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Diffstat (limited to 'plip/test/pdb/1bma.pdb')
| -rw-r--r-- | plip/test/pdb/1bma.pdb | 2569 |
1 files changed, 0 insertions, 2569 deletions
diff --git a/plip/test/pdb/1bma.pdb b/plip/test/pdb/1bma.pdb deleted file mode 100644 index 294818a..0000000 --- a/plip/test/pdb/1bma.pdb +++ /dev/null @@ -1,2569 +0,0 @@ -HEADER HYDROLASE/HYDROLASE INHIBITOR 01-MAY-95 1BMA -TITLE BENZYL METHYL AMINIMIDE INHIBITOR COMPLEXED TO PORCINE PANCREATIC -TITLE 2 ELASTASE -COMPND MOL_ID: 1; -COMPND 2 MOLECULE: CHYMOTRYPSIN-LIKE ELASTASE FAMILY MEMBER 1; -COMPND 3 CHAIN: A; -COMPND 4 SYNONYM: ELASTASE-1; -COMPND 5 EC: 3.4.21.36 -SOURCE MOL_ID: 1; -SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; -SOURCE 3 ORGANISM_COMMON: PIGS,SWINE,WILD BOAR; -SOURCE 4 ORGANISM_TAXID: 9823; -SOURCE 5 ORGAN: PANCREAS -KEYWDS SERINE PROTEASE,METAL-BINDING, PROTEASE, SECRETED, ZYMOGEN, -KEYWDS 2 HYDROLASE-HYDROLASE INHIBITOR COMPLEX -EXPDTA X-RAY DIFFRACTION -AUTHOR E.PEISACH,D.CASEBIER,S.L.GALLION,P.FURTH,G.A.PETSKO,J.C.HOGAN JR., -AUTHOR 2 D.RINGE -REVDAT 4 13-JUL-11 1BMA 1 VERSN -REVDAT 3 24-FEB-09 1BMA 1 VERSN -REVDAT 2 01-APR-03 1BMA 1 JRNL -REVDAT 1 07-DEC-95 1BMA 0 -JRNL AUTH E.PEISACH,D.CASEBIER,S.L.GALLION,P.FURTH,G.A.PETSKO, -JRNL AUTH 2 J.C.HOGAN JR.,D.RINGE -JRNL TITL INTERACTION OF A PEPTIDOMIMETIC AMINIMIDE INHIBITOR WITH -JRNL TITL 2 ELASTASE. -JRNL REF SCIENCE V. 269 66 1995 -JRNL REFN ISSN 0036-8075 -JRNL PMID 7604279 -REMARK 1 -REMARK 1 REFERENCE 1 -REMARK 1 AUTH C.MATTOS,D.A.GIAMMONA,G.A.PETSKO,D.RINGE -REMARK 1 TITL STRUCTURAL ANALYSIS OF THE ACTIVE SITE OF PORCINE PANCREATIC -REMARK 1 TITL 2 ELASTASE BASED ON THE X-RAY CRYSTAL STRUCTURES OF COMPLEXES -REMARK 1 TITL 3 WITH TRIFLUOROACETYL-DIPEPTIDE-ANILIDE INHIBITORS -REMARK 1 REF BIOCHEMISTRY V. 34 3193 1995 -REMARK 1 REFN ISSN 0006-2960 -REMARK 1 REFERENCE 2 -REMARK 1 AUTH I.LI DE LA SIERRA,E.PAPAMICHAEL,C.SAKARELOS,J.-L.DIMICOLI, -REMARK 1 AUTH 2 T.PRANGE -REMARK 1 TITL INTERACTION OF THE PEPTIDE CF3-LEU-ALA-NH-C6H4-CF3 (TFLA) -REMARK 1 TITL 2 WITH PORCINE PANCREATIC ELASTASE. X-RAY STUDIES AT 1.8 -REMARK 1 TITL 3 ANGSTROMS -REMARK 1 REF J.MOL.RECOG. V. 3 36 1990 -REMARK 1 REFN ISSN 0952-3499 -REMARK 1 REFERENCE 3 -REMARK 1 AUTH E.MEYER,G.COLE,R.RADHAKRISHNAN,O.EPP -REMARK 1 TITL STRUCTURE OF NATIVE PORCINE PANCREATIC ELASTASE AT 1.65 -REMARK 1 TITL 2 ANGSTROMS RESOLUTION -REMARK 1 REF ACTA CRYSTALLOGR.,SECT.B V. 44 26 1988 -REMARK 1 REFN ISSN 0108-7681 -REMARK 1 REFERENCE 4 -REMARK 1 AUTH E.MEYER,R.RADHAKRISHNAN,G.COLE,L.G.PRESTA -REMARK 1 TITL STRUCTURE OF THE PRODUCT COMPLEX OF ACETYL-ALA-PRO-ALA WITH -REMARK 1 TITL 2 PORCINE PANCREATIC ELASTASE AT 1.65 ANGSTROMS RESOLUTION -REMARK 1 REF J.MOL.BIOL. V. 189 533 1986 -REMARK 1 REFN ISSN 0022-2836 -REMARK 1 REFERENCE 5 -REMARK 1 AUTH D.L.HUGHES,L.C.DIECKER,L.C.BIETH,J.-L.DIMICOLI -REMARK 1 TITL CRYSTALLOGRAPHIC STUDY OF THE BINDING OF A TRI-FLUOROACETYL -REMARK 1 TITL 2 DIPEPTIDE ANILIDE INHIBITOR WITH ELASTASE -REMARK 1 REF J.MOL.BIOL. V. 162 645 1982 -REMARK 1 REFN ISSN 0022-2836 -REMARK 1 REFERENCE 6 -REMARK 1 AUTH J.-L.DIMICOLI,A.RENAUD,J.BIETH -REMARK 1 TITL THE INDIRECT MECHANISM OF ACTION OF THE TRIFLUOROACETYL -REMARK 1 TITL 2 PEPTIDES ON ELASTASE -REMARK 1 REF EUR.J.BIOCHEM. V. 107 423 1980 -REMARK 1 REFN ISSN 0014-2956 -REMARK 1 REFERENCE 7 -REMARK 1 AUTH L.SAWYER,C.M.SHOTTON,J.W.CAMPBELL,P.L.WENDELL,H.MUIRHEAD, -REMARK 1 AUTH 2 H.C.WATSON,R.DIAMOND,R.C.LADNER -REMARK 1 TITL THE ATOMIC STRUCTURE OF CRYSTALLINE PORCINE PANCREATIC -REMARK 1 TITL 2 ELASTASE AT 2.5 ANGSTROMS RESOLUTION. COMPARISONS WITH THE -REMARK 1 TITL 3 STRUCTURE OF ALPHA-CHYMOTRYPSIN -REMARK 1 REF J.MOL.BIOL. V. 118 137 1978 -REMARK 1 REFN ISSN 0022-2836 -REMARK 2 -REMARK 2 RESOLUTION. 1.80 ANGSTROMS. -REMARK 3 -REMARK 3 REFINEMENT. -REMARK 3 PROGRAM : X-PLOR 3.1 -REMARK 3 AUTHORS : BRUNGER -REMARK 3 -REMARK 3 DATA USED IN REFINEMENT. -REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.80 -REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 10.00 -REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 -REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL -REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL -REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 58.7 -REMARK 3 NUMBER OF REFLECTIONS : 44505 -REMARK 3 -REMARK 3 FIT TO DATA USED IN REFINEMENT. -REMARK 3 CROSS-VALIDATION METHOD : NULL -REMARK 3 FREE R VALUE TEST SET SELECTION : NULL -REMARK 3 R VALUE (WORKING SET) : 0.192 -REMARK 3 FREE R VALUE : NULL -REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL -REMARK 3 FREE R VALUE TEST SET COUNT : NULL -REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL -REMARK 3 -REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. -REMARK 3 TOTAL NUMBER OF BINS USED : NULL -REMARK 3 BIN RESOLUTION RANGE HIGH (A) : NULL -REMARK 3 BIN RESOLUTION RANGE LOW (A) : NULL -REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL -REMARK 3 REFLECTIONS IN BIN (WORKING SET) : NULL -REMARK 3 BIN R VALUE (WORKING SET) : NULL -REMARK 3 BIN FREE R VALUE : NULL -REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : NULL -REMARK 3 BIN FREE R VALUE TEST SET COUNT : NULL -REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL -REMARK 3 -REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. -REMARK 3 PROTEIN ATOMS : 1822 -REMARK 3 NUCLEIC ACID ATOMS : 0 -REMARK 3 HETEROGEN ATOMS : 43 -REMARK 3 SOLVENT ATOMS : 134 -REMARK 3 -REMARK 3 B VALUES. -REMARK 3 FROM WILSON PLOT (A**2) : NULL -REMARK 3 MEAN B VALUE (OVERALL, A**2) : 18.50 -REMARK 3 OVERALL ANISOTROPIC B VALUE. -REMARK 3 B11 (A**2) : NULL -REMARK 3 B22 (A**2) : NULL -REMARK 3 B33 (A**2) : NULL -REMARK 3 B12 (A**2) : NULL -REMARK 3 B13 (A**2) : NULL -REMARK 3 B23 (A**2) : NULL -REMARK 3 -REMARK 3 ESTIMATED COORDINATE ERROR. -REMARK 3 ESD FROM LUZZATI PLOT (A) : NULL -REMARK 3 ESD FROM SIGMAA (A) : NULL -REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL -REMARK 3 -REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. -REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL -REMARK 3 ESD FROM C-V SIGMAA (A) : NULL -REMARK 3 -REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. -REMARK 3 BOND LENGTHS (A) : 0.015 -REMARK 3 BOND ANGLES (DEGREES) : 2.70 -REMARK 3 DIHEDRAL ANGLES (DEGREES) : 26.80 -REMARK 3 IMPROPER ANGLES (DEGREES) : 1.01 -REMARK 3 -REMARK 3 ISOTROPIC THERMAL MODEL : NULL -REMARK 3 -REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA -REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL -REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL -REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL -REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL -REMARK 3 -REMARK 3 NCS MODEL : NULL -REMARK 3 -REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT -REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL -REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL -REMARK 3 -REMARK 3 PARAMETER FILE 1 : NULL -REMARK 3 TOPOLOGY FILE 1 : NULL -REMARK 3 -REMARK 3 OTHER REFINEMENT REMARKS: NULL -REMARK 4 -REMARK 4 1BMA COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 -REMARK 100 -REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. -REMARK 200 -REMARK 200 EXPERIMENTAL DETAILS -REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION -REMARK 200 DATE OF DATA COLLECTION : 20-MAY-94 -REMARK 200 TEMPERATURE (KELVIN) : NULL -REMARK 200 PH : NULL -REMARK 200 NUMBER OF CRYSTALS USED : NULL -REMARK 200 -REMARK 200 SYNCHROTRON (Y/N) : N -REMARK 200 RADIATION SOURCE : NULL -REMARK 200 BEAMLINE : NULL -REMARK 200 X-RAY GENERATOR MODEL : NULL -REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M -REMARK 200 WAVELENGTH OR RANGE (A) : 1.5148 -REMARK 200 MONOCHROMATOR : NI FILTER -REMARK 200 OPTICS : NULL -REMARK 200 -REMARK 200 DETECTOR TYPE : NULL -REMARK 200 DETECTOR MANUFACTURER : SIEMENS -REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS -REMARK 200 DATA SCALING SOFTWARE : NULL -REMARK 200 -REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 39545 -REMARK 200 RESOLUTION RANGE HIGH (A) : 1.800 -REMARK 200 RESOLUTION RANGE LOW (A) : 10.000 -REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 -REMARK 200 -REMARK 200 OVERALL. -REMARK 200 COMPLETENESS FOR RANGE (%) : 58.7 -REMARK 200 DATA REDUNDANCY : NULL -REMARK 200 R MERGE (I) : 0.06300 -REMARK 200 R SYM (I) : NULL -REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : NULL -REMARK 200 -REMARK 200 IN THE HIGHEST RESOLUTION SHELL. -REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL -REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL -REMARK 200 COMPLETENESS FOR SHELL (%) : NULL -REMARK 200 DATA REDUNDANCY IN SHELL : NULL -REMARK 200 R MERGE FOR SHELL (I) : NULL -REMARK 200 R SYM FOR SHELL (I) : NULL -REMARK 200 <I/SIGMA(I)> FOR SHELL : NULL -REMARK 200 -REMARK 200 DIFFRACTION PROTOCOL: NULL -REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL -REMARK 200 SOFTWARE USED: X-PLOR 3.1 -REMARK 200 STARTING MODEL: NULL -REMARK 200 -REMARK 200 REMARK: NULL -REMARK 280 -REMARK 280 CRYSTAL -REMARK 280 SOLVENT CONTENT, VS (%): 43.84 -REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.19 -REMARK 280 -REMARK 280 CRYSTALLIZATION CONDITIONS: THE INHIBITOR WAS SOAKED INTO THE -REMARK 280 GROWN CRYSTALS USING A 4 MM STOCK SOLUTION OF THE INHIBITOR IN -REMARK 280 10% ACETONITRILE. -REMARK 290 -REMARK 290 CRYSTALLOGRAPHIC SYMMETRY -REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 -REMARK 290 -REMARK 290 SYMOP SYMMETRY -REMARK 290 NNNMMM OPERATOR -REMARK 290 1555 X,Y,Z -REMARK 290 2555 -X+1/2,-Y,Z+1/2 -REMARK 290 3555 -X,Y+1/2,-Z+1/2 -REMARK 290 4555 X+1/2,-Y+1/2,-Z -REMARK 290 -REMARK 290 WHERE NNN -> OPERATOR NUMBER -REMARK 290 MMM -> TRANSLATION VECTOR -REMARK 290 -REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS -REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM -REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY -REMARK 290 RELATED MOLECULES. -REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 -REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 -REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 -REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 26.08000 -REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 -REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 37.76000 -REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 -REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 28.84000 -REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 37.76000 -REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 26.08000 -REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 28.84000 -REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 -REMARK 290 -REMARK 290 REMARK: NULL -REMARK 300 -REMARK 300 BIOMOLECULE: 1 -REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM -REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN -REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON -REMARK 300 BURIED SURFACE AREA. -REMARK 350 -REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN -REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE -REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS -REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND -REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. -REMARK 