00 10.83 C
|
|
ATOM 1571 C ALA I 40 18.171 16.487 42.447 1.00 13.08 C
|
|
ATOM 1572 O ALA I 40 18.374 16.171 43.611 1.00 14.67 O
|
|
ATOM 1573 CB ALA I 40 15.805 16.291 41.642 1.00 14.13 C
|
|
ATOM 1574 N VAL I 41 19.024 16.182 41.499 1.00 11.70 N
|
|
ATOM 1575 CA VAL I 41 20.328 15.505 41.754 1.00 12.14 C
|
|
ATOM 1576 C VAL I 41 21.147 16.411 42.682 1.00 15.55 C
|
|
ATOM 1577 O VAL I 41 21.647 15.914 43.686 1.00 15.90 O
|
|
ATOM 1578 CB VAL I 41 21.131 15.298 40.455 1.00 11.38 C
|
|
ATOM 1579 CG1 VAL I 41 22.566 14.786 40.686 1.00 14.27 C
|
|
ATOM 1580 CG2 VAL I 41 20.439 14.306 39.542 1.00 9.58 C
|
|
ATOM 1581 N VAL I 42 21.197 17.703 42.331 1.00 15.79 N
|
|
ATOM 1582 CA VAL I 42 21.970 18.651 43.188 1.00 20.03 C
|
|
ATOM 1583 C VAL I 42 21.445 18.651 44.615 1.00 21.06 C
|
|
ATOM 1584 O VAL I 42 22.199 18.548 45.611 1.00 19.98 O
|
|
ATOM 1585 CB VAL I 42 21.934 20.058 42.539 1.00 24.43 C
|
|
ATOM 1586 CG1 VAL I 42 22.330 21.137 43.543 1.00 29.30 C
|
|
ATOM 1587 CG2 VAL I 42 22.781 20.096 41.283 1.00 24.55 C
|
|
ATOM 1588 N GLU I 43 20.149 18.826 44.726 1.00 18.29 N
|
|
ATOM 1589 CA GLU I 43 19.430 18.809 45.982 1.00 20.63 C
|
|
ATOM 1590 C GLU I 43 19.710 17.539 46.787 1.00 20.19 C
|
|
ATOM 1591 O GLU I 43 19.652 17.610 48.018 1.00 21.80 O
|
|
ATOM 1592 CB GLU I 43 17.902 18.913 45.850 1.00 19.81 C
|
|
ATOM 1593 CG GLU I 43 17.164 19.404 47.089 1.00 31.50 C
|
|
ATOM 1594 CD GLU I 43 15.748 19.862 46.922 1.00 33.91 C
|
|
ATOM 1595 OE1 GLU I 43 15.011 20.047 47.882 1.00 30.63 O
|
|
ATOM 1596 OE2 GLU I 43 15.449 19.949 45.703 1.00 41.05 O
|
|
ATOM 1597 N SER I 44 19.939 16.427 46.109 1.00 17.17 N
|
|
ATOM 1598 CA SER I 44 20.175 15.162 46.799 1.00 13.65 C
|
|
ATOM 1599 C SER I 44 21.638 14.998 47.141 1.00 15.70 C
|
|
ATOM 1600 O SER I 44 21.950 13.930 47.679 1.00 15.95 O
|
|
ATOM 1601 CB SER I 44 19.697 13.957 45.966 1.00 13.35 C
|
|
ATOM 1602 OG SER I 44 20.689 13.723 44.954 1.00 15.18 O
|
|
ATOM 1603 N ASN I 45 22.472 15.947 46.779 1.00 13.62 N
|
|
ATOM 1604 CA ASN I 45 23.914 15.893 47.038 1.00 17.33 C
|
|
ATOM 1605 C ASN I 45 24.537 14.682 46.328 1.00 17.69 C
|
|
ATOM 1606 O ASN I 45 25.415 13.957 46.850 1.00 15.41 O
|
|
ATOM 1607 CB ASN I 45 24.138 15.898 48.560 1.00 17.85 C
|
|
ATOM 1608 CG ASN I 45 25.597 16.051 48.911 1.00 25.81 C
|
|
ATOM 1609 OD1 ASN I 45 26.317 16.841 48.289 1.00 27.74 O