350 -REMARK 350 BIOMOLECULE: 1 -REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC -REMARK 350 APPLY THE FOLLOWING TO CHAINS: A -REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 -REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 -REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 -REMARK 500 -REMARK 500 GEOMETRY AND STEREOCHEMISTRY -REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS -REMARK 500 -REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES -REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE -REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN -REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). -REMARK 500 -REMARK 500 STANDARD TABLE: -REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) -REMARK 500 -REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 -REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 -REMARK 500 -REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION -REMARK 500 HIS A 60 NE2 HIS A 60 CD2 -0.073 -REMARK 500 HIS A 75 NE2 HIS A 75 CD2 -0.070 -REMARK 500 -REMARK 500 REMARK: NULL -REMARK 500 -REMARK 500 GEOMETRY AND STEREOCHEMISTRY -REMARK 500 SUBTOPIC: COVALENT BOND ANGLES -REMARK 500 -REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES -REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE -REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN -REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). -REMARK 500 -REMARK 500 STANDARD TABLE: -REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) -REMARK 500 -REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 -REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 -REMARK 500 -REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 -REMARK 500 TRP A 27 CD1 - CG - CD2 ANGL. DEV. = 6.1 DEGREES -REMARK 500 TRP A 27 CE2 - CD2 - CG ANGL. DEV. = -5.9 DEGREES -REMARK 500 ARG A 36 NE - CZ - NH1 ANGL. DEV. = 3.3 DEGREES -REMARK 500 TRP A 41 CD1 - CG - CD2 ANGL. DEV. = 7.3 DEGREES -REMARK 500 TRP A 41 CE2 - CD2 - CG ANGL. DEV. = -6.1 DEGREES -REMARK 500 ARG A 51 NE - CZ - NH1 ANGL. DEV. = 3.3 DEGREES -REMARK 500 TRP A 54 CD1 - CG - CD2 ANGL. DEV. = 5.5 DEGREES -REMARK 500 TRP A 54 CE2 - CD2 - CG ANGL. DEV. = -5.3 DEGREES -REMARK 500 ARG A 64 NE - CZ - NH1 ANGL. DEV. = 3.3 DEGREES -REMARK 500 TRP A 98 CD1 - CG - CD2 ANGL. DEV. = 5.0 DEGREES -REMARK 500 TRP A 98 CE2 - CD2 - CG ANGL. DEV. = -5.1 DEGREES -REMARK 500 TRP A 147 CD1 - CG - CD2 ANGL. DEV. = 6.3 DEGREES -REMARK 500 TRP A 147 CE2 - CD2 - CG ANGL. DEV. = -5.5 DEGREES -REMARK 500 ARG A 151 CA - CB - CG ANGL. DEV. = 14.0 DEGREES -REMARK 500 ARG A 151 NE - CZ - NH1 ANGL. DEV. = 3.3 DEGREES -REMARK 500 TRP A 179 CD1 - CG - CD2 ANGL. DEV. = 6.3 DEGREES -REMARK 500 TRP A 179 CE2 - CD2 - CG ANGL. DEV. = -5.3 DEGREES -REMARK 500 ARG A 226 NE - CZ - NH1 ANGL. DEV. = 3.4 DEGREES -REMARK 500 ARG A 240 NE - CZ - NH1 ANGL. DEV. = 3.1 DEGREES -REMARK 500 TRP A 247 CD1 - CG - CD2 ANGL. DEV. = 6.2 DEGREES -REMARK 500 TRP A 247 CE2 - CD2 - CG ANGL. DEV. = -5.1 DEGREES -REMARK 500 -REMARK 500 REMARK: NULL -REMARK 500 -REMARK 500 GEOMETRY AND STEREOCHEMISTRY -REMARK 500 SUBTOPIC: TORSION ANGLES -REMARK 500 -REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: -REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; -REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). -REMARK 500 -REMARK 500 STANDARD TABLE: -REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) -REMARK 500 -REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- -REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 -REMARK 500 -REMARK 500 M RES CSSEQI PSI PHI -REMARK 500 HIS A 75 -55.40 -129.50 -REMARK 500 TYR A 178 -113.73 -104.95 -REMARK 500 SER A 203 135.31 -37.60 -REMARK 500 SER A 222 -56.81 -120.48 -REMARK 500 -REMARK 500 REMARK: NULL -REMARK 600 -REMARK 600 HETEROGEN -REMARK 600 NOTE THAT SUBCOMPONENT MBH IS REFERRED TO AS MBA IN THE PAPER -REMARK 600 CITED IN THE JRNL RECORDS ABOVE. -REMARK 620 -REMARK 620 METAL COORDINATION -REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; -REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): -REMARK 620 -REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL -REMARK 620 CA A 280 CA -REMARK 620 N RES CSSEQI ATOM -REMARK 620 1 GLU A 84 OE2 -REMARK 620 2 GLN A 79 O 93.3 -REMARK 620 3 HOH A 355 O 84.6 90.9 -REMARK 620 4 ASN A 81 OD1 83.2 93.3 167.3 -REMARK 620 5 GLU A 74 OE1 94.5 163.5 104.3 73.2 -REMARK 620 6 ASN A 76 O 169.8 87.8 105.6 86.5 82.0 -REMARK 620 7 GLU A 74 OE2 95.9 150.8 62.5 115.3 42.2 88.0 -REMARK 620 N 1 2 3 4 5 6 -REMARK 630 -REMARK 630 MOLECULE TYPE: NULL -REMARK 630 MOLECULE NAME: (1R)-1-BENZYL-1-METHYL-1-(2-{[4-(1-METHYLETHYL) -REMARK 630 PHENYL]AMINO}-2-OXOETHYL)-2-{(2S)-4-METHYL-2-[(TRIFLUOROACETYL) -REMARK 630 AMINO]PENTANOYL}DIAZANIUM -REMARK 630 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; -REMARK 630 SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) -REMARK 630 -REMARK 630 M RES C SSSEQI -REMARK 630 0QH A 256 -REMARK 630 SOURCE: NULL -REMARK 630 TAXONOMY: NULL -REMARK 630 SUBCOMP: TFA LEU MBH ISO -REMARK 630 DETAILS: NULL -REMARK 700 -REMARK 700 SHEET -REMARK 700 THE SHEETS PRESENTED AS *S1* AND *S2* IN SHEET RECORDS -REMARK 700 BELOW ARE ACTUALLY TWO SIX-STRANDED BETA-BARRELS. THIS IS -REMARK 700 REPRESENTED BY TWO SEVEN-STRANDED SHEETS IN WHICH THE FIRST -REMARK 700 AND LAST STRANDS OF EACH SHEET ARE IDENTICAL. -REMARK 800 -REMARK 800 SITE -REMARK 800 SITE_IDENTIFIER: AC1 -REMARK 800 EVIDENCE_CODE: SOFTWARE -REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA A 280 -REMARK 800 -REMARK 800 SITE_IDENTIFIER: AC2 -REMARK 800 EVIDENCE_CODE: SOFTWARE -REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 A 290 -REMARK 800 -REMARK 800 SITE_IDENTIFIER: AC3 -REMARK 800 EVIDENCE_CODE: SOFTWARE -REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 0QH A 256 -REMARK 800 -REMARK 800 SITE_IDENTIFIER: CAT -REMARK 800 EVIDENCE_CODE: AUTHOR -REMARK 800 SITE_DESCRIPTION: CATALYTIC TRIAD -REMARK 999 -REMARK 999 SEQUENCE -REMARK 999 THE RESIDUE NUMBERING SCHEME FOR THE PROTEIN IS SEQUENTIAL -REMARK 999 STARTING WITH VAL A 16 AND ENDING WITH ASN A 255. -REMARK 999 -REMARK 999 THE IDENTITY OF ASN A 81 AGREES WITH THE SEQUENCES OF -REMARK 999 SEVERAL OTHER ELASTASE STRUCTURES. THE AUTHORS, THEREFORE, -REMARK 999 BELIEVE IT TO BE CORRECT. -DBREF 1BMA A 16 255 UNP P00772 CELA1_PIG 27 266 -SEQADV 1BMA ASN A 81 UNP P00772 ASP 92 CONFLICT -SEQRES 1 A 240 VAL VAL GLY GLY THR GLU ALA GLN ARG ASN SER TRP PRO -SEQRES 2 A 240 SER GLN ILE SER LEU GLN TYR ARG SER GLY SER SER TRP -SEQRES 3 A 240 ALA HIS THR CYS GLY GLY THR LEU ILE ARG GLN ASN TRP -SEQRES 4 A 240 VAL MET THR ALA ALA HIS CYS VAL ASP ARG GLU LEU THR -SEQRES 5 A 240 PHE ARG VAL VAL VAL GLY GLU HIS ASN LEU ASN GLN ASN -SEQRES 6 A 240 ASN GLY THR GLU GLN TYR VAL GLY VAL GLN LYS ILE VAL -SEQRES 7 A 240 VAL HIS PRO TYR TRP ASN THR ASP ASP VAL ALA ALA GLY -SEQRES 8 A 240 TYR ASP ILE ALA LEU LEU ARG LEU ALA GLN SER VAL THR -SEQRES 9 A 240 LEU ASN SER TYR VAL GLN LEU GLY VAL LEU PRO ARG ALA -SEQRES 10 A 240 GLY THR ILE LEU ALA ASN ASN SER PRO CYS TYR ILE THR -SEQRES 11 A 240 GLY TRP GLY LEU THR ARG THR ASN GLY GLN LEU ALA GLN -SEQRES 12 A 240 THR LEU GLN GLN ALA TYR LEU PRO THR VAL ASP TYR ALA -SEQRES 13 A 240 ILE CYS SER SER SER SER TYR TRP GLY SER THR VAL LYS -SEQRES 14 A 240 ASN SER MET VAL CYS ALA GLY GLY ASP GLY VAL ARG SER -SEQRES 15 A 240 GLY CYS GLN GLY ASP SER GLY GLY PRO LEU HIS CYS LEU -SEQRES 16 A 240 VAL ASN GLY GLN TYR ALA VAL HIS GLY VAL THR SER PHE -SEQRES 17 A 240 VAL SER ARG LEU GLY CYS ASN VAL THR ARG LYS PRO THR -SEQRES 18 A 240 VAL PHE THR ARG VAL SER ALA TYR ILE SER TRP ILE ASN -SEQRES 19 A 240 ASN VAL ILE ALA SER ASN -HET CA A 280 1 -HET SO4 A 290 5 -HET 0QH A 256 37 -HETNAM CA CALCIUM ION -HETNAM SO4 SULFATE ION -HETNAM 0QH (1R)-1-BENZYL-1-METHYL-1-(2-{[4-(1-METHYLETHYL) -HETNAM 2 0QH PHENYL]AMINO}-2-OXOETHYL)-2-{(2S)-4-METHYL-2- -HETNAM 3 0QH [(TRIFLUOROACETYL)AMINO]PENTANOYL}DIAZANIUM -FORMUL 2 CA CA 2+ -FORMUL 3 SO4 O4 S 2- -FORMUL 4 0QH C27 H36 F3 N4 O3 1+ -FORMUL 5 HOH *134(H2 O) -HELIX 1 H1 ASP A 169 SER A 175 1 7 -HELIX 2 H2 TYR A 244 ASN A 255 1 12 -SHEET 1 S1 7 SER A 29 SER A 37 0 -SHEET 2 S1 7 SER A 40 ILE A 50 -1 -SHEET 3 S1 7 ASN A 53 ALA A 59 -1 -SHEET 4 S1 7 ASP A 108 GLN A 116 -1 -SHEET 5 S1 7 GLU A 84 HIS A 95 -1 -SHEET 6 S1 7 PHE A 68 GLY A 73 -1 -SHEET 7 S1 7 SER A 29 SER A 37 -1 -SHEET 1 S2 7 ASN A 139 THR A 150 0 -SHEET 2 S2 7 GLY A 154 VAL A 168 -1 -SHEET 3 S2 7 SER A 186 VAL A 195 -1 -SHEET 4 S2 7 ASN A 230 VAL A 241 -1 -SHEET 5 S2 7 HIS A 218 VAL A 224 -1 -SHEET 6 S2 7 SER A 203 CYS A 209 -1 -SHEET 7 S2 7 SER A 140 THR A 150 -1 -SHEET 1 S3 3 GLY A 154 ALA A 157 0 -SHEET 2 S3 3 TRP A 147 LEU A 149 -1 -SHEET 3 S3 3 GLN A 200 ASP A 202 -1 -SSBOND 1 CYS A 45 CYS A 61 1555 1555 2.02 -SSBOND 2 CYS A 142 CYS A 209 1555 1555 2.01 -SSBOND 3 CYS A 173 CYS A 189 1555 1555 2.01 -SSBOND 4 CYS A 199 CYS A 229 1555 1555 2.01 -LINK CA CA A 280 OE2 GLU A 84 1555 1555 2.51 -LINK CA CA A 280 O GLN A 79 1555 1555 2.37 -LINK CA CA A 280 O HOH A 355 1555 1555 2.53 -LINK CA CA A 280 OD1 ASN A 81 1555 1555 2.52 -LINK CA CA A 280 OE1 GLU A 74 1555 1555 2.50 -LINK CA CA A 280 O ASN A 76 1555 1555 2.37 -LINK CA CA A 280 OE2 GLU A 74 1555 1555 3.09 -SITE 1 AC1 6 GLU A 74 ASN A 76 GLN A 79 ASN A 81 -SITE 2 AC1 6 GLU A 84 HOH A 355 -SITE 1 AC2 5 GLY A 133 ARG A 151 ARG A 240 HOH A 340 -SITE 2 AC2 5 HOH A 345 -SITE 1 AC3 17 GLU A 65 LEU A 66 THR A 67 VAL A 103 -SITE 2 AC3 17 THR A 152 THR A 182 CYS A 199 GLN A 200 -SITE 3 AC3 17 SER A 203 THR A 221 SER A 222 PHE A 223 -SITE 4 AC3 17 VAL A 224 SER A 225 ARG A 226 GLY A 228 -SITE 5 AC3 17 CYS A 229 -SITE 1 CAT 3 ASP A 108 HIS A 60 SER A 203 -CRYST1 52.160 57.680 75.520 90.00 90.00 90.00 P 21 21 21 4 -ORIGX1 1.000000 0.000000 0.000000 0.00000 -ORIGX2 0.000000 1.000000 0.000000 0.00000 -ORIGX3 0.000000 0.000000 1.000000 0.00000 -SCALE1 0.019172 0.000000 0.000000 0.00000 -SCALE2 0.000000 0.017337 0.000000 0.00000 -SCALE3 0.000000 0.000000 0.013242 0.00000 -ATOM 1 N VAL A 16 41.593 32.726 35.179 1.00 5.92 N -ATOM 2 CA VAL A 16 40.667 33.462 36.045 1.00 5.90 C -ATOM 3 C VAL A 16 39.544 34.005 35.167 1.00 9.05 C -ATOM 4 O VAL A 16 39.830 34.764 34.220 1.00 10.48 O -ATOM 5 CB VAL A 16 41.446 34.646 36.763 1.00 3.34 C -ATOM 6 CG1 VAL A 16 40.479 35.497 37.575 1.00 5.02 C -ATOM 7 CG2 VAL A 16 42.485 34.116 37.761 1.00 7.03 C -ATOM 8 N VAL A 17 38.276 33.667 35.460 1.00 9.38 N -ATOM 9 CA VAL A 17 37.124 34.221 34.774 1.00 8.32 C -ATOM 10 C VAL A 17 36.701 35.486 35.515 1.00 10.66 C -ATOM 11 O VAL A 17 36.731 35.504 36.741 1.00 10.27 O -ATOM 12 CB VAL A 17 35.956 33.225 34.766 1.00 6.81 C -ATOM 13 CG1 VAL A 17 34.839 33.738 33.857 1.00 6.95 C -ATOM 14 CG2 VAL A 17 36.405 31.908 34.179 1.00 7.97 C -ATOM 15 N GLY A 18 36.334 36.574 34.832 1.00 9.48 N -ATOM 16 CA GLY A 18 35.822 37.755 35.533 1.00 10.87 C -ATOM 17 C GLY A 18 36.915 38.523 36.270 1.00 12.24 C -ATOM 18 O GLY A 18 36.678 39.227 37.249 1.00 14.40 O -ATOM 19 N GLY A 19 38.145 38.374 35.824 1.00 12.48 N -ATOM 20 CA GLY A 19 39.268 39.043 36.456 1.00 14.94 C -ATOM 21 C GLY A 19 39.626 40.361 35.784 1.00 16.65 C -ATOM 22 O GLY A 19 38.950 40.814 34.852 1.00 18.12 O -ATOM 23 N THR A 20 40.656 41.023 36.329 1.00 17.53 N -ATOM 24 CA THR A 20 41.215 42.247 35.786 1.00 18.60 C -ATOM 25 C THR A 20 42.711 42.021 35.745 1.00 18.76 C -ATOM 26 O THR A 20 43.229 41.126 36.410 1.00 18.06 O -ATOM 27 CB THR A 20 40.854 43.488 36.671 1.00 18.53 C -ATOM 28 OG1 THR A 20 41.161 43.234 38.028 1.00 21.90 O -ATOM 29 CG2 THR A 20 39.362 43.783 36.615 1.00 20.28 C -ATOM 30 N GLU A 21 43.465 42.806 34.977 1.00 17.36 N -ATOM 31 CA GLU A 21 44.865 42.555 34.859 1.00 16.71 C -ATOM 32 C GLU A 21 45.574 42.977 36.145 1.00 17.00 C -ATOM 33 O GLU A 21 45.219 44.002 36.718 1.00 16.14 O -ATOM 34 CB GLU A 21 45.362 43.317 33.667 1.00 20.43 C -ATOM 35 CG GLU A 21 46.829 43.020 33.446 1.00 24.72 C -ATOM 36 CD GLU A 21 47.475 43.832 32.343 1.00 30.35 C -ATOM 37 OE1 GLU A 21 46.815 44.064 31.332 1.00 32.22 O -ATOM 38 OE2 GLU A 21 48.640 44.213 32.503 1.00 34.58 O -ATOM 39 N ALA A 22 46.507 42.201 36.690 1.00 13.57 N -ATOM 40 CA ALA A 22 47.254 42.613 37.877 1.00 16.53 C -ATOM 41 C ALA A 22 48.413 43.574 37.541 1.00 19.25 C -ATOM 42 O ALA A 22 48.936 43.546 36.410 1.00 19.34 O -ATOM 43 CB ALA A 22 47.850 41.387 38.565 1.00 12.65 C -ATOM 44 N GLN A 23 48.800 44.479 38.475 1.00 22.53 N -ATOM 45 CA GLN A 23 50.009 45.296 38.310 1.00 26.37 C -ATOM 46 C GLN A 23 51.263 44.409 38.378 1.00 27.67 C -ATOM 47 O GLN A 23 51.187 43.347 38.997 1.00 23.66 O -ATOM 48 CB GLN A 23 50.168 46.320 39.400 1.00 31.17 C -ATOM 49 CG GLN A 23 49.159 47.429 39.421 1.00 42.19 C -ATOM 50 CD GLN A 23 49.687 48.673 40.142 1.00 49.58 C -ATOM 51 OE1 GLN A 23 50.904 48.913 40.285 1.00 52.36 O -ATOM 52 NE2 GLN A 23 48.727 49.492 40.591 1.00 51.67 N -ATOM 53 N ARG A 24 52.431 44.788 37.800 1.00 29.51 N -ATOM 54 CA ARG A 24 53.641 43.953 37.789 1.00 30.30 C -ATOM 55 C ARG A 24 54.183 43.386 39.081 1.00 31.38 C -ATOM 56 O ARG A 24 54.587 42.235 39.151 1.00 34.00 O -ATOM 57 CB ARG A 24 54.840 44.668 37.206 1.00 30.16 C -ATOM 58 CG ARG A 24 54.679 44.883 35.770 1.00 28.35 C -ATOM 59 CD ARG A 24 55.881 45.609 35.209 1.00 27.43 C -ATOM 60 NE ARG A 24 55.515 45.740 33.820 1.00 28.29 N -ATOM 61 CZ ARG A 24 55.724 44.756 32.944 1.00 28.28 C -ATOM 62 NH1 ARG A 24 56.320 43.610 33.293 1.00 27.96 N -ATOM 63 NH2 ARG A 24 55.172 44.852 31.736 1.00 28.73 N -ATOM 64 N ASN A 25 54.279 44.201 40.117 1.00 32.39 N -ATOM 65 CA ASN A 25 54.869 43.760 41.380 1.00 33.61 C -ATOM 66 C ASN A 25 53.824 43.580 42.473 1.00 31.97 C -ATOM 67 O ASN A 25 54.141 43.602 43.671 1.00 29.55 O -ATOM 68 CB ASN A 25 55.929 44.795 41.809 1.00 37.80 C -ATOM 69 CG ASN A 25 55.409 46.225 41.994 1.00 40.56 C -ATOM 70 OD1 ASN A 25 54.300 46.613 41.600 1.00 42.11 O -ATOM 71 ND2 ASN A 25 56.249 47.031 42.633 1.00 44.06 N -ATOM 72 N SER A 26 52.568 43.425 42.030 1.00 28.95 N -ATOM 73 CA SER A 26 51.480 43.244 42.956 1.00 27.48 C -ATOM 74 C SER A 26 51.550 41.881 43.640 1.00 24.98 C -ATOM 75 O SER A 26 51.345 41.838 44.862 1.00 24.86 O -ATOM 76 CB SER A 26 50.145 43.400 42.220 1.00 29.77 C -ATOM 77 OG SER A 26 49.576 44.692 42.384 1.00 32.18 O -ATOM 78 N TRP A 27 51.894 40.773 42.943 1.00 19.00 N -ATOM 79 CA TRP A 27 51.827 39.462 43.577 1.00 15.63 C -ATOM 80 C TRP A 27 53.117 38.694 43.339 1.00 13.92 C -ATOM 81 O TRP A 27 53.144 37.728 42.595 1.00 12.13 O -ATOM 82 CB TRP A 27 50.596 38.703 43.019 1.00 11.96 C -ATOM 83 CG TRP A 27 49.263 39.463 43.147 1.00 11.14 C -ATOM 84 CD1 TRP A 27 48.655 40.009 42.035 1.00 11.57 C -ATOM 85 CD2 TRP A 27 48.540 39.681 44.301 1.00 13.48 C -ATOM 86 NE1 TRP A 27 47.556 40.562 42.482 1.00 10.27 N -ATOM 87 CE2 TRP A 27 47.439 40.401 43.808 1.00 10.92 C -ATOM 88 CE3 TRP A 27 48.623 39.397 45.681 1.00 13.18 C -ATOM 89 CZ2 TRP A 27 46.423 40.836 44.680 1.00 10.34 C -ATOM 90 CZ3 TRP A 27 47.605 39.840 46.538 1.00 11.90 C -ATOM 91 CH2 TRP A 27 46.513 40.551 46.040 1.00 10.77 C -ATOM 92 N PRO A 28 54.229 39.090 43.951 1.00 11.86 N -ATOM 93 CA PRO A 28 55.548 38.663 43.566 1.00 12.64 C -ATOM 94 C PRO A 28 55.962 37.263 44.017 1.00 11.81 C -ATOM 95 O PRO A 28 57.054 36.803 43.660 1.00 11.52 O -ATOM 96 CB PRO A 28 56.413 39.809 44.089 1.00 14.52 C -ATOM 97 CG PRO A 28 55.730 40.196 45.376 1.00 12.82 C -ATOM 98 CD PRO A 28 54.281 40.117 44.984 1.00 11.25 C -ATOM 99 N SER A 29 55.096 36.568 44.781 1.00 9.76 N -ATOM 100 CA SER A 29 55.334 35.159 45.098 1.00 9.96 C -ATOM 101 C SER A 29 54.674 34.231 44.069 1.00 9.91 C -ATOM 102 O SER A 29 54.900 33.017 44.093 1.00 9.94 O -ATOM 103 CB SER A 29 54.789 34.832 46.503 1.00 8.62 C -ATOM 104 OG SER A 29 53.364 34.849 46.566 1.00 12.43 O -ATOM 105 N GLN A 30 53.845 34.765 43.154 1.00 8.00 N -ATOM 106 CA GLN A 30 53.241 33.980 42.087 1.00 8.57 C -ATOM 107 C GLN A 30 54.294 33.417 41.123 1.00 10.02 C -ATOM 108 O GLN A 30 55.207 34.132 40.697 1.00 10.78 O -ATOM 109 CB GLN A 30 52.264 34.846 41.275 1.00 10.17 C -ATOM 110 CG GLN A 30 51.653 34.201 40.027 1.00 8.01 C -ATOM 111 CD GLN A 30 50.507 33.288 40.306 1.00 9.07 C -ATOM 112 OE1 GLN A 30 49.469 33.711 40.810 1.00 10.33 O -ATOM 113 NE2 GLN A 30 50.621 32.014 39.953 1.00 10.31 N -ATOM 114 N ILE A 31 54.210 32.116 40.793 1.00 8.92 N -ATOM 115 CA ILE A 31 55.088 31.545 39.777 1.00 6.99 C -ATOM 116 C ILE A 31 54.240 30.889 38.673 1.00 7.32 C -ATOM 117 O ILE A 31 53.032 30.629 38.858 1.00 6.13 O -ATOM 118 CB ILE A 31 56.136 30.486 40.429 1.00 9.28 C -ATOM 119 CG1 ILE A 31 55.501 29.162 40.903 1.00 7.00 C -ATOM 120 CG2 ILE A 31 56.814 31.169 41.627 1.00 8.47 C -ATOM 121 CD1 ILE A 31 55.220 28.102 39.818 1.00 8.11 C -ATOM 122 N SER A 32 54.850 30.664 37.482 1.00 8.48 N -ATOM 123 CA SER A 32 54.240 29.916 36.392 1.00 9.14 C -ATOM 124 C SER A 32 54.994 28.595 36.331 1.00 7.06 C -ATOM 125 O SER A 32 56.212 28.571 36.246 1.00 8.01 O -ATOM 126 CB SER A 32 54.410 30.660 35.057 1.00 9.53 C -ATOM 127 OG SER A 32 54.099 29.861 33.919 1.00 10.59 O -ATOM 128 N LEU A 33 54.275 27.494 36.373 1.00 9.59 N -ATOM 129 CA LEU A 33 54.858 26.166 36.265 1.00 9.76 C -ATOM 130 C LEU A 33 54.588 25.764 34.825 1.00 10.03 C -ATOM 131 O LEU A 33 53.451 25.728 34.380 1.00 8.61 O -ATOM 132 CB LEU A 33 54.176 25.127 37.197 1.00 10.56 C -ATOM 133 CG LEU A 33 54.678 23.658 37.079 1.00 9.91 C -ATOM 134 CD1 LEU A 33 56.085 23.543 37.617 1.00 7.64 C -ATOM 135 CD2 LEU A 33 53.734 22.732 37.820 1.00 12.30 C -ATOM 136 N GLN A 34 55.645 25.383 34.129 1.00 12.13 N -ATOM 137 CA GLN A 34 55.609 25.150 32.694 1.00 13.18 C -ATOM 138 C GLN A 34 56.151 23.795 32.353 1.00 11.91 C -ATOM 139 O GLN A 34 57.055 23.357 33.054 1.00 13.44 O -ATOM 140 CB GLN A 34 56.479 26.194 31.955 1.00 12.93 C -ATOM 141 CG GLN A 34 55.982 27.572 32.291 1.00 12.27 C -ATOM 142 CD GLN A 34 56.605 28.671 31.492 1.00 13.36 C -ATOM 143 OE1 GLN A 34 57.616 28.521 30.808 1.00 13.40 O -ATOM 144 NE2 GLN A 34 55.926 29.794 31.626 1.00 11.34 N -ATOM 145 N TYR A 35 55.675 23.147 31.306 1.00 11.44 N -ATOM 146 CA TYR A 35 56.313 21.907 30.895 1.00 14.14 C -ATOM 147 C TYR A 35 56.852 22.024 29.466 1.00 14.38 C -ATOM 148 O TYR A 35 56.391 22.859 28.695 1.00 13.75 O -ATOM 149 CB TYR A 35 55.327 20.761 30.987 1.00 13.02 C -ATOM 150 CG TYR A 35 54.128 20.842 30.062 1.00 19.19 C -ATOM 151 CD1 TYR A 35 53.089 21.733 30.324 1.00 20.94 C -ATOM 152 CD2 TYR A 35 54.087 20.023 28.922 1.00 22.45 C -ATOM 153 CE1 TYR A 35 52.006 21.816 29.452 1.00 23.87 C -ATOM 154 CE2 TYR A 35 52.999 20.103 28.049 1.00 22.05 C -ATOM 155 CZ TYR A 35 51.964 20.998 28.321 1.00 24.06 C -ATOM 156 OH TYR A 35 50.865 21.061 27.476 1.00 25.35 O -ATOM 157 N ARG A 36 57.832 21.217 29.075 1.00 16.04 N -ATOM 158 CA ARG A 36 58.391 21.298 27.740 1.00 19.73 C -ATOM 159 C ARG A 36 57.462 20.582 26.795 1.00 22.34 C -ATOM 160 O ARG A 36 56.908 19.520 27.036 1.00 22.37 O -ATOM 161 CB ARG A 36 59.757 20.698 27.755 1.00 21.39 C -ATOM 162 CG ARG A 36 60.578 21.142 26.575 1.00 24.73 C -ATOM 163 CD ARG A 36 62.004 20.688 26.765 1.00 30.91 C -ATOM 164 NE ARG A 36 62.103 19.297 27.236 1.00 38.05 N -ATOM 165 CZ ARG A 36 61.826 18.166 26.523 1.00 39.47 C -ATOM 166 NH1 ARG A 36 61.391 18.177 25.242 1.00 43.28 N -ATOM 167 NH2 ARG A 36 62.026 16.974 27.092 1.00 37.49 N -ATOM 168 N SER A 37 57.147 21.355 25.786 1.00 25.25 N -ATOM 169 CA SER A 37 56.184 20.971 24.794 1.00 32.58 C -ATOM 170 C SER A 37 56.928 21.157 23.477 1.00 37.49 C -ATOM 171 O SER A 37 57.067 22.276 22.947 1.00 38.55 O -ATOM 172 CB SER A 37 55.010 21.909 24.986 1.00 34.35 C -ATOM 173 OG SER A 37 53.918 21.576 24.154 1.00 39.18 O -ATOM 174 N GLY A 38 57.490 20.028 23.009 1.00 39.31 N -ATOM 175 CA GLY A 38 58.282 19.988 21.792 1.00 40.50 C -ATOM 176 C GLY A 38 59.594 20.740 21.968 1.00 42.41 C -ATOM 177 O GLY A 38 60.516 20.339 22.693 1.00 42.97 O -ATOM 178 N SER A 39 59.595 21.879 21.277 1.00 42.87 N -ATOM 179 CA SER A 39 60.731 22.796 21.262 1.00 44.46 C -ATOM 180 C SER A 39 60.594 23.962 22.239 1.00 43.55 C -ATOM 181 O SER A 39 61.551 24.647 22.607 1.00 45.39 O -ATOM 182 CB SER A 39 60.874 23.321 19.850 1.00 47.58 C -ATOM 183 OG SER A 39 59.583 23.585 19.282 1.00 51.23 O -ATOM 184 N SER A 40 59.345 24.174 22.644 1.00 41.15 N -ATOM 185 CA SER A 40 58.971 25.266 23.518 1.00 38.12 C -ATOM 186 C SER A 40 58.493 24.800 24.901 1.00 33.55 C -ATOM 187 O SER A 40 58.634 23.624 25.245 1.00 32.42 O -ATOM 188 CB SER A 40 57.905 26.050 22.768 1.00 40.19 C -ATOM 189 OG SER A 40 56.915 25.159 22.253 1.00 45.65 O -ATOM 190 N TRP A 41 57.967 25.752 25.687 1.00 27.38 N -ATOM 191 CA TRP A 41 57.496 25.523 27.043 1.00 22.42 C -ATOM 192 C TRP A 41 56.114 26.091 27.135 1.00 19.86 C -ATOM 193 O TRP A 41 55.904 27.195 26.677 1.00 21.58 O -ATOM 194 CB TRP A 41 58.348 26.242 28.014 1.00 22.39 C -ATOM 195 CG TRP A 41 59.743 25.673 28.140 1.00 23.61 C -ATOM 196 CD1 TRP A 41 60.790 26.138 27.371 1.00 22.48 C -ATOM 197 CD2 TRP A 41 60.106 24.685 29.028 1.00 24.55 C -ATOM 198 NE1 TRP A 41 61.828 25.437 27.779 1.00 25.26 N -ATOM 199 CE2 TRP A 41 61.481 24.564 28.756 1.00 25.15 C -ATOM 200 CE3 TRP A 41 59.498 23.894 30.019 1.00 24.05 C -ATOM 201 CZ2 TRP A 41 62.247 23.644 29.482 1.00 24.19 C -ATOM 202 CZ3 TRP A 41 60.279 22.981 30.736 1.00 21.92 C -ATOM 203 CH2 TRP A 41 61.635 22.859 30.471 1.00 23.76 C -ATOM 204 N ALA A 42 55.153 25.389 27.704 1.00 16.35 N -ATOM 205 CA ALA A 42 53.776 25.840 27.824 1.00 15.04 C -ATOM 206 C ALA A 42 53.388 25.995 29.315 1.00 14.44 C -ATOM 207 O ALA A 42 53.767 25.155 30.145 1.00 13.83 O -ATOM 208 CB ALA A 42 52.825 24.815 27.202 1.00 13.91 C -ATOM 209 N HIS A 43 52.632 27.039 29.679 1.00 11.49 N -ATOM 210 CA HIS A 43 52.146 27.185 31.048 1.00 12.37 C -ATOM 211 C HIS A 43 51.090 26.108 31.347 1.00 10.74 C -ATOM 212 O HIS A 43 50.169 25.878 30.566 1.00 11.37 O -ATOM 213 CB HIS A 43 51.548 28.584 31.205 1.00 12.11 C -ATOM 214 CG HIS A 43 50.789 28.830 32.491 1.00 11.84 C -ATOM 215 ND1 HIS A 43 51.312 29.320 33.609 1.00 11.21 N -ATOM 216 CD2 HIS A 43 49.454 28.549 32.701 1.00 12.94 C -ATOM 217 CE1 HIS A 43 50.340 29.340 34.491 1.00 12.11 C -ATOM 218 NE2 HIS A 43 49.227 28.879 33.948 1.00 10.55 N -ATOM 219 N THR A 44 51.215 25.400 32.464 1.00 9.11 N -ATOM 220 CA THR A 44 50.175 24.476 32.872 1.00 9.74 C -ATOM 221 C THR A 44 49.510 24.819 34.228 1.00 7.13 C -ATOM 222 O THR A 44 48.329 24.556 34.440 1.00 7.38 O -ATOM 223 CB THR A 44 50.822 23.066 32.851 1.00 10.48 C -ATOM 224 OG1 THR A 44 49.727 22.191 32.998 1.00 14.23 O -ATOM 225 CG2 THR A 44 51.867 22.787 33.920 1.00 12.75 C -ATOM 226 N CYS A 45 50.235 25.490 35.116 1.00 6.51 N -ATOM 227 CA CYS A 45 49.773 