|
|
ATOM 1610 ND2 ASN I 45 25.982 15.287 49.943 1.00 27.23 N
|
|
ATOM 1611 N GLY I 46 24.001 14.470 45.129 1.00 14.46 N
|
|
ATOM 1612 CA GLY I 46 24.470 13.434 44.224 1.00 16.45 C
|
|
ATOM 1613 C GLY I 46 23.990 12.022 44.483 1.00 15.93 C
|
|
ATOM 1614 O GLY I 46 24.558 11.106 43.890 1.00 19.57 O
|
|
ATOM 1615 N THR I 47 22.964 11.858 45.288 1.00 8.77 N
|
|
ATOM 1616 CA THR I 47 22.439 10.511 45.611 1.00 12.83 C
|
|
ATOM 1617 C THR I 47 21.492 9.972 44.571 1.00 16.78 C
|
|
ATOM 1618 O THR I 47 21.402 8.750 44.392 1.00 20.88 O
|
|
ATOM 1619 CB THR I 47 21.953 10.904 47.066 1.00 16.62 C
|
|
ATOM 1620 OG1 THR I 47 22.909 10.212 47.926 1.00 22.68 O
|
|
ATOM 1621 CG2 THR I 47 20.483 10.909 47.269 1.00 16.77 C
|
|
ATOM 1622 N LEU I 48 20.742 10.828 43.917 1.00 12.44 N
|
|
ATOM 1623 CA LEU I 48 19.727 10.484 42.901 1.00 9.93 C
|
|
ATOM 1624 C LEU I 48 20.385 10.184 41.554 1.00 10.92 C
|
|
ATOM 1625 O LEU I 48 21.324 10.937 41.204 1.00 12.36 O
|
|
ATOM 1626 CB LEU I 48 18.792 11.716 42.790 1.00 8.79 C
|
|
ATOM 1627 CG LEU I 48 17.675 11.586 41.770 1.00 14.95 C
|
|
ATOM 1628 CD1 LEU I 48 16.685 10.462 42.112 1.00 19.51 C
|
|
ATOM 1629 CD2 LEU I 48 16.917 12.932 41.746 1.00 14.56 C
|
|
ATOM 1630 N THR I 49 19.915 9.176 40.877 1.00 12.56 N
|
|
ATOM 1631 CA THR I 49 20.514 8.778 39.594 1.00 11.72 C
|
|
ATOM 1632 C THR I 49 19.405 8.521 38.602 1.00 10.52 C
|
|
ATOM 1633 O THR I 49 18.215 8.472 38.960 1.00 9.46 O
|
|
ATOM 1634 CB THR I 49 21.484 7.546 39.717 1.00 12.87 C
|
|
ATOM 1635 OG1 THR I 49 20.687 6.395 40.120 1.00 16.10 O
|
|
ATOM 1636 CG2 THR I 49 22.661 7.802 40.662 1.00 16.76 C
|
|
ATOM 1637 N LEU I 50 19.848 8.407 37.362 1.00 9.05 N
|
|
ATOM 1638 CA LEU I 50 18.832 8.145 36.298 1.00 9.94 C
|
|
ATOM 1639 C LEU I 50 18.579 6.651 36.135 1.00 12.23 C
|
|
ATOM 1640 O LEU I 50 19.570 5.894 35.920 1.00 12.92 O
|
|
ATOM 1641 CB LEU I 50 19.413 8.761 34.999 1.00 13.55 C
|
|
ATOM 1642 CG LEU I 50 18.363 8.603 33.868 1.00 13.32 C
|
|
ATOM 1643 CD1 LEU I 50 17.207 9.546 34.119 1.00 19.19 C
|
|
ATOM 1644 CD2 LEU I 50 19.139 8.865 32.584 1.00 18.36 C
|
|
ATOM 1645 N SER I 51 17.380 6.215 36.211 1.00 8.78 N
|
|
ATOM 1646 CA SER I 51 16.949 4.809 35.984 1.00 8.04 C
|
|
ATOM 1647 C SER I 51 16.834 4.531 34.477 1.00 11.25 C
|
|
ATOM 1648 O SER I 51 17.480 3.604 33.923 1.00 11.94 O
|
|
ATOM 1649 CB SER I 51 15.644 4.580 36.713 1.00 15.55 C
|
|
ATOM 1650 OG SER I 51 15.221 3.260 36.366 1.00 24.31 O
|
|
ATOM 1651 N HIS I 52 16.075 5.376 33.784 1.00 9.07 N
|
|
ATOM 1652 CA HIS I 52 15.969 5.261 32.325 1.00 11.69 C
|
|
ATOM 1653 C HIS I 52 15.292 6.526 31.768 1.00 13.08 C
|
|
ATOM 1654 O HIS I 52 14.699 7.306 32.537 1.00 10.03 O
|
|
ATOM 1655 CB HIS I 52 15.116 4.089 31.823 1.00 11.61 C
|
|
ATOM 1656 CG HIS I 52 13.782 3.936 32.449 1.00 7.44 C
|
|
ATOM 1657 ND1 HIS I 52 12.624 4.612 32.007 1.00 10.00 N
|
|
ATOM 1658 CD2 HIS I 52 13.433 3.288 33.585 1.00 9.74 C
|
|
ATOM 1659 CE1 HIS I 52 11.657 4.285 32.828 1.00 10.50 C
|
|
ATOM 1660 NE2 HIS I 52 12.093 3.473 33.768 1.00 13.47 N
|
|
ATOM 1661 N PHE I 53 15.378 6.608 30.421 1.00 8.43 N
|
|
ATOM 1662 CA PHE I 53 14.619 7.725 29.783 1.00 6.85 C
|
|
ATOM 1663 C PHE I 53 13.153 7.393 29.664 1.00 11.45 C
|
|
ATOM 1664 O PHE I 53 12.698 6.215 29.504 1.00 14.04 O
|
|
ATOM 1665 CB PHE I 53 15.284 8.140 28.472 1.00 7.46 C
|
|
ATOM 1666 CG PHE I 53 16.736 8.456 28.592 1.00 8.72 C
|
|
ATOM 1667 CD1 PHE I 53 17.716 7.447 28.436 1.00 8.88 C
|
|
ATOM 1668 CD2 PHE I 53 17.129 9.759 28.910 1.00 14.65 C
|
|
ATOM 1669 CE1 PHE I 53 19.060 7.791 28.516 1.00 12.66 C
|
|
ATOM 1670 CE2 PHE I 53 18.487 10.075 29.046 1.00 12.53 C
|
|
ATOM 1671 CZ PHE I 53 19.451 9.083 28.839 1.00 15.10 C
|
|
ATOM 1672 N GLY I 54 12.325 8.445 29.660 1.00 11.29 N
|
|
ATOM 1673 CA GLY I 54 10.876 8.380 29.608 1.00 10.50 C
|
|
ATOM 1674 C GLY I 54 10.237 8.342 31.010 1.00 9.88 C
|
|
ATOM 1675 O GLY I 54 10.935 8.423 32.035 1.00 13.17 O
|
|
ATOM 1676 N LYS I 55 8.911 8.222 31.030 1.00 9.05 N
|
|
ATOM 1677 CA LYS I 55 8.212 8.118 32.337 1.00 10.85 C
|
|
ATOM 1678 C LYS I 55 8.626 6.859 33.098 1.00 13.46 C
|
|
ATOM 1679 O LYS I 55 8.933 5.790 32.525 1.00 13.82 O
|
|
ATOM 1680 CB LYS I 55 6.702 7.944 32.078 1.00 16.04 C
|
|
ATOM 1681 CG LYS I 55 6.051 9.307 31.871 1.00 19.97 C
|
|
ATOM 1682 CD LYS I 55 4.615 9.061 31.373 1.00 28.17 C
|
|
ATOM 1683 CE LYS I 55 4.089 10.326 30.700 1.00 35.77 C
|
|
ATOM 1684 NZ LYS I 55 2.873 9.934 29.915 1.00 42.55 N
|
|
ATOM 1685 N CYS I 56 8.476 6.902 34.414 1.00 11.33 N
|
|
ATOM 1686 CA CYS I 56 8.698 5.736 35.282 1.00 11.44 C
|
|
ATOM 1687 C CYS I 56 7.483 4.781 35.167 1.00 16.54 C
|
|
ATOM 1688 O CYS I 56 6.365 5.234 34.840 1.00 20.62 O