25.700 36.485 1.00 6.29 C -ATOM 228 C CYS A 45 50.423 26.923 37.125 1.00 5.70 C -ATOM 229 O CYS A 45 51.443 27.401 36.620 1.00 4.80 O -ATOM 230 CB CYS A 45 50.122 24.446 37.382 1.00 8.42 C -ATOM 231 SG CYS A 45 48.919 23.107 37.188 1.00 10.15 S -ATOM 232 N GLY A 46 49.794 27.434 38.193 1.00 6.07 N -ATOM 233 CA GLY A 46 50.444 28.450 38.978 1.00 7.86 C -ATOM 234 C GLY A 46 51.105 27.748 40.178 1.00 10.78 C -ATOM 235 O GLY A 46 51.065 26.510 40.318 1.00 11.22 O -ATOM 236 N GLY A 47 51.711 28.548 41.043 1.00 6.54 N -ATOM 237 CA GLY A 47 52.285 28.063 42.289 1.00 6.80 C -ATOM 238 C GLY A 47 52.661 29.272 43.136 1.00 7.93 C -ATOM 239 O GLY A 47 52.493 30.423 42.702 1.00 9.16 O -ATOM 240 N THR A 48 53.219 29.016 44.305 1.00 7.69 N -ATOM 241 CA THR A 48 53.681 30.047 45.215 1.00 8.22 C -ATOM 242 C THR A 48 55.117 29.798 45.606 1.00 9.03 C -ATOM 243 O THR A 48 55.466 28.710 46.049 1.00 10.78 O -ATOM 244 CB THR A 48 52.811 30.066 46.470 1.00 10.32 C -ATOM 245 OG1 THR A 48 51.476 30.319 46.073 1.00 9.40 O -ATOM 246 CG2 THR A 48 53.206 31.179 47.448 1.00 9.14 C -ATOM 247 N LEU A 49 56.018 30.767 45.471 1.00 9.93 N -ATOM 248 CA LEU A 49 57.386 30.650 45.934 1.00 10.04 C -ATOM 249 C LEU A 49 57.389 30.698 47.474 1.00 10.76 C -ATOM 250 O LEU A 49 56.894 31.661 48.042 1.00 9.70 O -ATOM 251 CB LEU A 49 58.216 31.805 45.323 1.00 9.80 C -ATOM 252 CG LEU A 49 59.709 31.758 45.631 1.00 12.10 C -ATOM 253 CD1 LEU A 49 60.337 30.629 44.818 1.00 10.75 C -ATOM 254 CD2 LEU A 49 60.348 33.111 45.320 1.00 12.86 C -ATOM 255 N ILE A 50 57.843 29.663 48.187 1.00 10.28 N -ATOM 256 CA ILE A 50 57.774 29.700 49.641 1.00 11.21 C -ATOM 257 C ILE A 50 59.150 29.768 50.263 1.00 10.60 C -ATOM 258 O ILE A 50 59.280 30.150 51.428 1.00 11.17 O -ATOM 259 CB ILE A 50 57.008 28.470 50.241 1.00 10.84 C -ATOM 260 CG1 ILE A 50 57.635 27.146 49.819 1.00 12.83 C -ATOM 261 CG2 ILE A 50 55.545 28.694 49.943 1.00 8.94 C -ATOM 262 CD1 ILE A 50 56.887 25.953 50.437 1.00 19.56 C -ATOM 263 N ARG A 51 60.179 29.331 49.538 1.00 11.39 N -ATOM 264 CA ARG A 51 61.572 29.479 49.921 1.00 14.84 C -ATOM 265 C ARG A 51 62.311 29.843 48.642 1.00 14.15 C -ATOM 266 O ARG A 51 61.754 29.654 47.574 1.00 15.83 O -ATOM 267 CB ARG A 51 62.252 28.189 50.447 1.00 15.49 C -ATOM 268 CG ARG A 51 61.749 27.603 51.730 1.00 20.57 C -ATOM 269 CD ARG A 51 61.836 28.700 52.749 1.00 26.75 C -ATOM 270 NE ARG A 51 61.483 28.198 54.067 1.00 36.70 N -ATOM 271 CZ ARG A 51 60.229 28.103 54.521 1.00 40.23 C -ATOM 272 NH1 ARG A 51 59.155 28.467 53.810 1.00 44.96 N -ATOM 273 NH2 ARG A 51 60.048 27.549 55.715 1.00 45.37 N -ATOM 274 N GLN A 52 63.559 30.313 48.677 1.00 14.77 N -ATOM 275 CA GLN A 52 64.315 30.613 47.475 1.00 17.69 C -ATOM 276 C GLN A 52 64.508 29.415 46.557 1.00 17.94 C -ATOM 277 O GLN A 52 64.717 29.568 45.362 1.00 16.30 O -ATOM 278 CB GLN A 52 65.684 31.156 47.836 1.00 22.60 C -ATOM 279 CG GLN A 52 65.565 32.611 48.259 1.00 31.18 C -ATOM 280 CD GLN A 52 66.887 33.323 48.580 1.00 38.73 C -ATOM 281 OE1 GLN A 52 67.126 33.760 49.719 1.00 43.53 O -ATOM 282 NE2 GLN A 52 67.782 33.472 47.599 1.00 39.25 N -ATOM 283 N ASN A 53 64.408 28.203 47.090 1.00 15.33 N -ATOM 284 CA ASN A 53 64.510 27.011 46.265 1.00 16.68 C -ATOM 285 C ASN A 53 63.330 26.053 46.454 1.00 14.98 C -ATOM 286 O ASN A 53 63.459 24.884 46.119 1.00 13.92 O -ATOM 287 CB ASN A 53 65.830 26.296 46.572 1.00 17.35 C -ATOM 288 CG ASN A 53 66.052 25.916 48.036 1.00 18.96 C -ATOM 289 OD1 ASN A 53 66.934 25.116 48.326 1.00 24.48 O -ATOM 290 ND2 ASN A 53 65.351 26.389 49.059 1.00 19.62 N -ATOM 291 N TRP A 54 62.187 26.485 47.000 1.00 11.60 N -ATOM 292 CA TRP A 54 61.013 25.626 47.134 1.00 11.68 C -ATOM 293 C TRP A 54 59.781 26.386 46.654 1.00 10.70 C -ATOM 294 O TRP A 54 59.648 27.594 46.913 1.00 11.59 O -ATOM 295 CB TRP A 54 60.775 25.158 48.617 1.00 11.66 C -ATOM 296 CG TRP A 54 61.683 24.023 49.131 1.00 14.01 C -ATOM 297 CD1 TRP A 54 62.831 24.286 49.837 1.00 16.95 C -ATOM 298 CD2 TRP A 54 61.487 22.654 48.953 1.00 16.32 C -ATOM 299 NE1 TRP A 54 63.376 23.106 50.101 1.00 17.14 N -ATOM 300 CE2 TRP A 54 62.619 22.108 49.598 1.00 16.55 C -ATOM 301 CE3 TRP A 54 60.541 21.809 48.355 1.00 14.98 C -ATOM 302 CZ2 TRP A 54 62.823 20.732 49.657 1.00 14.78 C -ATOM 303 CZ3 TRP A 54 60.753 20.430 48.420 1.00 18.60 C -ATOM 304 CH2 TRP A 54 61.880 19.901 49.063 1.00 16.24 C -ATOM 305 N VAL A 55 58.943 25.673 45.877 1.00 9.81 N -ATOM 306 CA VAL A 55 57.666 26.154 45.334 1.00 10.27 C -ATOM 307 C VAL A 55 56.517 25.268 45.825 1.00 10.57 C -ATOM 308 O VAL A 55 56.636 24.045 45.875 1.00 11.53 O -ATOM 309 CB VAL A 55 57.697 26.160 43.748 1.00 11.35 C -ATOM 310 CG1 VAL A 55 56.318 26.081 43.062 1.00 11.56 C -ATOM 311 CG2 VAL A 55 58.243 27.503 43.327 1.00 10.32 C -ATOM 312 N MET A 56 55.386 25.846 46.219 1.00 8.66 N -ATOM 313 CA MET A 56 54.227 25.076 46.603 1.00 7.44 C -ATOM 314 C MET A 56 53.219 25.081 45.458 1.00 10.16 C -ATOM 315 O MET A 56 52.927 26.154 44.924 1.00 9.25 O -ATOM 316 CB MET A 56 53.670 25.703 47.875 1.00 9.29 C -ATOM 317 CG MET A 56 52.377 25.079 48.372 1.00 10.71 C -ATOM 318 SD MET A 56 51.700 25.886 49.852 1.00 13.02 S -ATOM 319 CE MET A 56 51.288 27.566 49.430 1.00 9.38 C -ATOM 320 N THR A 57 52.628 23.952 45.055 1.00 8.68 N -ATOM 321 CA THR A 57 51.655 23.921 43.955 1.00 6.91 C -ATOM 322 C THR A 57 50.646 22.812 44.262 1.00 7.86 C -ATOM 323 O THR A 57 50.679 22.256 45.374 1.00 7.97 O -ATOM 324 CB THR A 57 52.436 23.702 42.597 1.00 5.11 C -ATOM 325 OG1 THR A 57 51.496 23.956 41.567 1.00 5.03 O -ATOM 326 CG2 THR A 57 52.996 22.303 42.379 1.00 5.45 C -ATOM 327 N ALA A 58 49.721 22.481 43.359 1.00 8.02 N -ATOM 328 CA ALA A 58 48.786 21.380 43.583 1.00 8.76 C -ATOM 329 C ALA A 58 49.418 20.058 43.095 1.00 10.42 C -ATOM 330 O ALA A 58 50.202 20.041 42.128 1.00 8.70 O -ATOM 331 CB ALA A 58 47.485 21.629 42.817 1.00 7.33 C -ATOM 332 N ALA A 59 49.157 18.938 43.792 1.00 9.16 N -ATOM 333 CA ALA A 59 49.627 17.641 43.341 1.00 8.74 C -ATOM 334 C ALA A 59 49.083 17.230 41.957 1.00 9.94 C -ATOM 335 O ALA A 59 49.797 16.613 41.149 1.00 9.40 O -ATOM 336 CB ALA A 59 49.212 16.591 44.328 1.00 9.97 C -ATOM 337 N HIS A 60 47.853 17.606 41.585 1.00 9.12 N -ATOM 338 CA HIS A 60 47.349 17.225 40.272 1.00 10.21 C -ATOM 339 C HIS A 60 48.119 17.919 39.140 1.00 9.84 C -ATOM 340 O HIS A 60 48.018 17.452 38.006 1.00 10.59 O -ATOM 341 CB HIS A 60 45.823 17.534 40.124 1.00 9.52 C -ATOM 342 CG HIS A 60 45.355 18.977 39.952 1.00 12.03 C -ATOM 343 ND1 HIS A 60 44.765 19.764 40.861 1.00 13.28 N -ATOM 344 CD2 HIS A 60 45.448 19.698 38.779 1.00 11.66 C -ATOM 345 CE1 HIS A 60 44.505 20.915 40.306 1.00 12.79 C -ATOM 346 NE2 HIS A 60 44.916 20.850 39.061 1.00 13.95 N -ATOM 347 N CYS A 61 48.885 18.995 39.406 1.00 7.85 N -ATOM 348 CA CYS A 61 49.713 19.651 38.388 1.00 9.63 C -ATOM 349 C CYS A 61 50.914 18.793 37.965 1.00 11.75 C -ATOM 350 O CYS A 61 51.460 18.975 36.873 1.00 11.07 O -ATOM 351 CB CYS A 61 50.279 20.995 38.878 1.00 9.53 C -ATOM 352 SG CYS A 61 48.981 22.231 39.006 1.00 9.56 S -ATOM 353 N VAL A 62 51.372 17.885 38.838 1.00 11.98 N -ATOM 354 CA VAL A 62 52.538 17.079 38.543 1.00 13.47 C -ATOM 355 C VAL A 62 52.177 15.599 38.430 1.00 14.50 C -ATOM 356 O VAL A 62 53.049 14.733 38.528 1.00 15.98 O -ATOM 357 CB VAL A 62 53.637 17.283 39.615 1.00 14.34 C -ATOM 358 CG1 VAL A 62 54.198 18.694 39.437 1.00 14.68 C -ATOM 359 CG2 VAL A 62 53.117 17.128 41.041 1.00 15.60 C -ATOM 360 N ASP A 63 50.899 15.278 38.187 1.00 14.73 N -ATOM 361 CA ASP A 63 50.545 13.889 37.961 1.00 19.22 C -ATOM 362 C ASP A 63 51.208 13.313 36.716 1.00 20.60 C -ATOM 363 O ASP A 63 51.656 12.159 36.748 1.00 22.54 O -ATOM 364 CB ASP A 63 49.029 13.724 37.841 1.00 18.62 C -ATOM 365 CG ASP A 63 48.279 13.565 39.174 1.00 18.39 C -ATOM 366 OD1 ASP A 63 48.843 13.089 40.164 1.00 18.09 O -ATOM 367 OD2 ASP A 63 47.100 13.916 39.199 1.00 18.27 O -ATOM 368 N ARG A 64 51.318 14.065 35.615 1.00 20.95 N -ATOM 369 CA ARG A 64 52.016 13.547 34.448 1.00 21.05 C -ATOM 370 C ARG A 64 53.499 13.775 34.581 1.00 20.06 C -ATOM 371 O ARG A 64 53.971 14.823 35.033 1.00 22.98 O -ATOM 372 CB ARG A 64 51.526 14.202 33.157 1.00 25.12 C -ATOM 373 CG ARG A 64 50.231 13.593 32.567 1.00 34.24 C -ATOM 374 CD ARG A 64 50.160 12.057 32.234 1.00 44.22 C -ATOM 375 NE ARG A 64 51.129 11.521 31.257 1.00 53.66 N -ATOM 376 CZ ARG A 64 50.832 11.172 29.978 1.00 57.48 C -ATOM 377 NH1 ARG A 64 49.601 11.283 29.442 1.00 58.71 N -ATOM 378 NH2 ARG A 64 51.800 10.675 29.203 1.00 57.72 N -ATOM 379 N GLU A 65 54.238 12.753 34.165 1.00 17.07 N -ATOM 380 CA GLU A 65 55.679 12.742 34.250 1.00 17.82 C -ATOM 381 C GLU A 65 56.333 13.452 33.078 1.00 19.64 C -ATOM 382 O GLU A 65 56.778 12.820 32.122 1.00 20.83 O -ATOM 383 CB GLU A 65 56.143 11.299 34.335 1.00 18.50 C -ATOM 384 CG GLU A 65 55.616 10.706 35.633 1.00 20.29 C -ATOM 385 CD GLU A 65 56.362 9.473 36.085 1.00 17.04 C -ATOM 386 OE1 GLU A 65 57.553 9.583 36.382 1.00 17.50 O -ATOM 387 OE2 GLU A 65 55.729 8.427 36.140 1.00 19.42 O -ATOM 388 N LEU A 66 56.420 14.785 33.220 1.00 15.92 N -ATOM 389 CA LEU A 66 56.848 15.716 32.176 1.00 15.64 C -ATOM 390 C LEU A 66 58.095 16.424 32.660 1.00 16.72 C -ATOM 391 O LEU A 66 58.454 16.286 33.833 1.00 16.69 O -ATOM 392 CB LEU A 66 55.757 16.768 31.946 1.00 17.74 C -ATOM 393 CG LEU A 66 54.328 16.332 31.660 1.00 18.78 C -ATOM 394 CD1 LEU A 66 53.378 17.487 31.846 1.00 21.80 C -ATOM 395 CD2 LEU A 66 54.222 15.831 30.257 1.00 20.48 C -ATOM 396 N THR A 67 58.774 17.160 31.774 1.00 13.72 N -ATOM 397 CA THR A 67 59.883 18.010 32.146 1.00 15.03 C -ATOM 398 C THR A 67 59.310 19.379 32.563 1.00 15.54 C -ATOM 399 O THR A 67 58.695 20.086 31.764 1.00 16.15 O -ATOM 400 CB THR A 67 60.871 18.249 30.983 1.00 16.91 C -ATOM 401 OG1 THR A 67 61.456 17.006 30.642 1.00 19.43 O -ATOM 402 CG2 THR A 67 61.986 19.202 31.361 1.00 16.06 C -ATOM 403 N PHE A 68 59.563 19.798 33.809 1.00 14.23 N -ATOM 404 CA PHE A 68 58.984 21.009 34.356 1.00 12.00 C -ATOM 405 C PHE A 68 60.057 22.023 34.658 1.00 11.66 C -ATOM 406 O PHE A 68 61.182 21.699 35.038 1.00 12.35 O -ATOM 407 CB PHE A 68 58.227 20.727 35.660 1.00 10.94 C -ATOM 408 CG PHE A 68 56.966 19.891 35.537 1.00 10.22 C -ATOM 409 CD1 PHE A 68 55.824 20.423 34.932 1.00 10.34 C -ATOM 410 CD2 PHE A 68 56.952 18.589 36.055 1.00 13.17 C -ATOM 411 CE1 PHE A 68 54.669 19.641 34.855 1.00 12.14 C -ATOM 412 CE2 PHE A 68 55.785 17.811 35.969 1.00 8.93 C -ATOM 413 CZ PHE A 68 54.648 18.339 35.372 1.00 12.34 C -ATOM 414 N ARG A 69 59.656 23.281 34.477 1.00 11.68 N -ATOM 415 CA ARG A 69 60.474 24.403 34.916 1.00 11.50 C -ATOM 416 C ARG A 69 59.529 25.414 35.583 1.00 8.81 C -ATOM 417 O ARG A 69 58.320 25.415 35.394 1.00 10.24 O -ATOM 418 CB ARG A 69 61.213 25.098 33.743 1.00 11.76 C -ATOM 419 CG ARG A 69 60.364 25.979 32.846 1.00 14.86 C -ATOM 420 CD ARG A 69 61.293 26.707 31.895 1.00 16.28 C -ATOM 421 NE ARG A 69 60.420 27.583 31.120 1.00 19.92 N -ATOM 422 CZ ARG A 69 60.875 28.394 30.165 1.00 21.52 C -ATOM 423 NH1 ARG A 69 62.162 28.451 29.840 1.00 20.39 N -ATOM 424 NH2 ARG A 69 60.016 29.192 29.543 1.00 20.72 N -ATOM 425 N VAL A 70 60.129 26.315 36.347 1.00 11.12 N -ATOM 426 CA VAL A 70 59.422 27.336 37.099 1.00 10.60 C -ATOM 427 C VAL A 70 59.950 28.655 36.558 1.00 9.31 C -ATOM 428 O VAL A 70 61.156 28.828 36.334 1.00 10.93 O -ATOM 429 CB VAL A 70 59.753 27.097 38.634 1.00 9.18 C -ATOM 430 CG1 VAL