|
|
ATOM 1689 CB CYS I 56 8.785 6.112 36.757 1.00 11.71 C
|
|
ATOM 1690 SG CYS I 56 10.261 6.989 37.199 1.00 10.45 S
|
|
ATOM 1691 OXT CYS I 56 7.733 3.598 35.450 1.00 23.90 O
|
|
TER 1692 CYS I 56
|
|
HETATM 1693 O HOH E 243 -12.591 35.911 22.839 1.00 5.57 O
|
|
HETATM 1694 O HOH E 244 -7.974 36.046 35.939 1.00 9.82 O
|
|
HETATM 1695 O HOH E 245 1.095 27.214 31.984 1.00 9.85 O
|
|
HETATM 1696 O HOH E 246 3.896 19.560 42.723 1.00 11.99 O
|
|
HETATM 1697 O HOH E 247 -4.968 43.235 40.022 0.94 10.64 O
|
|
HETATM 1698 O HOH E 248 -7.031 31.952 23.332 0.80 8.48 O
|
|
HETATM 1699 O HOH E 249 15.929 41.928 31.758 1.00 14.17 O
|
|
HETATM 1700 O HOH E 250 -0.688 46.226 39.513 1.00 14.39 O
|
|
HETATM 1701 O HOH E 251 13.222 40.188 25.599 0.94 12.93 O
|
|
HETATM 1702 O HOH E 252 -1.446 21.452 40.243 0.82 10.15 O
|
|
HETATM 1703 O HOH E 253 1.926 41.819 27.988 0.89 12.56 O
|
|
HETATM 1704 O HOH E 254 8.602 42.566 32.083 0.93 14.29 O
|
|
HETATM 1705 O HOH E 255 -4.786 19.114 23.186 0.97 15.55 O
|
|
HETATM 1706 O HOH E 256 11.516 24.103 37.381 1.00 17.17 O
|
|
HETATM 1707 O HOH E 257 22.956 40.814 28.561 1.00 17.25 O
|
|
HETATM 1708 O HOH E 258 4.677 17.502 37.607 0.87 13.53 O
|
|
HETATM 1709 O HOH E 259 5.894 17.488 35.036 0.84 13.94 O
|
|
HETATM 1710 O HOH E 260 9.911 45.395 38.945 1.00 19.84 O
|
|
HETATM 1711 O HOH E 261 3.562 43.107 30.048 1.00 20.17 O
|
|
HETATM 1712 O HOH E 262 7.455 18.685 15.541 0.98 19.90 O
|
|
HETATM 1713 O HOH E 263 9.916 35.128 15.629 0.89 16.75 O
|
|
HETATM 1714 O HOH E 264 0.533 9.670 13.651 0.86 16.24 O
|
|
HETATM 1715 O HOH E 265 -7.940 29.015 33.586 1.00 23.95 O
|
|
HETATM 1716 O HOH E 266 -7.800 34.365 22.094 0.97 22.54 O
|
|
HETATM 1717 O HOH E 267 -3.160 37.892 43.838 0.95 21.86 O
|
|
HETATM 1718 O HOH E 268 2.045 13.279 27.858 1.00 24.27 O
|
|
HETATM 1719 O HOH E 269 10.783 38.550 16.997 0.88 19.52 O
|
|
HETATM 1720 O HOH E 270 -7.157 29.814 40.437 0.96 24.10 O
|
|
HETATM 1721 O HOH E 271 3.839 29.514 44.385 0.82 18.15 O
|
|
HETATM 1722 O HOH E 272 20.172 35.537 25.216 1.00 27.03 O
|
|
HETATM 1723 O HOH E 273 -5.280 44.951 37.631 0.94 24.08 O
|
|
HETATM 1724 O HOH E 274 6.731 26.885 39.873 1.00 27.81 O
|
|
HETATM 1725 O HOH E 275 -3.730 10.132 21.970 0.92 23.60 O
|
|
HETATM 1726 O HOH E 276 6.129 16.503 10.602 0.95 25.59 O
|
|
HETATM 1727 O HOH E 277 13.889 29.942 18.298 0.86 21.35 O
|
|
HETATM 1728 O HOH E 278 4.301 48.185 37.523 0.70 14.22 O
|
|
HETATM 1729 O HOH E 279 -0.765 33.779 45.667 0.84 21.23 O
|
|
HETATM 1730 O HOH E 280 -15.873 33.764 30.197 0.91 25.04 O
|
|
HETATM 1731 O HOH E 281 -2.118 47.872 29.201 0.76 17.63 O
|
|
HETATM 1732 O HOH E 282 -10.492 43.000 28.156 1.00 31.01 O
|
|
HETATM 1733 O HOH E 283 8.308 36.397 42.949 0.93 27.34 O
|
|
HETATM 1734 O HOH E 284 -1.700 41.528 44.291 0.99 31.50 O
|
|
HETATM 1735 O HOH E 285 7.668 33.741 44.187 0.90 26.14 O
|
|
HETATM 1736 O HOH E 286 -8.192 24.086 34.318 1.00 33.25 O
|
|
HETATM 1737 O HOH E 287 9.219 25.236 46.576 1.00 33.93 O
|
|
HETATM 1738 O HOH E 288 3.118 41.612 44.017 0.65 14.33 O
|
|
HETATM 1739 O HOH E 289 8.257 16.134 13.193 1.00 34.31 O
|
|
HETATM 1740 O HOH E 290 0.827 38.875 10.242 0.82 23.43 O
|
|
HETATM 1741 O HOH E 291 7.816 43.120 19.695 0.56 11.06 O
|
|
HETATM 1742 O HOH E 292 -1.672 16.630 34.329 0.62 13.70 O
|
|
HETATM 1743 O HOH E 293 -4.917 19.364 27.420 0.62 13.60 O
|
|
HETATM 1744 O HOH E 294 11.357 38.917 26.300 0.84 25.84 O
|
|
HETATM 1745 O HOH E 295 9.311 21.076 21.270 0.67 17.11 O
|
|
HETATM 1746 O HOH E 296 -0.022 20.290 8.492 0.85 27.71 O
|
|
HETATM 1747 O HOH E 297 -4.717 41.812 20.120 0.75 21.75 O
|
|
HETATM 1748 O HOH E 298 9.009 24.404 38.120 0.71 19.77 O
|
|
HETATM 1749 O HOH E 299 9.669 19.899 23.607 0.93 33.90 O
|
|
HETATM 1750 O HOH E 300 -11.406 41.398 33.101 0.75 22.13 O
|
|
HETATM 1751 O HOH E 301 10.027 41.283 20.398 0.66 17.06 O
|
|
HETATM 1752 O HOH E 302 -10.174 20.828 20.659 0.83 27.50 O
|
|
HETATM 1753 O HOH E 303 -9.147 18.100 10.108 1.00 40.68 O
|
|
HETATM 1754 O HOH E 304 -4.924 21.959 39.072 0.75 23.76 O
|
|
HETATM 1755 O HOH E 305 -5.398 21.744 31.986 0.91 34.31 O
|
|
HETATM 1756 O HOH E 306 7.110 31.900 26.913 0.69 20.20 O
|
|
HETATM 1757 O HOH E 307 17.732 29.475 19.693 0.61 15.67 O
|
|
HETATM 1758 O HOH E 308 -5.631 46.633 31.867 0.86 31.32 O
|
|
HETATM 1759 O HOH E 309 -7.368 23.671 36.550 0.63 16.66 O
|
|
HETATM 1760 O HOH E 310 10.731 19.134 14.074 0.79 26.90 O
|
|
HETATM 1761 O HOH E 311 4.742 45.945 31.578 0.64 17.58 O
|
|
HETATM 1762 O HOH E 312 0.291 36.779 8.789 0.83 30.33 O
|
|
HETATM 1763 O HOH E 313 1.418 15.405 33.187 0.69 21.01 O
|
|
HETATM 1764 O HOH E 314 3.802 28.208 8.426 1.00 44.84 O
|
|