A 70 59.743 28.373 39.455 1.00 13.34 C -ATOM 431 CG2 VAL A 70 58.721 26.109 39.166 1.00 6.24 C -ATOM 432 N VAL A 71 58.992 29.549 36.368 1.00 8.89 N -ATOM 433 CA VAL A 71 59.338 30.909 36.017 1.00 11.93 C -ATOM 434 C VAL A 71 58.852 31.852 37.120 1.00 11.92 C -ATOM 435 O VAL A 71 57.655 31.937 37.432 1.00 12.15 O -ATOM 436 CB VAL A 71 58.702 31.317 34.647 1.00 14.02 C -ATOM 437 CG1 VAL A 71 59.272 32.677 34.251 1.00 10.96 C -ATOM 438 CG2 VAL A 71 59.011 30.289 33.563 1.00 13.43 C -ATOM 439 N VAL A 72 59.804 32.566 37.744 1.00 13.18 N -ATOM 440 CA VAL A 72 59.451 33.594 38.734 1.00 12.34 C -ATOM 441 C VAL A 72 59.636 34.991 38.089 1.00 14.36 C -ATOM 442 O VAL A 72 60.312 35.152 37.048 1.00 13.27 O -ATOM 443 CB VAL A 72 60.327 33.453 40.043 1.00 11.92 C -ATOM 444 CG1 VAL A 72 60.168 32.062 40.595 1.00 12.55 C -ATOM 445 CG2 VAL A 72 61.794 33.651 39.807 1.00 11.27 C -ATOM 446 N GLY A 73 58.974 36.008 38.646 1.00 11.87 N -ATOM 447 CA GLY A 73 59.073 37.371 38.121 1.00 14.08 C -ATOM 448 C GLY A 73 58.387 37.512 36.773 1.00 15.09 C -ATOM 449 O GLY A 73 58.735 38.353 35.952 1.00 13.12 O -ATOM 450 N GLU A 74 57.377 36.673 36.557 1.00 14.89 N -ATOM 451 CA GLU A 74 56.680 36.658 35.300 1.00 15.18 C -ATOM 452 C GLU A 74 55.441 37.519 35.345 1.00 15.13 C -ATOM 453 O GLU A 74 54.729 37.580 36.343 1.00 15.30 O -ATOM 454 CB GLU A 74 56.305 35.201 34.918 1.00 15.63 C -ATOM 455 CG GLU A 74 55.658 34.857 33.578 1.00 14.24 C -ATOM 456 CD GLU A 74 56.448 35.409 32.404 1.00 17.13 C -ATOM 457 OE1 GLU A 74 56.479 36.597 32.299 1.00 16.38 O -ATOM 458 OE2 GLU A 74 57.040 34.708 31.606 1.00 19.38 O -ATOM 459 N HIS A 75 55.228 38.237 34.232 1.00 15.92 N -ATOM 460 CA HIS A 75 53.987 38.963 34.068 1.00 14.16 C -ATOM 461 C HIS A 75 53.300 38.688 32.718 1.00 15.24 C -ATOM 462 O HIS A 75 52.114 38.343 32.754 1.00 13.71 O -ATOM 463 CB HIS A 75 54.285 40.426 34.247 1.00 16.58 C -ATOM 464 CG HIS A 75 53.004 41.234 34.238 1.00 18.47 C -ATOM 465 ND1 HIS A 75 52.022 41.152 35.121 1.00 19.99 N -ATOM 466 CD2 HIS A 75 52.667 42.159 33.285 1.00 19.29 C -ATOM 467 CE1 HIS A 75 51.097 41.991 34.744 1.00 21.94 C -ATOM 468 NE2 HIS A 75 51.491 42.588 33.645 1.00 23.35 N -ATOM 469 N ASN A 76 53.936 38.875 31.533 1.00 12.62 N -ATOM 470 CA ASN A 76 53.282 38.553 30.275 1.00 12.88 C -ATOM 471 C ASN A 76 53.830 37.233 29.786 1.00 13.49 C -ATOM 472 O ASN A 76 55.021 37.202 29.520 1.00 14.57 O -ATOM 473 CB ASN A 76 53.557 39.636 29.227 1.00 14.38 C -ATOM 474 CG ASN A 76 52.816 39.356 27.917 1.00 16.99 C -ATOM 475 OD1 ASN A 76 52.985 38.314 27.303 1.00 18.07 O -ATOM 476 ND2 ASN A 76 51.957 40.205 27.375 1.00 18.06 N -ATOM 477 N LEU A 77 53.074 36.138 29.618 1.00 13.10 N -ATOM 478 CA LEU A 77 53.654 34.856 29.191 1.00 16.26 C -ATOM 479 C LEU A 77 54.349 34.840 27.835 1.00 18.78 C -ATOM 480 O LEU A 77 55.335 34.135 27.607 1.00 16.87 O -ATOM 481 CB LEU A 77 52.587 33.746 29.171 1.00 12.97 C -ATOM 482 CG LEU A 77 52.036 33.309 30.510 1.00 12.19 C -ATOM 483 CD1 LEU A 77 50.886 32.342 30.314 1.00 10.63 C -ATOM 484 CD2 LEU A 77 53.160 32.685 31.334 1.00 11.40 C -ATOM 485 N ASN A 78 53.889 35.718 26.964 1.00 22.18 N -ATOM 486 CA ASN A 78 54.380 35.717 25.614 1.00 27.02 C -ATOM 487 C ASN A 78 55.407 36.791 25.304 1.00 29.22 C -ATOM 488 O ASN A 78 55.888 36.812 24.167 1.00 31.27 O -ATOM 489 CB ASN A 78 53.136 35.808 24.724 1.00 30.95 C -ATOM 490 CG ASN A 78 52.153 34.665 24.993 1.00 34.09 C -ATOM 491 OD1 ASN A 78 51.008 34.856 25.420 1.00 36.04 O -ATOM 492 ND2 ASN A 78 52.594 33.422 24.807 1.00 35.73 N -ATOM 493 N GLN A 79 55.796 37.686 26.230 1.00 29.09 N -ATOM 494 CA GLN A 79 56.730 38.787 25.929 1.00 27.70 C -ATOM 495 C GLN A 79 57.879 38.885 26.904 1.00 26.60 C -ATOM 496 O GLN A 79 57.615 38.583 28.052 1.00 20.79 O -ATOM 497 CB GLN A 79 56.043 40.128 25.981 1.00 31.97 C -ATOM 498 CG GLN A 79 55.124 40.432 24.818 1.00 40.38 C -ATOM 499 CD GLN A 79 54.257 41.660 25.083 1.00 45.18 C -ATOM 500 OE1 GLN A 79 54.605 42.525 25.898 1.00 49.79 O -ATOM 501 NE2 GLN A 79 53.099 41.765 24.418 1.00 45.59 N -ATOM 502 N ASN A 80 59.125 39.256 26.607 1.00 24.38 N -ATOM 503 CA ASN A 80 60.093 39.436 27.672 1.00 26.13 C -ATOM 504 C ASN A 80 59.733 40.691 28.492 1.00 24.82 C -ATOM 505 O ASN A 80 59.459 41.770 27.975 1.00 24.22 O -ATOM 506 CB ASN A 80 61.525 39.577 27.110 1.00 31.06 C -ATOM 507 CG ASN A 80 62.609 39.916 28.160 1.00 36.12 C -ATOM 508 OD1 ASN A 80 62.814 39.231 29.174 1.00 37.74 O -ATOM 509 ND2 ASN A 80 63.332 41.026 27.967 1.00 40.37 N -ATOM 510 N ASN A 81 59.733 40.517 29.813 1.00 20.88 N -ATOM 511 CA ASN A 81 59.400 41.570 30.751 1.00 20.77 C -ATOM 512 C ASN A 81 60.699 42.125 31.344 1.00 18.80 C -ATOM 513 O ASN A 81 60.704 43.163 31.979 1.00 19.83 O -ATOM 514 CB ASN A 81 58.474 40.983 31.844 1.00 19.80 C -ATOM 515 CG ASN A 81 57.062 40.605 31.402 1.00 20.20 C -ATOM 516 OD1 ASN A 81 56.685 39.438 31.377 1.00 20.33 O -ATOM 517 ND2 ASN A 81 56.187 41.530 31.047 1.00 19.34 N -ATOM 518 N GLY A 82 61.862 41.502 31.165 1.00 18.50 N -ATOM 519 CA GLY A 82 63.105 41.965 31.737 1.00 17.86 C -ATOM 520 C GLY A 82 63.188 41.609 33.213 1.00 19.09 C -ATOM 521 O GLY A 82 64.088 42.084 33.890 1.00 20.72 O -ATOM 522 N THR A 83 62.286 40.781 33.764 1.00 19.40 N -ATOM 523 CA THR A 83 62.275 40.417 35.187 1.00 19.01 C -ATOM 524 C THR A 83 62.283 38.924 35.505 1.00 18.98 C -ATOM 525 O THR A 83 62.373 38.506 36.664 1.00 19.69 O -ATOM 526 CB THR A 83 61.045 41.054 35.821 1.00 16.10 C -ATOM 527 OG1 THR A 83 59.922 40.569 35.104 1.00 14.11 O -ATOM 528 CG2 THR A 83 61.070 42.588 35.751 1.00 16.91 C -ATOM 529 N GLU A 84 62.245 38.082 34.466 1.00 17.88 N -ATOM 530 CA GLU A 84 62.045 36.648 34.637 1.00 14.65 C -ATOM 531 C GLU A 84 63.292 35.900 35.014 1.00 13.47 C -ATOM 532 O GLU A 84 64.387 36.258 34.588 1.00 13.80 O -ATOM 533 CB GLU A 84 61.499 35.997 33.363 1.00 12.10 C -ATOM 534 CG GLU A 84 60.237 36.570 32.736 1.00 14.64 C -ATOM 535 CD GLU A 84 60.445 37.752 31.775 1.00 16.56 C -ATOM 536 OE1 GLU A 84 61.402 38.528 31.859 1.00 15.47 O -ATOM 537 OE2 GLU A 84 59.621 37.917 30.905 1.00 16.61 O -ATOM 538 N GLN A 85 63.147 34.915 35.913 1.00 12.34 N -ATOM 539 CA GLN A 85 64.221 33.966 36.198 1.00 12.18 C -ATOM 540 C GLN A 85 63.605 32.598 35.922 1.00 13.70 C -ATOM 541 O GLN A 85 62.467 32.345 36.316 1.00 13.20 O -ATOM 542 CB GLN A 85 64.674 34.008 37.637 1.00 14.90 C -ATOM 543 CG GLN A 85 65.380 35.285 38.054 1.00 17.26 C -ATOM 544 CD GLN A 85 65.518 35.351 39.570 1.00 20.93 C -ATOM 545 OE1 GLN A 85 66.202 34.524 40.171 1.00 22.56 O -ATOM 546 NE2 GLN A 85 64.883 36.312 40.242 1.00 20.29 N -ATOM 547 N TYR A 86 64.354 31.744 35.217 1.00 14.34 N -ATOM 548 CA TYR A 86 63.891 30.436 34.741 1.00 16.35 C -ATOM 549 C TYR A 86 64.717 29.364 35.424 1.00 16.89 C -ATOM 550 O TYR A 86 65.946 29.361 35.275 1.00 18.78 O -ATOM 551 CB TYR A 86 64.096 30.294 33.259 1.00 16.32 C -ATOM 552 CG TYR A 86 63.416 31.357 32.429 1.00 19.72 C -ATOM 553 CD1 TYR A 86 62.099 31.182 32.060 1.00 18.48 C -ATOM 554 CD2 TYR A 86 64.098 32.516 32.052 1.00 20.37 C -ATOM 555 CE1 TYR A 86 61.448 32.162 31.315 1.00 20.31 C -ATOM 556 CE2 TYR A 86 63.451 33.499 31.301 1.00 19.67 C -ATOM 557 CZ TYR A 86 62.128 33.308 30.944 1.00 20.73 C -ATOM 558 OH TYR A 86 61.442 34.288 30.249 1.00 27.36 O -ATOM 559 N VAL A 87 64.095 28.450 36.183 1.00 15.67 N -ATOM 560 CA VAL A 87 64.884 27.451 36.906 1.00 15.58 C -ATOM 561 C VAL A 87 64.223 26.079 36.822 1.00 14.33 C -ATOM 562 O VAL A 87 63.008 25.999 36.714 1.00 12.05 O -ATOM 563 CB VAL A 87 65.089 27.968 38.386 1.00 15.09 C -ATOM 564 CG1 VAL A 87 63.770 28.218 39.073 1.00 17.81 C -ATOM 565 CG2 VAL A 87 65.878 26.938 39.180 1.00 14.82 C -ATOM 566 N GLY A 88 65.029 25.001 36.778 1.00 15.60 N -ATOM 567 CA GLY A 88 64.545 23.626 36.675 1.00 15.91 C -ATOM 568 C GLY A 88 64.036 23.095 38.002 1.00 15.26 C -ATOM 569 O GLY A 88 64.387 23.586 39.078 1.00 13.64 O -ATOM 570 N VAL A 89 63.131 22.124 37.918 1.00 14.94 N -ATOM 571 CA VAL A 89 62.621 21.446 39.101 1.00 16.34 C -ATOM 572 C VAL A 89 63.521 20.237 39.296 1.00 19.56 C -ATOM 573 O VAL A 89 63.700 19.406 38.406 1.00 21.89 O -ATOM 574 CB VAL A 89 61.175 21.005 38.884 1.00 11.51 C -ATOM 575 CG1 VAL A 89 60.647 20.192 40.048 1.00 13.75 C -ATOM 576 CG2 VAL A 89 60.328 22.252 38.793 1.00 9.94 C -ATOM 577 N GLN A 90 64.189 20.204 40.429 1.00 20.26 N -ATOM 578 CA GLN A 90 65.034 19.096 40.765 1.00 22.28 C -ATOM 579 C GLN A 90 64.294 17.969 41.535 1.00 24.14 C -ATOM 580 O GLN A 90 64.680 16.807 41.382 1.00 25.96 O -ATOM 581 CB GLN A 90 66.142 19.683 41.550 1.00 23.58 C -ATOM 582 CG GLN A 90 67.113 18.705 42.144 1.00 30.44 C -ATOM 583 CD GLN A 90 68.064 19.491 43.008 1.00 33.80 C -ATOM 584 OE1 GLN A 90 67.753 19.879 44.134 1.00 36.82 O -ATOM 585 NE2 GLN A 90 69.237 19.779 42.454 1.00 36.91 N -ATOM 586 N LYS A 91 63.262 18.187 42.371 1.00 20.69 N -ATOM 587 CA LYS A 91 62.648 17.102 43.128 1.00 18.40 C -ATOM 588 C LYS A 91 61.197 17.458 43.376 1.00 17.81 C -ATOM 589 O LYS A 91 60.920 18.610 43.681 1.00 17.02 O -ATOM 590 CB LYS A 91 63.404 16.948 44.427 1.00 20.25 C -ATOM 591 CG LYS A 91 62.840 15.904 45.357 1.00 26.29 C -ATOM 592 CD LYS A 91 63.591 15.895 46.677 1.00 29.77 C -ATOM 593 CE LYS A 91 63.339 14.527 47.326 1.00 32.95 C -ATOM 594 NZ LYS A 91 64.038 13.442 46.641 1.00 36.98 N -ATOM 595 N ILE A 92 60.266 16.514 43.214 1.00 14.26 N -ATOM 596 CA ILE A 92 58.838 16.726 43.403 1.00 16.37 C -ATOM 597 C ILE A 92 58.401 15.863 44.592 1.00 16.51 C -ATOM 598 O ILE A 92 58.598 14.641 44.563 1.00 17.95 O -ATOM 599 CB ILE A 92 58.097 16.311 42.112 1.00 15.64 C -ATOM 600 CG1 ILE A 92 58.510 17.276 40.968 1.00 16.74 C -ATOM 601 CG2 ILE A 92 56.580 16.304 42.348 1.00 14.98 C -ATOM 602 CD1 ILE A 92 57.997 16.971 39.532 1.00 20.78 C -ATOM 603 N VAL A 93 57.797 16.491 45.617 1.00 13.52 N -ATOM 604 CA VAL A 93 57.362 15.804 46.824 1.00 12.48 C -ATOM 605 C VAL A 93 55.886 16.028 46.841 1.00 12.62 C -ATOM 606 O VAL A 93 55.421 17.117 47.128 1.00 14.90 O -ATOM 607 CB VAL A 93 58.034 16.409 48.107 1.00 8.83 C -ATOM 608 CG1 VAL A 93 57.629 15.621 49.341 1.00 9.55 C -ATOM 609 CG2 VAL A 93 59.555 16.361 47.987 1.00 10.27 C -ATOM 610 N VAL A 94 55.103 15.022 46.489 1.00 12.74 N -ATOM 611 CA VAL A 94 53.657 15.132 46.518 1.00 13.20 C -ATOM 612 C VAL A 94 53.193 14.687 47.910 1.00 14.69 C -ATOM 613 O VAL A 94 53.896 13.885 48.542 1.00 12.47 O -ATOM 614 CB VAL A 94 53.061 14.222 45.373 1.00 16.43 C -ATOM 615 CG1 VAL A 94 51.556 14.174 45.405 1.00 15.01 C -ATOM 616 CG2 VAL A 94 53.417 14.836 44.013 1.00 15.46 C -ATOM 617 N HIS A 95 52.081 15.208 48.467 1.00 12.87 N -ATOM 618 CA HIS A 95 51.562 14.729 49.747 1.00 14.54 C -ATOM 619 C HIS A 95 51.364 13.200 49.686 1.00 15.11 C -ATOM 620 O HIS A 95 50.773 12.732 48.701 1.00 13.56 O -ATOM 621 CB HIS A 95 50.230 15.412 50.049 1.00 13.95 C -ATOM 622 CG HIS A 95 49.864 15.175 51.497 1.00 16.11 C -ATOM 623 ND1 HIS A 95 49.373 14.062 52.040 1.00 14.83 N -ATOM 624 CD2 HIS A 95 50.077 16.080 52.510 1.00 16.56 C -ATOM 625 CE1 HIS A 95 49.288 14.251 53.348 1.00 16.92 C -ATOM 626 NE2 HIS A 95 49.711 15.458 53.612 1.00 17.35 N -ATOM 627 N PRO A 96 51.849 12.377 50.656 1.00 15.94 N -ATOM 628 CA PRO A 96 51.682 10.906 50.715 1.00 16.06 C -ATOM 629 C PRO A 96 50.288 10.339 50.474 1.00 15.65 C -ATOM 630 O PRO A 96 50.147 9.247 49.935 1.00 17.84 O -ATOM 631 CB PRO A 96 52.206 10.520 52.097 1.00 16.71 C -ATOM 632 CG PRO A 96 53.231 11.588 52.459 1.00 16.31 C -ATOM 633 CD PRO A 96 52.671 12.844 51.797 1.00 16.37 C -ATOM 634 N TYR A 97 49.246 11.060 50.904 1.00 12.74 N -ATOM 635 CA TYR A 97 47.875 10.656 50.747 1.00 12.92 C -ATOM 636 C TYR A 97 47.122 11.114 49.509 1.00 14.08 C -ATOM 637 O TYR A 97 45.918 10.844 49.445 1.00 12.62 O -ATOM 638 CB TYR A 97 47.086 11.125 51.937 1.00 19.96 C -ATOM 639 CG TYR A 97 47.419 10.449 53.244 1.00 24.42 C -ATOM 640 CD1 TYR A 97 47.972 9.169 53.262 1.00 29.05 C -ATOM 641 CD2 TYR A 97 47.116 11.098 54.441 1.00 28.57 C -ATOM 642 CE1 TYR A 97 48.214 8.515 54.478 1.00 30.89 C -ATOM 643 CE2 TYR A 97 47.357 10.458 55.662 1.00 31.11 C -ATOM 644 CZ TYR A 97 47.899 9.168 55.673 1.00 31.62 C -ATOM 645 OH TYR A 97 48.088 8.514 56.878 1.00 33.38 O -ATOM 646 N TRP A 98 47.783 11.833 48.568 1.00 13.04 N -ATOM 647 CA TRP A 98 47.155 12.347 47.348 1.00 12.00 C -ATOM 648 C TRP A 98 46.665 11.184 46.522 1.00 12.60 C -ATOM 649 O TRP A 98 47.422 10.250 46.298 1.00 13.84 O -ATOM 650 CB TRP A 98 48.157 13.169 46.445 1.00 10.27 C -ATOM 651 CG TRP A 98 47.633 13.510 45.018 1.00 9.10 C -ATOM 652 CD1 TRP A 98 48.301 13.079 43.898 1.00 9.83 C -ATOM 653 CD2 TRP A 98 46.490 14.212 44.682 1.00 8.83 C -ATOM 654 NE1 TRP A 98 47.583 13.495 42.864 1.00 7.05 N -ATOM 655 CE2 TRP A 98 46.512 14.161 43.285 1.00 8.87 C -ATOM 656 CE3 TRP A 98 45.436 14.874 45.319 1.00 9.49 C -ATOM 657 CZ2 TRP A 98 45.512 14.741 42.521 1.00 10.25 C -ATOM 658 CZ3 TRP A 98 44.425 15.458 44.549 1.00 12.16 C -ATOM 659 CH2 TRP A 98 44.462 15.398 43.155 1.00 11.86 C -ATOM 660 N ASN A 99 45.457 11.209 46.028 1.00 14.58 N -ATOM 661 CA ASN A 99 45.017 10.129 45.157 1.00 16.39 C -ATOM 662 C ASN A 99 44.429 10.790 43.941 1.00 14.46 C -ATOM 663 O ASN A 99 43.391 11.435 44.072 1.00 14.41 O -ATOM 664 CB ASN A 99 43.966 9.302 45.883 1.00 18.94 C -ATOM 665 CG ASN A 99 43.326 8.185 45.093 1.00 20.89 C -ATOM 666 OD1 ASN A 99 43.688 7.903 43.951 1.00 24.09 O -ATOM 667 ND2 ASN A 99 42.336 7.557 45.732 1.00 24.14 N -ATOM 668 N THR A 100 45.076 10.624 42.786 1.00 15.80 N -ATOM 669 CA THR A 100 44.608 11.181 41.502 1.00 18.40 C -ATOM 670 C THR A 100 43.146 10.900 41.123 1.00 19.39 C -ATOM 671 O THR A 100 42.462 11.748 40.532 1.00 20.77 O -ATOM 672 CB THR A 100 45.432 10.654 40.351 1.00 19.59 C -ATOM 673 OG1 THR A 100 46.784 10.591 40.746 1.00 26.80 O -ATOM 674 CG2 THR A 100 45.218 11.522 39.143 1.00 22.76 C -ATOM 675 N ASP A 101 42.670 9.693 41.471 1.00 20.22 N -ATOM 676 CA ASP A 101 41.285 9.239 41.235 1.00 22.75 C -ATOM 677 C ASP A 101 40.234 9.804 42.210 1.00 25.03 C -ATOM 678 O ASP A 101 39.035 9.498 42.075 1.00 23.02 O -ATOM 679 CB ASP A 101 41.132 7.708 41.349 1.00 24.56 C -ATOM 680 CG ASP A 101 42.027 6.808 40.511 1.00 28.77 C -ATOM 681 OD1 ASP A 101 42.446 7.214 39.420 1.00 29.77 O -ATOM 682 OD2 ASP A 101 42.279 5.687 40.975 1.00 31.95 O -ATOM 683 N ASP A 102 40.685 10.572 43.235 1.00 23.36 N -ATOM 684 CA ASP A 102 39.788 11.180 44.201 1.00 22.91 C -ATOM 685 C ASP A 102 40.272 12.575 44.630 1.00 22.59 C -ATOM 686 O ASP A 102 40.711 12.725 45.774 1.00 21.87 O -ATOM 687 CB ASP A 102 39.715 10.218 45.352 1.00 22.88 C -ATOM 688 CG ASP A 102 38.567 10.408 46.325 1.00 26.98 C -ATOM 689 OD1 ASP A 102 37.798 11.372 46.219 1.00 22.46 O -ATOM 690 OD2 ASP A 102 38.468 9.544 47.203 1.00 28.88 O -ATOM 691 N VAL A 103 40.207 13.631 43.770 1.00 20.22 N -ATOM 692 CA VAL A 103 40.590 14.990 44.190 1.00 18.18 C -ATOM 693 C VAL A 103 39.676 15.478 45.338 1.00 15.07 C -ATOM 694 O VAL A 103 40.099 16.273 46.166 1.00 14.46 O -ATOM 695 CB VAL A 103 40.533 15.972 42.915 1.00 19.44 C -ATOM 696 CG1 VAL A 103 39.125 16.374 42.552 1.00 19.05 C -ATOM 697 CG2 VAL A 103 41.252 17.269 43.206 1.00 17.32 C -ATOM 698 N ALA A 104 38.442 14.967 45.449 1.00 12.49 N -ATOM 699 CA ALA A 104 37.510 15.367 46.482 1.00 13.00 C -ATOM 700 C ALA A 104 37.913 14.831 47.846 1.00 11.56 C -ATOM 701 O ALA A 104 37.409 15.291 48.867 1.00 11.63 O -ATOM 702 CB ALA A 104 36.125 14.865 46.138 1.00 13.61 C -ATOM 703 N ALA A 105 38.850 13.880 47.903 1.00 12.38 N -ATOM 704 CA ALA A 105 39.424 13.466 49.171 1.00 12.37 C -ATOM 705 C ALA A 105 40.428 14.478 49.778 1.00 12.90 C -ATOM 706 O ALA A 105 40.738 14.402 50.975 1.00 13.39 O -ATOM 707 CB ALA A 105 40.153 12.138 48.997 1.00 12.90 C -ATOM 708 N GLY A 106 40.932 15.450 49.004 1.00 11.80 N -ATOM 709 CA GLY A 106 41.878 16.431 49.511 1.00 11.28 C -ATOM 710 C GLY A 106 43.291 16.009 49.180 1.00 10.14 C -ATOM 711 O GLY A 106 43.517 15.221 48.264 1.00 10.55 O -ATOM 712 N TYR A 107 44.221 16.539 49.991 1.00 6.45 N -ATOM 713 CA TYR A 107 45.660 16.363 49.895 1.00 7.59 C -ATOM 714 C TYR A 107 46.191 16.831 48.550 1.00 5.93 C -ATOM 715 O TYR A 107 47.220 16.349 48.084 1.00 8.21 O -ATOM 716 CB TYR A 107 46.098 14.873 50.119 1.00 10.07 C -ATOM 717 CG TYR A 107 45.495 14.301 51.410 1.00 14.76 C -ATOM 718 CD1 TYR A 107 45.975 14.689 52.667 1.00 14.99 C -ATOM 719 CD2 TYR A 107 44.403 13.430 51.318 1.00 16.34 C -ATOM 720 CE1 TYR A 107 45.347 14.211 53.819 1.00 19.58 C -ATOM 721 CE2 TYR A 107 43.772 12.941 52.449 1.00 16.99 C -ATOM 722 CZ TYR A 107 44.250 13.342 53.691 1.00 21.33 C -ATOM 723 OH TYR A 107 43.601 12.881 54.828 1.00 28.40 O -ATOM 724 N ASP A 108 45.542 17.824 47.956 1.00 6.59 N -ATOM 725 CA ASP A 108 46.017 18.293 46.666 1.00 6.83 C -ATOM 726 C ASP A 108 47.061 19.380 46.853 1.00 7.13 C -ATOM 727 O ASP A 108 46.795 20.575 46.695 1.00 7.22 O -ATOM 728 CB ASP A 108 44.835 18.832 45.808 1.00 5.74 C -ATOM 729 CG ASP A 108 45.130 18.984 44.297 1.00 7.46 C -ATOM 730 OD1 ASP A 108 46.207 18.606 43.862 1.00 6.32 O -ATOM 731 OD2 ASP A 108 44.261 19.453 43.571 1.00 7.77 O -ATOM 732 N ILE A 109 48.278 18.894 47.151 1.00 6.43 N -ATOM 733 CA ILE A 109 49.434 19.753 47.427 1.00 7.64 C -ATOM 734 C ILE A 109 50.714 18.997 47.168 1.00 7.56 C -ATOM 735 O ILE A 109 50.848 17.790 47.384 1.00 9.28 O -ATOM 736 CB ILE A 109 49.313 20.299 48.927 1.00 8.14 C -ATOM 737 CG1 ILE A 109 50.424 21.328 49.224 1.00 8.97 C -ATOM 738 CG2 ILE A 109 49.366 19.129 49.951 1.00 6.47 C -ATOM 739 CD1 ILE A 109 50.035 22.216 50.449 1.00 10.00 C -ATOM 740 N ALA A 110 51.673 19.768 46.661 1.00 7.57 N -ATOM 741 CA ALA A 110 52.975 19.254 46.297 1.00 8.22 C -ATOM 742 C ALA A 110 54.005 20.354 46.456 1.00 9.78 C -ATOM 743 O ALA A 110 53.710 21.540 46.305 1.00 10.61 O -ATOM 744 CB ALA A 110 52.957 18.783 44.842 1.00 7.05 C -ATOM 745 N LEU A 111 55.214 19.961 46.827 1.00 8.38 N -ATOM 746 CA LEU A 111 56.315 20.876 46.979 1.00 11.26 C -ATOM 747 C LEU A 111 57.401 20.545 45.961 1.00 11.28 C -ATOM 748 O LEU A 111 57.808 19.398 45.844 1.00 11.78 O -ATOM 749 CB LEU A 111 56.900 20.778 48.401 1.00 11.52 C -ATOM 750 CG LEU A 111 55.944 21.119 49.543 1.00 14.90 C -ATOM 751 CD1 LEU A 111 56.650 20.874 50.874 1.00 16.48 C -ATOM 752 CD2 LEU A 111 55.506 22.572 49.439 1.00 13.34 C -ATOM 753 N LEU A 112 57.916 21.532 45.234 1.00 12.10 N -ATOM 754 CA LEU A 112 58.928 21.349 44.211 1.00 11.77 C -ATOM 755 C LEU A 112 60.230 21.991 44.671 1.00 13.64 C -ATOM 756 O LEU A 112 60.290 23.170 45.037 1.00 10.84 O -ATOM 757 CB LEU A 112 58.482 22.015 42.905 1.00 12.17 C -ATOM 758 CG LEU A 112 57.063 21.837 42.415 1.00 15.40 C -ATOM 759 CD1 LEU A 112 56.876 22.538 41.085 1.00 15.49 C -ATOM 760 CD2 LEU A 112 56.775 20.368 42.294 1.00 15.15 C -ATOM 761 N ARG A 113 61.283 21.186 44.757 1.00 13.46 N -ATOM 762 CA ARG A 113 62.589 21.715 45.050 1.00 15.28 C -ATOM 763 C ARG A 113 63.244 22.124 43.733 1.00 16.51 C -ATOM 764 O ARG A 113 63.374 21.346 42.790 1.00 15.93 O -ATOM 765 CB ARG A 113 63.388 20.649 45.748 1.00 19.45 C -ATOM 766 CG ARG A 113 64.692 21.189 46.234 1.00 24.78 C -ATOM 767 CD ARG A 113 65.510 19.963 46.464 1.00 35.00 C -ATOM 768 NE ARG A 113 66.833 20.308 46.929 1.00 44.46 N -ATOM 769 CZ ARG A 113 67.054 20.648 48.211 1.00 50.93 C -ATOM 770 NH1 ARG A 113 66.056 20.699 49.111 1.00 53.94 N -ATOM 771 NH2 ARG A 113 68.294 20.957 48.614 1.00 52.42 N -ATOM 772 N LEU A 114 63.656 23.382 43.675 1.00 14.59 N -ATOM 773 CA LEU A 114 64.286 23.948 42.517 1.00 12.96 C -ATOM 774 C LEU A 114 65.750 23.621 42.431 1.00 14.45 C -ATOM 775 O LEU A 114 66.429 23.426 43.427 1.00 15.35 O -ATOM 776 CB LEU A 114 64.085 25.448 42.528 1.00 14.52 C -ATOM 777 CG LEU A 114 62.643 25.929 42.734 1.00 13.04 C -ATOM 778 CD1 LEU A 114 62.618 27.433 42.664 1.00 13.89 C -ATOM 779 CD2 LEU A 114 61.727 25.354 41.681 1.00 15.27 C -ATOM 780 N ALA A 115 66.225 23.591 41.180 1.00 15.90 N -ATOM 781 CA ALA A 115 67.574 23.190 40.869 1.00 16.86 C -ATOM 782 C ALA A 115 68.522 24.228 41.395 1.00 19.93 C -ATOM 783 O ALA A 115 69.664 23.887 41.715 1.00 22.92 O -ATOM 784 CB ALA A 115 67.763 23.068 39.383 1.00 14.10 C -ATOM 785 N GLN A 116 68.097 25.490 41.479 1.00 21.12 N -ATOM 786 CA GLN A 116 68.882 26.472 42.201 1.00 24.08 C -ATOM 787 C GLN A 116 68.024 27.514 42.898 1.00 20.84 C -ATOM 788 O GLN A 116 66.823 27.610 42.679 1.00 18.27 O -ATOM 789 CB GLN A 116 69.904 27.171 41.267 1.00 30.47 C -ATOM 790 CG GLN A 116 69.588 28.237 40.206 1.00 40.70 C -ATOM 791 CD GLN A 116 70.645 29.381 40.178 1.00 48.56 C -ATOM 792 OE1 GLN A 116 71.846 29.204 40.474 1.00 51.81 O -ATOM 793 NE2 GLN A 116 70.236 30.621 39.855 1.00 50.77 N -ATOM 794 N SER A 117 68.648 28.236 43.834 1.00 20.21 N -ATOM 795 CA SER A 117 67.993 29.326 44.525 1.00 22.03 C -ATOM 796 C SER A 117 67.726 30.546 43.645 1.00 20.51 C -ATOM 797 O SER A 117 68.607 30.978 42.906 1.00 21.61 O -ATOM 798 CB SER A 117 68.848 29.713 45.693 1.00 23.40 C -ATOM 799 OG SER A 117 68.736 28.667 46.645 1.00 29.17 O -ATOM 800 N VAL A 118 66.505 31.076 43.634 1.00 18.92 N -ATOM 801 CA VAL A 118 66.219 32.272 42.862 1.00 17.04 C -ATOM 802 C VAL A 118 66.682 33.466 43.689 1.00 18.16 C -ATOM 803 O VAL A 118 66.958 33.359 44.893 1.00 18.57 O -ATOM 804 CB VAL A 118 64.691 32.408 42.520 1.00 15.99 C -ATOM 805 CG1 VAL A 118 64.306 31.212 41.662 1.00 13.34 C -ATOM 806 CG2 VAL A 118 63.798 32.454 43.740 1.00 14.89 C -ATOM 807 N THR A 119 66.874 34.578 42.987 1.00 17.98 N -ATOM 808 CA THR A 119 67.293 35.837 43.544 1.00 18.88 C -ATOM 809 C THR A 119 66.071 36.651 43.921 1.00 18.24 C -ATOM 810 O THR A 119 65.197 36.845 43.074 1.00 19.28 O -ATOM 811 CB THR A 119 68.136 36.574 42.489 1.00 22.39 C -ATOM 812 OG1 THR A 119 69.324 35.787 42.316 1.00 24.41 O -ATOM 813 CG2 THR A 119 68.409 38.046 42.866 1.00 23.47 C -ATOM 814 N LEU A 120 65.997 37.164 45.156 1.00 17.66 N -ATOM 815 CA LEU A 120 64.844 37.945 45.535 1.00 17.16 C -ATOM 816 C LEU A 120 65.043 39.410 45.223 1.00 17.89 C -ATOM 817 O LEU A 120 66.140 39.954 45.375 1.00 21.02 O -ATOM 818 CB LEU A 120 64.553 37.758 47.023 1.00 17.06 C -ATOM 819 CG LEU A 120 64.308 36.343 47.568 1.00 19.10 C -ATOM 820 CD1 LEU A 120 63.883 36.470 49.023 1.00 18.54 C -ATOM 821 CD2 LEU A 120 63.208 35.620 46.823 1.00 18.38 C -ATOM 822 N ASN A 121 63.967 40.037 44.751 1.00 17.23 N -ATOM 823 CA ASN A 121 63.949 41.455 44.410 1.00 18.56 C -ATOM 824 C ASN A 121 62.526 41.982 44.418 1.00 18.33 C -ATOM 825 O ASN A 121 61.669 41.268 44.947 1.00 19.10 O -ATOM 826 CB ASN A 121 64.608 41.669 43.030 1.00 18.33 C -ATOM 827 CG ASN A 121 64.039 40.875 41.875 1.00 18.25 C -ATOM 828 OD1 ASN A 121 62.827 40.853 41.666 1.00 19.36 O -ATOM 829 ND2 ASN A 121 64.922 40.227 41.111 1.00 18.49 N -ATOM 830 N SER A 122 62.109 43.135 43.864 1.00 20.06 N -ATOM 831 CA SER A 122 60.701 43.535 