HETATM 1765 O HOH E 315 0.258 29.443 42.095 0.60 16.55 O
|
|
HETATM 1766 O HOH E 316 8.983 44.702 41.807 0.77 27.17 O
|
|
HETATM 1767 O HOH E 317 0.829 32.062 44.463 0.76 26.44 O
|
|
HETATM 1768 O HOH E 318 -6.402 45.770 27.680 0.93 40.98 O
|
|
HETATM 1769 O HOH E 319 4.849 41.976 11.602 1.00 47.36 O
|
|
HETATM 1770 O HOH E 320 -9.748 17.702 14.127 0.88 36.38 O
|
|
HETATM 1771 O HOH E 321 8.018 17.322 11.214 0.79 30.86 O
|
|
HETATM 1772 O HOH E 322 -4.187 29.237 9.479 0.64 21.09 O
|
|
HETATM 1773 O HOH E 323 -11.498 41.609 21.364 0.67 23.55 O
|
|
HETATM 1774 O HOH E 324 -5.204 21.541 29.727 0.64 22.06 O
|
|
HETATM 1775 O HOH E 325 13.406 42.482 37.995 0.63 22.06 O
|
|
HETATM 1776 O HOH E 326 -10.173 23.789 25.350 0.68 26.20 O
|
|
HETATM 1777 O HOH E 327 16.843 34.708 19.627 0.69 27.38 O
|
|
HETATM 1778 O HOH E 328 16.765 40.332 36.645 0.45 11.61 O
|
|
HETATM 1779 O HOH E 329 -0.622 43.300 16.750 0.63 23.48 O
|
|
HETATM 1780 O HOH E 330 9.824 42.483 27.757 0.55 18.05 O
|
|
HETATM 1781 O HOH E 331 -5.903 11.298 11.954 0.68 27.27 O
|
|
HETATM 1782 O HOH E 332 13.645 24.476 41.399 0.51 15.52 O
|
|
HETATM 1783 O HOH E 333 6.215 31.658 45.731 0.50 16.08 O
|
|
HETATM 1784 O HOH E 334 18.316 33.219 36.392 0.60 22.90 O
|
|
HETATM 1785 O HOH E 335 24.007 31.285 30.107 0.61 23.72 O
|
|
HETATM 1786 O HOH E 336 -9.498 22.125 28.007 0.75 37.84 O
|
|
HETATM 1787 O HOH E 337 -3.562 13.067 24.205 0.56 21.07 O
|
|
HETATM 1788 O HOH E 338 2.525 32.717 8.290 0.72 36.12 O
|
|
HETATM 1789 O HOH E 339 20.274 25.669 28.510 0.60 25.43 O
|
|
HETATM 1790 O HOH E 340 0.292 47.499 24.997 0.68 32.94 O
|
|
HETATM 1791 O HOH E 341 -13.442 27.327 25.241 0.61 27.07 O
|
|
HETATM 1792 O HOH E 342 4.265 49.500 35.343 0.44 14.94 O
|
|
HETATM 1793 O HOH E 343 1.935 26.215 45.182 0.54 22.40 O
|
|
HETATM 1794 O HOH E 344 -0.408 36.739 45.798 0.56 24.29 O
|
|
HETATM 1795 O HOH E 345 6.317 43.816 30.835 0.60 28.76 O
|
|
HETATM 1796 O HOH E 346 3.897 48.035 33.014 0.53 22.54 O
|
|
HETATM 1797 O HOH E 347 -15.330 20.253 14.709 0.67 37.18 O
|
|
HETATM 1798 O HOH E 348 -3.206 17.647 29.827 0.45 17.00 O
|
|
HETATM 1799 O HOH E 349 9.664 13.205 25.372 0.51 21.46 O
|
|
HETATM 1800 O HOH E 350 11.072 25.378 14.002 0.51 22.00 O
|
|
HETATM 1801 O HOH E 351 12.386 23.035 21.250 0.51 22.18 O
|
|
HETATM 1802 O HOH E 352 -1.065 14.650 29.865 0.57 27.82 O