44.000 1.00 21.56 C -ATOM 832 C SER A 122 59.689 42.720 43.200 1.00 21.71 C -ATOM 833 O SER A 122 58.476 42.816 43.410 1.00 23.08 O -ATOM 834 CB SER A 122 60.540 44.987 43.627 1.00 25.51 C -ATOM 835 OG SER A 122 61.304 45.281 42.466 1.00 35.65 O -ATOM 836 N TYR A 123 60.216 41.903 42.277 1.00 19.93 N -ATOM 837 CA TYR A 123 59.418 41.039 41.431 1.00 17.77 C -ATOM 838 C TYR A 123 59.332 39.622 41.935 1.00 15.04 C -ATOM 839 O TYR A 123 58.436 38.902 41.513 1.00 14.16 O -ATOM 840 CB TYR A 123 60.006 40.982 40.052 1.00 19.11 C -ATOM 841 CG TYR A 123 60.098 42.388 39.530 1.00 21.65 C -ATOM 842 CD1 TYR A 123 58.899 43.020 39.158 1.00 25.24 C -ATOM 843 CD2 TYR A 123 61.335 43.032 39.445 1.00 21.72 C -ATOM 844 CE1 TYR A 123 58.945 44.334 38.689 1.00 25.01 C -ATOM 845 CE2 TYR A 123 61.380 44.348 38.971 1.00 22.05 C -ATOM 846 CZ TYR A 123 60.184 44.980 38.603 1.00 24.94 C -ATOM 847 OH TYR A 123 60.168 46.280 38.139 1.00 26.91 O -ATOM 848 N VAL A 124 60.314 39.232 42.751 1.00 14.56 N -ATOM 849 CA VAL A 124 60.462 37.886 43.301 1.00 15.79 C -ATOM 850 C VAL A 124 60.566 37.920 44.837 1.00 13.33 C -ATOM 851 O VAL A 124 61.586 38.272 45.424 1.00 13.49 O -ATOM 852 CB VAL A 124 61.736 37.207 42.666 1.00 14.02 C -ATOM 853 CG1 VAL A 124 61.857 35.756 43.122 1.00 14.00 C -ATOM 854 CG2 VAL A 124 61.628 37.221 41.137 1.00 12.98 C -ATOM 855 N GLN A 125 59.480 37.525 45.504 1.00 15.12 N -ATOM 856 CA GLN A 125 59.396 37.532 46.964 1.00 14.25 C -ATOM 857 C GLN A 125 58.761 36.258 47.480 1.00 14.18 C -ATOM 858 O GLN A 125 57.963 35.658 46.781 1.00 12.99 O -ATOM 859 CB GLN A 125 58.540 38.710 47.464 1.00 16.30 C -ATOM 860 CG GLN A 125 59.202 40.063 47.285 1.00 22.28 C -ATOM 861 CD GLN A 125 60.382 40.270 48.215 1.00 27.01 C -ATOM 862 OE1 GLN A 125 60.210 40.216 49.432 1.00 32.30 O -ATOM 863 NE2 GLN A 125 61.614 40.482 47.752 1.00 30.01 N -ATOM 864 N LEU A 126 59.072 35.839 48.699 1.00 12.49 N -ATOM 865 CA LEU A 126 58.465 34.650 49.243 1.00 13.35 C -ATOM 866 C LEU A 126 57.043 34.954 49.700 1.00 12.59 C -ATOM 867 O LEU A 126 56.705 36.045 50.161 1.00 11.18 O -ATOM 868 CB LEU A 126 59.297 34.118 50.426 1.00 12.23 C -ATOM 869 CG LEU A 126 60.799 33.912 50.317 1.00 13.20 C -ATOM 870 CD1 LEU A 126 61.319 33.196 51.553 1.00 14.55 C -ATOM 871 CD2 LEU A 126 61.109 33.120 49.080 1.00 15.07 C -ATOM 872 N GLY A 127 56.200 33.941 49.540 1.00 11.33 N -ATOM 873 CA GLY A 127 54.836 33.975 49.957 1.00 11.54 C -ATOM 874 C GLY A 127 54.753 33.786 51.454 1.00 13.23 C -ATOM 875 O GLY A 127 55.547 33.052 52.038 1.00 14.89 O -ATOM 876 N VAL A 128 53.807 34.474 52.086 1.00 12.47 N -ATOM 877 CA VAL A 128 53.651 34.406 53.529 1.00 12.66 C -ATOM 878 C VAL A 128 52.649 33.269 53.788 1.00 10.38 C -ATOM 879 O VAL A 128 51.526 33.321 53.297 1.00 12.45 O -ATOM 880 CB VAL A 128 53.125 35.792 54.025 1.00 12.62 C -ATOM 881 CG1 VAL A 128 52.798 35.658 55.512 1.00 16.46 C -ATOM 882 CG2 VAL A 128 54.153 36.918 53.813 1.00 12.26 C -ATOM 883 N LEU A 129 53.000 32.231 54.574 1.00 12.38 N -ATOM 884 CA LEU A 129 52.053 31.181 54.933 1.00 12.53 C -ATOM 885 C LEU A 129 51.234 31.506 56.197 1.00 14.42 C -ATOM 886 O LEU A 129 51.762 32.177 57.100 1.00 14.93 O -ATOM 887 CB LEU A 129 52.850 29.870 55.106 1.00 13.25 C -ATOM 888 CG LEU A 129 53.533 29.362 53.833 1.00 14.57 C -ATOM 889 CD1 LEU A 129 54.094 28.008 54.108 1.00 16.71 C -ATOM 890 CD2 LEU A 129 52.563 29.223 52.681 1.00 14.81 C -ATOM 891 N PRO A 130 49.960 31.099 56.339 1.00 12.78 N -ATOM 892 CA PRO A 130 49.205 31.212 57.581 1.00 14.50 C -ATOM 893 C PRO A 130 49.726 30.305 58.703 1.00 14.51 C -ATOM 894 O PRO A 130 50.451 29.329 58.494 1.00 13.22 O -ATOM 895 CB PRO A 130 47.772 30.904 57.177 1.00 12.12 C -ATOM 896 CG PRO A 130 47.960 29.939 56.033 1.00 13.92 C -ATOM 897 CD PRO A 130 49.144 30.506 55.289 1.00 13.35 C -ATOM 898 N ARG A 131 49.411 30.670 59.949 1.00 16.06 N -ATOM 899 CA ARG A 131 49.723 29.766 61.050 1.00 17.91 C -ATOM 900 C ARG A 131 48.784 28.578 60.973 1.00 13.67 C -ATOM 901 O ARG A 131 47.649 28.714 60.483 1.00 12.92 O -ATOM 902 CB ARG A 131 49.560 30.491 62.409 1.00 25.93 C -ATOM 903 CG ARG A 131 50.680 31.554 62.612 1.00 39.42 C -ATOM 904 CD ARG A 131 52.152 31.030 62.666 1.00 50.12 C -ATOM 905 NE ARG A 131 53.162 32.110 62.659 1.00 60.31 N -ATOM 906 CZ ARG A 131 54.278 32.132 63.441 1.00 65.68 C -ATOM 907 NH1 ARG A 131 54.577 31.147 64.316 1.00 66.88 N -ATOM 908 NH2 ARG A 131 55.123 33.181 63.366 1.00 68.80 N -ATOM 909 N ALA A 132 49.280 27.411 61.418 1.00 14.22 N -ATOM 910 CA ALA A 132 48.519 26.156 61.393 1.00 14.01 C -ATOM 911 C ALA A 132 47.173 26.231 62.081 1.00 15.78 C -ATOM 912 O ALA A 132 47.078 26.816 63.162 1.00 14.01 O -ATOM 913 CB ALA A 132 49.287 25.045 62.070 1.00 16.06 C -ATOM 914 N GLY A 133 46.109 25.699 61.454 1.00 12.42 N -ATOM 915 CA GLY A 133 44.789 25.646 62.036 1.00 11.40 C -ATOM 916 C GLY A 133 43.905 26.836 61.751 1.00 11.68 C -ATOM 917 O GLY A 133 42.712 26.772 62.027 1.00 12.16 O -ATOM 918 N THR A 134 44.469 27.938 61.230 1.00 12.27 N -ATOM 919 CA THR A 134 43.715 29.150 60.918 1.00 12.85 C -ATOM 920 C THR A 134 42.583 28.894 59.957 1.00 11.47 C -ATOM 921 O THR A 134 42.803 28.385 58.867 1.00 11.69 O -ATOM 922 CB THR A 134 44.648 30.227 60.295 1.00 13.66 C -ATOM 923 OG1 THR A 134 45.687 30.503 61.219 1.00 17.97 O -ATOM 924 CG2 THR A 134 43.926 31.533 60.032 1.00 17.08 C -ATOM 925 N ILE A 135 41.384 29.252 60.348 1.00 9.47 N -ATOM 926 CA ILE A 135 40.189 29.186 59.540 1.00 10.97 C -ATOM 927 C ILE A 135 39.715 30.642 59.371 1.00 14.31 C -ATOM 928 O ILE A 135 39.593 31.399 60.338 1.00 14.95 O -ATOM 929 CB ILE A 135 39.094 28.352 60.262 1.00 11.95 C -ATOM 930 CG1 ILE A 135 39.633 26.968 60.584 1.00 14.79 C -ATOM 931 CG2 ILE A 135 37.824 28.320 59.428 1.00 14.04 C -ATOM 932 CD1 ILE A 135 39.932 26.005 59.446 1.00 18.18 C -ATOM 933 N LEU A 136 39.430 31.092 58.150 1.00 15.33 N -ATOM 934 CA LEU A 136 38.900 32.423 57.908 1.00 15.29 C -ATOM 935 C LEU A 136 37.394 32.465 58.111 1.00 16.06 C -ATOM 936 O LEU A 136 36.653 31.499 57.870 1.00 15.28 O -ATOM 937 CB LEU A 136 39.216 32.880 56.461 1.00 16.04 C -ATOM 938 CG LEU A 136 40.704 32.930 56.113 1.00 18.11 C -ATOM 939 CD1 LEU A 136 40.897 33.096 54.617 1.00 21.51 C -ATOM 940 CD2 LEU A 136 41.353 34.040 56.921 1.00 19.80 C -ATOM 941 N ALA A 137 36.917 33.627 58.553 1.00 16.01 N -ATOM 942 CA ALA A 137 35.481 33.798 58.649 1.00 17.87 C -ATOM 943 C ALA A 137 34.844 33.866 57.247 1.00 18.01 C -ATOM 944 O ALA A 137 35.507 34.108 56.239 1.00 16.27 O -ATOM 945 CB ALA A 137 35.174 35.088 59.415 1.00 18.28 C -ATOM 946 N ASN A 138 33.532 33.622 57.203 1.00 18.60 N -ATOM 947 CA ASN A 138 32.733 33.695 56.001 1.00 18.18 C -ATOM 948 C ASN A 138 32.894 35.101 55.484 1.00 19.27 C -ATOM 949 O ASN A 138 32.994 36.085 56.229 1.00 17.88 O -ATOM 950 CB ASN A 138 31.262 33.470 56.276 1.00 17.20 C -ATOM 951 CG ASN A 138 30.433 33.247 55.024 1.00 20.09 C -ATOM 952 OD1 ASN A 138 30.676 32.313 54.261 1.00 19.28 O -ATOM 953 ND2 ASN A 138 29.436 34.094 54.767 1.00 20.96 N -ATOM 954 N ASN A 139 32.995 35.108 54.165 1.00 18.73 N -ATOM 955 CA ASN A 139 33.154 36.302 53.365 1.00 20.28 C -ATOM 956 C ASN A 139 34.413 37.113 53.609 1.00 19.05 C -ATOM 957 O ASN A 139 34.368 38.332 53.490 1.00 19.23 O -ATOM 958 CB ASN A 139 31.929 37.170 53.556 1.00 25.51 C -ATOM 959 CG ASN A 139 31.584 37.807 52.234 1.00 34.05 C -ATOM 960 OD1 ASN A 139 30.958 37.179 51.377 1.00 40.16 O -ATOM 961 ND2 ASN A 139 32.015 39.048 52.015 1.00 40.04 N -ATOM 962 N SER A 140 35.543 36.481 53.963 1.00 15.70 N -ATOM 963 CA SER A 140 36.798 37.186 54.122 1.00 14.52 C -ATOM 964 C SER A 140 37.315 37.619 52.773 1.00 15.11 C -ATOM 965 O SER A 140 37.031 36.951 51.785 1.00 14.47 O -ATOM 966 CB SER A 140 37.867 36.321 54.772 1.00 16.20 C -ATOM 967 OG SER A 140 37.468 36.086 56.112 1.00 18.16 O -ATOM 968 N PRO A 141 38.003 38.759 52.678 1.00 14.63 N -ATOM 969 CA PRO A 141 38.577 39.279 51.444 1.00 13.41 C -ATOM 970 C PRO A 141 39.807 38.525 51.000 1.00 10.55 C -ATOM 971 O PRO A 141 40.833 38.470 51.675 1.00 11.01 O -ATOM 972 CB PRO A 141 38.831 40.740 51.769 1.00 14.54 C -ATOM 973 CG PRO A 141 39.189 40.734 53.232 1.00 15.28 C -ATOM 974 CD PRO A 141 38.095 39.783 53.731 1.00 16.40 C -ATOM 975 N CYS A 142 39.669 37.908 49.826 1.00 11.19 N -ATOM 976 CA CYS A 142 40.765 37.156 49.211 1.00 10.27 C -ATOM 977 C CYS A 142 40.805 37.452 47.732 1.00 10.86 C -ATOM 978 O CYS A 142 39.767 37.785 47.149 1.00 12.76 O -ATOM 979 CB CYS A 142 40.548 35.673 49.362 1.00 12.32 C -ATOM 980 SG CYS A 142 40.395 35.106 51.066 1.00 11.55 S -ATOM 981 N TYR A 143 41.991 37.399 47.132 1.00 9.25 N -ATOM 982 CA TYR A 143 42.160 37.538 45.699 1.00 7.77 C -ATOM 983 C TYR A 143 42.678 36.232 45.103 1.00 9.84 C -ATOM 984 O TYR A 143 43.627 35.658 45.663 1.00 9.61 O -ATOM 985 CB TYR A 143 43.191 38.602 45.349 1.00 8.46 C -ATOM 986 CG TYR A 143 42.556 39.960 45.490 1.00 15.49 C -ATOM 987 CD1 TYR A 143 42.505 40.616 46.728 1.00 20.51 C -ATOM 988 CD2 TYR A 143 41.972 40.533 44.365 1.00 18.94 C -ATOM 989 CE1 TYR A 143 41.852 41.855 46.833 1.00 22.21 C -ATOM 990 CE2 TYR A 143 41.327 41.768 44.467 1.00 25.19 C -ATOM 991 CZ TYR A 143 41.275 42.414 45.699 1.00 25.16 C -ATOM 992 OH TYR A 143 40.644 43.636 45.777 1.00 31.74 O -ATOM 993 N ILE A 144 42.116 35.757 43.968 1.00 8.83 N -ATOM 994 CA ILE A 144 42.751 34.637 43.247 1.00 8.16 C -ATOM 995 C ILE A 144 43.617 35.210 42.158 1.00 8.94 C -ATOM 996 O ILE A 144 43.264 36.216 41.529 1.00 9.58 O -ATOM 997 CB ILE A 144 41.669 33.658 42.648 1.00 7.84 C -ATOM 998 CG1 ILE A 144 42.414 32.453 42.000 1.00 9.60 C -ATOM 999 CG2 ILE A 144 40.755 34.349 41.648 1.00 5.35 C -ATOM 1000 CD1 ILE A 144 41.552 31.284 41.473 1.00 6.07 C -ATOM 1001 N THR A 145 44.789 34.652 41.924 1.00 7.93 N -ATOM 1002 CA THR A 145 45.569 35.137 40.804 1.00 7.74 C -ATOM 1003 C THR A 145 45.991 34.012 39.845 1.00 10.60 C -ATOM 1004 O THR A 145 46.172 32.873 40.276 1.00 9.17 O -ATOM 1005 CB THR A 145 46.858 35.918 41.281 1.00 5.71 C -ATOM 1006 OG1 THR A 145 47.622 35.116 42.173 1.00 5.47 O -ATOM 1007 CG2 THR A 145 46.444 37.275 41.846 1.00 8.19 C -ATOM 1008 N GLY A 146 46.149 34.299 38.540 1.00 8.12 N -ATOM 1009 CA GLY A 146 46.676 33.295 37.629 1.00 9.19 C -ATOM 1010 C GLY A 146 46.537 33.671 36.155 1.00 9.69 C -ATOM 1011 O GLY A 146 45.903 34.677 35.803 1.00 8.92 O -ATOM 1012 N TRP A 147 47.140 32.807 35.319 1.00 7.68 N -ATOM 1013 CA TRP A 147 47.144 32.956 33.862 1.00 7.80 C -ATOM 1014 C TRP A 147 46.212 31.971 33.164 1.00 9.38 C -ATOM 1015 O TRP A 147 46.263 31.821 31.952 1.00 11.53 O -ATOM 1016 CB TRP A 147 48.558 32.739 33.306 1.00 8.48 C -ATOM 1017 CG TRP A 147 49.620 33.790 33.632 1.00 9.39 C -ATOM 1018 CD1 TRP A 147 49.780 34.882 32.834 1.00 10.04 C -ATOM 1019 CD2 TRP A 147 50.541 33.740 34.652 1.00 10.02 C -ATOM 1020 NE1 TRP A 147 50.813 35.519 33.335 1.00 8.45 N -ATOM 1021 CE2 TRP A 147 51.303 34.896 34.408 1.00 9.41 C -ATOM 1022 CE3 TRP A 147 50.865 32.913 35.729 1.00 7.37 C -ATOM 1023 CZ2 TRP A 147 52.386 35.235 35.229 1.00 11.23 C -ATOM 1024 CZ3 TRP A 147 51.953 33.253 36.548 1.00 7.18 C -ATOM 1025 CH2 TRP A 147 52.716 34.408 36.308 1.00 8.91 C -ATOM 1026 N GLY A 148 45.346 31.299 33.929 1.00 9.69 N -ATOM 1027 CA GLY A 148 44.410 30.330 33.395 1.00 7.88 C -ATOM 1028 C GLY A 148 43.335 30.928 32.510 1.00 9.49 C -ATOM 1029 O GLY A 148 43.270 32.144 32.321 1.00 10.20 O -ATOM 