|
|
HETATM 1803 O HOH E 353 4.137 13.373 25.853 0.59 29.79 O
|
|
HETATM 1804 O HOH E 354 -1.387 27.196 43.357 0.46 18.86 O
|
|
HETATM 1805 O HOH E 355 6.692 44.835 27.687 0.64 36.06 O
|
|
HETATM 1806 O HOH E 356 -4.392 19.580 34.079 0.69 43.22 O
|
|
HETATM 1807 O HOH E 357 -8.403 38.357 4.701 0.55 27.25 O
|
|
HETATM 1808 O HOH E 358 -0.929 16.176 32.019 0.45 19.02 O
|
|
HETATM 1809 O HOH E 359 2.880 44.660 14.518 0.42 17.38 O
|
|
HETATM 1810 O HOH E 360 -4.397 29.049 42.512 0.49 24.07 O
|
|
HETATM 1811 O HOH E 361 -10.144 27.319 33.243 0.58 34.18 O
|
|
HETATM 1812 O HOH E 362 -5.170 31.843 5.795 0.50 26.67 O
|
|
HETATM 1813 O HOH E 363 -13.685 42.806 30.782 0.44 20.35 O
|
|
HETATM 1814 O HOH E 364 10.070 30.388 44.825 0.41 17.85 O
|
|
HETATM 1815 O HOH E 365 -11.994 25.228 31.977 0.49 26.32 O
|
|
HETATM 1816 O HOH E 366 -5.133 23.443 5.898 0.51 29.42 O
|
|
HETATM 1817 O HOH E 367 20.461 33.618 37.293 0.51 28.87 O
|
|
HETATM 1818 O HOH E 368 6.045 42.895 44.764 0.51 29.80 O
|
|
HETATM 1819 O HOH E 369 -15.210 37.605 32.679 0.46 23.87 O
|
|
HETATM 1820 O HOH E 370 -14.343 31.719 20.442 0.45 27.09 O
|
|
HETATM 1821 O HOH E 371 11.336 21.923 43.407 0.50 33.06 O
|
|
HETATM 1822 O HOH E 372 2.502 32.763 47.247 0.53 37.68 O
|
|
HETATM 1823 O HOH E 373 -7.297 14.788 19.343 0.48 32.21 O
|
|
HETATM 1824 O HOH E 374 -3.001 28.170 7.216 0.39 26.85 O
|
|
HETATM 1825 O HOH E 375 -0.914 24.352 44.385 0.38 26.27 O
|
|
HETATM 1826 O HOH E 376 16.967 37.781 19.381 0.30 16.82 O
|
|
HETATM 1827 O HOH E 377 9.099 28.554 9.917 0.37 25.71 O
|
|
HETATM 1828 O HOH I 57 6.491 8.672 39.254 0.97 11.63 O
|
|
HETATM 1829 O HOH I 58 5.407 8.675 36.834 1.00 17.33 O
|
|
HETATM 1830 O HOH I 59 16.060 24.685 31.141 1.00 19.64 O
|
|
HETATM 1831 O HOH I 60 13.915 22.510 39.276 0.97 21.42 O
|
|
HETATM 1832 O HOH I 61 11.810 5.784 26.691 0.91 19.09 O
|
|
HETATM 1833 O HOH I 62 16.283 15.403 45.286 0.74 13.20 O
|
|
HETATM 1834 O HOH I 63 4.855 12.924 34.885 0.80 16.12 O
|
|
HETATM 1835 O HOH I 64 6.892 14.841 35.833 0.81 16.61 O
|
|
HETATM 1836 O HOH I 65 10.010 2.495 35.636 0.95 23.57 O
|
|
HETATM 1837 O HOH I 66 15.524 20.777 30.578 0.75 15.35 O
|
|
HETATM 1838 O HOH I 67 13.343 3.726 39.281 0.82 19.23 O
|
|
HETATM 1839 O HOH I 68 9.510 17.460 37.419 0.66 12.80 O
|
|
HETATM 1840 O HOH I 69 14.236 11.808 45.619 0.88 24.97 O
|
|
HETATM 1841 O HOH I 70 7.037 14.230 25.920 0.57 11.24 O
|
|
HETATM 1842 O HOH I 71 8.776 21.417 38.753 0.88 29.06 O
|
|
HETATM 1843 O HOH I 72 14.871 17.826 28.953 0.65 19.02 O
|
|
HETATM 1844 O HOH I 73 13.745 19.782 40.374 0.70 22.19 O
|
|
HETATM 1845 O HOH I 74 23.197 6.736 44.041 0.75 25.48 O
|
|
HETATM 1846 O HOH I 75 7.439 7.880 28.566 0.64 18.53 O
|
|
HETATM 1847 O HOH I 76 19.751 1.856 36.580 0.91 39.83 O
|
|
HETATM 1848 O HOH I 77 7.474 19.313 39.134 0.57 15.95 O
|
|
HETATM 1849 O HOH I 78 14.436 15.773 28.937 0.67 22.55 O
|
|
HETATM 1850 O HOH I 79 14.514 22.515 31.025 0.71 27.22 O
|
|
HETATM 1851 O HOH I 80 22.867 6.174 34.336 0.84 38.95 O
|
|
HETATM 1852 O HOH I 81 15.673 29.201 42.281 0.71 28.44 O
|
|
HETATM 1853 O HOH I 82 20.803 5.491 42.666 0.68 26.33 O
|
|
HETATM 1854 O HOH I 83 8.663 15.271 39.210 0.47 12.80 O
|
|
HETATM 1855 O HOH I 84 10.526 17.349 40.156 0.52 15.87 O
|
|
HETATM 1856 O HOH I 85 20.437 12.588 50.148 0.81 39.51 O
|
|
HETATM 1857 O HOH I 86 19.267 6.687 44.523 0.69 29.51 O
|
|
HETATM 1858 O HOH I 87 23.345 4.690 42.510 0.63 26.04 O
|
|
HETATM 1859 O HOH I 88 9.093 4.864 29.745 0.73 34.61 O
|
|
HETATM 1860 O HOH I 89 17.094 7.488 44.757 0.68 31.21 O
|
|
HETATM 1861 O HOH I 90 22.691 8.297 36.596 0.59 25.09 O
|
|
HETATM 1862 O HOH I 91 12.684 14.951 44.202 0.52 20.39 O
|
|
HETATM 1863 O HOH I 92 18.232 22.521 43.048 0.52 21.60 O
|
|
HETATM 1864 O HOH I 93 4.606 6.769 35.354 0.51 22.89 O
|
|
HETATM 1865 O HOH I 94 26.652 11.548 42.340 0.61 33.50 O
|
|
HETATM 1866 O HOH I 95 16.686 15.242 48.142 0.56 29.93 O
|
|
HETATM 1867 O HOH I 96 12.428 2.441 37.344 0.54 27.23 O
|
|
HETATM 1868 O HOH I 97 23.001 5.809 36.632 0.49 24.19 O
|
|
HETATM 1869 O HOH I 98 20.421 4.062 37.996 0.49 25.26 O
|
|
HETATM 1870 O HOH I 99 20.582 20.223 31.028 0.48 26.42 O
|
|
HETATM 1871 O HOH I 100 26.895 15.446 36.691 0.44 26.74 O
|
|
HETATM 1872 O HOH I 101 15.026 24.316 26.960 0.49 43.02 O
|
|
HETATM 1873 O HOH I 102 15.079 2.231 42.206 0.37 25.45 O
|
|
HETATM 1874 O HOH I 103 22.843 24.381 30.648 0.34 25.80 O
|
|
CONECT 95 248
|
|
CONECT 248 95
|
|
CONECT 969 1141
|
|
CONECT 1141 969
|
|
CONECT 1325 1560
|
|
CONECT 1386 1535
|
|
CONECT 1454 1690
|
|
CONECT 1535 1386
|
|
CONECT 1560 1325
|
|
CONECT 1690 1454
|
|
MASTER 347 0 0 2 17 13 0 6 1872 2 10 20
|
|
END
|