1030 N LEU A 149 42.438 30.060 32.037 1.00 7.76 N -ATOM 1031 CA LEU A 149 41.387 30.425 31.092 1.00 7.74 C -ATOM 1032 C LEU A 149 40.533 31.537 31.615 1.00 8.88 C -ATOM 1033 O LEU A 149 40.138 31.552 32.795 1.00 9.52 O -ATOM 1034 CB LEU A 149 40.429 29.279 30.782 1.00 7.94 C -ATOM 1035 CG LEU A 149 40.950 27.945 30.363 1.00 9.90 C -ATOM 1036 CD1 LEU A 149 39.772 27.102 29.900 1.00 12.79 C -ATOM 1037 CD2 LEU A 149 42.009 28.104 29.318 1.00 10.28 C -ATOM 1038 N THR A 150 40.270 32.468 30.710 1.00 8.87 N -ATOM 1039 CA THR A 150 39.468 33.607 31.094 1.00 10.03 C -ATOM 1040 C THR A 150 37.977 33.426 30.858 1.00 10.87 C -ATOM 1041 O THR A 150 37.150 34.270 31.235 1.00 10.66 O -ATOM 1042 CB THR A 150 40.028 34.863 30.362 1.00 10.23 C -ATOM 1043 OG1 THR A 150 39.856 34.692 28.967 1.00 14.19 O -ATOM 1044 CG2 THR A 150 41.491 35.069 30.621 1.00 9.13 C -ATOM 1045 N ARG A 151 37.589 32.297 30.250 1.00 11.55 N -ATOM 1046 CA ARG A 151 36.199 31.916 30.057 1.00 12.27 C -ATOM 1047 C ARG A 151 36.241 30.399 30.140 1.00 10.58 C -ATOM 1048 O ARG A 151 37.274 29.796 29.839 1.00 11.78 O -ATOM 1049 CB ARG A 151 35.622 32.208 28.642 1.00 19.17 C -ATOM 1050 CG ARG A 151 35.542 33.557 27.934 1.00 26.69 C -ATOM 1051 CD ARG A 151 34.361 34.465 28.283 1.00 34.03 C -ATOM 1052 NE ARG A 151 33.052 33.811 28.152 1.00 39.13 N -ATOM 1053 CZ ARG A 151 32.061 34.233 27.333 1.00 39.58 C -ATOM 1054 NH1 ARG A 151 32.169 35.307 26.524 1.00 40.73 N -ATOM 1055 NH2 ARG A 151 30.897 33.581 27.372 1.00 38.69 N -ATOM 1056 N THR A 152 35.125 29.758 30.488 1.00 11.92 N -ATOM 1057 CA THR A 152 34.967 28.299 30.424 1.00 12.16 C -ATOM 1058 C THR A 152 35.237 27.895 28.963 1.00 14.05 C -ATOM 1059 O THR A 152 34.671 28.486 28.039 1.00 14.86 O -ATOM 1060 CB THR A 152 33.536 27.922 30.815 1.00 9.41 C -ATOM 1061 OG1 THR A 152 33.409 28.313 32.174 1.00 14.56 O -ATOM 1062 CG2 THR A 152 33.199 26.458 30.680 1.00 11.59 C -ATOM 1063 N ASN A 153 36.126 26.926 28.749 1.00 14.23 N -ATOM 1064 CA ASN A 153 36.538 26.475 27.424 1.00 14.96 C -ATOM 1065 C ASN A 153 37.083 27.596 26.559 1.00 14.95 C -ATOM 1066 O ASN A 153 36.934 27.509 25.339 1.00 15.11 O -ATOM 1067 CB ASN A 153 35.370 25.809 26.676 1.00 19.04 C -ATOM 1068 CG ASN A 153 34.910 24.544 27.381 1.00 23.80 C -ATOM 1069 OD1 ASN A 153 35.706 23.653 27.729 1.00 24.64 O -ATOM 1070 ND2 ASN A 153 33.596 24.510 27.614 1.00 25.16 N -ATOM 1071 N GLY A 154 37.682 28.633 27.180 1.00 13.63 N -ATOM 1072 CA GLY A 154 38.293 29.745 26.469 1.00 11.62 C -ATOM 1073 C GLY A 154 39.772 29.503 26.257 1.00 13.55 C -ATOM 1074 O GLY A 154 40.259 28.392 25.990 1.00 15.18 O -ATOM 1075 N GLN A 155 40.527 30.570 26.353 1.00 14.43 N -ATOM 1076 CA GLN A 155 41.966 30.447 26.288 1.00 15.79 C -ATOM 1077 C GLN A 155 42.712 31.081 27.468 1.00 13.66 C -ATOM 1078 O GLN A 155 42.148 31.866 28.224 1.00 10.24 O -ATOM 1079 CB GLN A 155 42.494 31.050 24.978 1.00 21.59 C -ATOM 1080 CG GLN A 155 42.034 32.419 24.521 1.00 29.39 C -ATOM 1081 CD GLN A 155 42.764 32.889 23.260 1.00 34.23 C -ATOM 1082 OE1 GLN A 155 43.277 32.111 22.451 1.00 36.53 O -ATOM 1083 NE2 GLN A 155 42.853 34.200 23.067 1.00 36.81 N -ATOM 1084 N LEU A 156 43.990 30.734 27.655 1.00 14.13 N -ATOM 1085 CA LEU A 156 44.836 31.289 28.717 1.00 14.79 C -ATOM 1086 C LEU A 156 44.989 32.798 28.626 1.00 16.90 C -ATOM 1087 O LEU A 156 44.858 33.409 27.550 1.00 16.83 O -ATOM 1088 CB LEU A 156 46.234 30.698 28.671 1.00 15.94 C -ATOM 1089 CG LEU A 156 46.337 29.193 28.964 1.00 19.73 C -ATOM 1090 CD1 LEU A 156 47.807 28.814 28.724 1.00 20.30 C -ATOM 1091 CD2 LEU A 156 45.865 28.823 30.392 1.00 16.92 C -ATOM 1092 N ALA A 157 45.223 33.437 29.764 1.00 15.33 N -ATOM 1093 CA ALA A 157 45.495 34.858 29.753 1.00 15.51 C -ATOM 1094 C ALA A 157 46.947 35.040 29.333 1.00 16.07 C -ATOM 1095 O ALA A 157 47.813 34.194 29.633 1.00 17.90 O -ATOM 1096 CB ALA A 157 45.296 35.403 31.140 1.00 12.82 C -ATOM 1097 N GLN A 158 47.257 36.120 28.610 1.00 15.47 N -ATOM 1098 CA GLN A 158 48.664 36.437 28.362 1.00 17.41 C -ATOM 1099 C GLN A 158 49.301 37.143 29.552 1.00 13.63 C -ATOM 1100 O GLN A 158 50.479 36.973 29.807 1.00 14.94 O -ATOM 1101 CB GLN A 158 48.861 37.368 27.215 1.00 24.31 C -ATOM 1102 CG GLN A 158 48.408 36.857 25.859 1.00 36.06 C -ATOM 1103 CD GLN A 158 48.489 37.906 24.729 1.00 42.49 C -ATOM 1104 OE1 GLN A 158 47.839 37.725 23.689 1.00 46.00 O -ATOM 1105 NE2 GLN A 158 49.244 39.021 24.843 1.00 44.51 N -ATOM 1106 N THR A 159 48.564 37.994 30.273 1.00 14.16 N -ATOM 1107 CA THR A 159 49.082 38.719 31.431 1.00 13.59 C -ATOM 1108 C THR A 159 48.386 38.250 32.721 1.00 12.30 C -ATOM 1109 O THR A 159 47.212 37.843 32.687 1.00 13.30 O -ATOM 1110 CB THR A 159 48.863 40.238 31.206 1.00 14.21 C -ATOM 1111 OG1 THR A 159 47.474 40.482 31.134 1.00 16.33 O -ATOM 1112 CG2 THR A 159 49.479 40.707 29.901 1.00 15.33 C -ATOM 1113 N LEU A 160 49.072 38.369 33.880 1.00 11.84 N -ATOM 1114 CA LEU A 160 48.496 37.890 35.143 1.00 12.23 C -ATOM 1115 C LEU A 160 47.179 38.597 35.455 1.00 11.95 C -ATOM 1116 O LEU A 160 47.063 39.809 35.272 1.00 12.78 O -ATOM 1117 CB LEU A 160 49.509 38.104 36.293 1.00 11.08 C -ATOM 1118 CG LEU A 160 49.146 37.580 37.676 1.00 10.58 C -ATOM 1119 CD1 LEU A 160 49.052 36.061 37.608 1.00 8.70 C -ATOM 1120 CD2 LEU A 160 50.203 37.943 38.681 1.00 10.14 C -ATOM 1121 N GLN A 161 46.164 37.806 35.817 1.00 8.13 N -ATOM 1122 CA GLN A 161 44.839 38.318 36.151 1.00 9.83 C -ATOM 1123 C GLN A 161 44.583 38.159 37.638 1.00 10.91 C -ATOM 1124 O GLN A 161 45.180 37.282 38.280 1.00 11.00 O -ATOM 1125 CB GLN A 161 43.691 37.548 35.461 1.00 10.26 C -ATOM 1126 CG GLN A 161 43.752 37.452 33.946 1.00 12.31 C -ATOM 1127 CD GLN A 161 43.575 38.796 33.267 1.00 13.11 C -ATOM 1128 OE1 GLN A 161 42.483 39.358 33.324 1.00 15.12 O -ATOM 1129 NE2 GLN A 161 44.620 39.310 32.628 1.00 15.95 N -ATOM 1130 N GLN A 162 43.699 38.982 38.181 1.00 10.49 N -ATOM 1131 CA GLN A 162 43.262 38.785 39.556 1.00 13.38 C -ATOM 1132 C GLN A 162 41.767 39.000 39.660 1.00 12.98 C -ATOM 1133 O GLN A 162 41.156 39.715 38.864 1.00 13.63 O -ATOM 1134 CB GLN A 162 43.981 39.738 40.506 1.00 14.26 C -ATOM 1135 CG GLN A 162 43.684 41.172 40.198 1.00 18.96 C -ATOM 1136 CD GLN A 162 44.422 42.100 41.114 1.00 17.04 C -ATOM 1137 OE1 GLN A 162 45.636 42.113 41.175 1.00 18.54 O -ATOM 1138 NE2 GLN A 162 43.661 42.902 41.825 1.00 19.42 N -ATOM 1139 N ALA A 163 41.127 38.327 40.599 1.00 13.23 N -ATOM 1140 CA ALA A 163 39.695 38.494 40.792 1.00 13.22 C -ATOM 1141 C ALA A 163 39.435 38.497 42.288 1.00 11.36 C -ATOM 1142 O ALA A 163 40.101 37.777 43.036 1.00 11.21 O -ATOM 1143 CB ALA A 163 38.880 37.350 40.176 1.00 14.42 C -ATOM 1144 N TYR A 164 38.474 39.311 42.731 1.00 11.67 N -ATOM 1145 CA TYR A 164 38.141 39.408 44.130 1.00 11.56 C -ATOM 1146 C TYR A 164 37.231 38.243 44.395 1.00 10.80 C -ATOM 1147 O TYR A 164 36.176 38.123 43.775 1.00 12.70 O -ATOM 1148 CB TYR A 164 37.448 40.710 44.359 1.00 12.54 C -ATOM 1149 CG TYR A 164 37.040 40.933 45.788 1.00 13.95 C -ATOM 1150 CD1 TYR A 164 38.014 41.027 46.791 1.00 17.97 C -ATOM 1151 CD2 TYR A 164 35.687 41.029 46.070 1.00 16.75 C -ATOM 1152 CE1 TYR A 164 37.615 41.220 48.101 1.00 18.03 C -ATOM 1153 CE2 TYR A 164 35.281 41.224 47.391 1.00 21.27 C -ATOM 1154 CZ TYR A 164 36.248 41.318 48.402 1.00 22.57 C -ATOM 1155 OH TYR A 164 35.833 41.496 49.724 1.00 26.64 O -ATOM 1156 N LEU A 165 37.643 37.397 45.335 1.00 9.07 N -ATOM 1157 CA LEU A 165 36.957 36.131 45.560 1.00 10.37 C -ATOM 1158 C LEU A 165 36.810 35.914 47.063 1.00 11.29 C -ATOM 1159 O LEU A 165 37.644 35.248 47.661 1.00 11.27 O -ATOM 1160 CB LEU A 165 37.787 34.976 44.930 1.00 12.38 C -ATOM 1161 CG LEU A 165 37.093 33.893 44.101 1.00 11.95 C -ATOM 1162 CD1 LEU A 165 36.540 34.532 42.852 1.00 9.43 C -ATOM 1163 CD2 LEU A 165 38.062 32.782 43.751 1.00 8.65 C -ATOM 1164 N PRO A 166 35.818 36.492 47.729 1.00 11.82 N -ATOM 1165 CA PRO A 166 35.583 36.361 49.163 1.00 13.01 C -ATOM 1166 C PRO A 166 35.260 34.957 49.614 1.00 13.63 C -ATOM 1167 O PRO A 166 34.616 34.224 48.863 1.00 12.83 O -ATOM 1168 CB PRO A 166 34.462 37.318 49.422 1.00 15.56 C -ATOM 1169 CG PRO A 166 33.694 37.392 48.119 1.00 16.69 C -ATOM 1170 CD PRO A 166 34.823 37.368 47.118 1.00 14.04 C -ATOM 1171 N THR A 167 35.620 34.550 50.821 1.00 14.28 N -ATOM 1172 CA THR A 167 35.421 33.166 51.166 1.00 12.03 C -ATOM 1173 C THR A 167 33.984 32.783 51.463 1.00 13.99 C -ATOM 1174 O THR A 167 33.121 33.622 51.727 1.00 13.60 O -ATOM 1175 CB THR A 167 36.327 32.814 52.346 1.00 14.28 C -ATOM 1176 OG1 THR A 167 35.813 33.542 53.453 1.00 12.69 O -ATOM 1177 CG2 THR A 167 37.805 33.108 52.083 1.00 14.31 C -ATOM 1178 N VAL A 168 33.710 31.477 51.351 1.00 12.25 N -ATOM 1179 CA VAL A 168 32.398 30.889 51.637 1.00 13.80 C -ATOM 1180 C VAL A 168 32.787 29.872 52.697 1.00 16.47 C -ATOM 1181 O VAL A 168 33.563 28.951 52.386 1.00 16.50 O -ATOM 1182 CB VAL A 168 31.794 30.139 50.415 1.00 11.38 C -ATOM 1183 CG1 VAL A 168 30.432 29.638 50.754 1.00 12.27 C -ATOM 1184 CG2 VAL A 168 31.689 31.048 49.222 1.00 14.01 C -ATOM 1185 N ASP A 169 32.285 29.980 53.941 1.00 16.38 N -ATOM 1186 CA ASP A 169 32.769 29.053 54.947 1.00 18.65 C -ATOM 1187 C ASP A 169 32.266 27.632 54.746 1.00 17.74 C -ATOM 1188 O ASP A 169 31.359 27.388 53.953 1.00 17.72 O -ATOM 1189 CB ASP A 169 32.409 29.582 56.344 1.00 19.48 C -ATOM 1190 CG ASP A 169 30.968 29.641 56.817 1.00 24.59 C -ATOM 1191 OD1 ASP A 169 30.079 29.046 56.217 1.00 26.31 O -ATOM 1192 OD2 ASP A 169 30.738 30.291 57.834 1.00 24.58 O -ATOM 1193 N TYR A 170 32.844 26.713 55.507 1.00 18.85 N -ATOM 1194 CA TYR A 170 32.610 25.308 55.315 1.00 19.40 C -ATOM 1195 C TYR A 170 31.175 24.909 55.488 1.00 20.05 C -ATOM 1196 O TYR A 170 30.680 24.097 54.705 1.00 18.83 O -ATOM 1197 CB TYR A 170 33.506 24.536 56.265 1.00 21.04 C -ATOM 1198 CG TYR A 170 33.214 23.051 56.250 1.00 23.14 C -ATOM 1199 CD1 TYR A 170 33.602 22.282 55.145 1.00 26.72 C -ATOM 1200 CD2 TYR A 170 32.532 22.469 57.332 1.00 26.68 C -ATOM 1201 CE1 TYR A 170 33.314 20.920 55.119 1.00 25.93 C -ATOM 1202 CE2 TYR A 170 32.241 21.102 57.307 1.00 27.72 C -ATOM 1203 CZ TYR A 170 32.645 20.334 56.199 1.00 28.85 C -ATOM 1204 OH TYR A 170 32.446 18.960 56.205 1.00 27.20 O -ATOM 1205 N ALA A 171 30.485 25.483 56.457 1.00 19.61 N -ATOM 1206 CA ALA A 171 29.101 25.118 56.673 1.00 21.92 C -ATOM 1207 C ALA A 171 28.224 25.480 55.490 1.00 23.01 C -ATOM 1208 O ALA A 171 27.300 24.738 55.163 1.00 24.62 O -ATOM 1209 CB ALA A 171 28.552 25.819 57.901 1.00 22.12 C -ATOM 1210 N ILE A 172 28.501 26.598 54.811 1.00 22.62 N -ATOM 1211 CA ILE A 172 27.740 26.953 53.626 1.00 22.20 C -ATOM 1212 C ILE A 172 28.229 26.155 52.417 1.00 21.87 C -ATOM 1213 O ILE A 172 27.414 25.602 51.661 1.00 23.60 O -ATOM 1214 CB ILE A 172 27.877 28.447 53.367 1.00 23.58 C -ATOM 1215 CG1 ILE A 172 27.265 29.244 54.528 1.00 26.43 C -ATOM 1216 CG2 ILE A 172 27.127 28.796 52.093 1.00 23.26 C -ATOM 1217 CD1 ILE A 172 27.460 30.777 54.480 1.00 29.86 C -ATOM 1218 N CYS A 173 29.550 26.023 52.248 1.00 20.25 N -ATOM 1219 CA CYS A 173 30.085 25.356 51.077 1.00 19.04 C -ATOM 1220 C CYS A 173 29.723 23.876 50.994 1.00 18.75 C -ATOM 1221 O CYS A 173 29.491 23.342 49.908 1.00 16.80 O -ATOM 1222 CB CYS A 173 31.593 25.525 51.061 1.00 17.25 C -ATOM 1223 SG CYS A 173 32.221 25.307 49.374 1.00 14.89 S -ATOM 1224 N SER A 174 29.611 23.206 52.138 1.00 18.61 N -ATOM 1225 CA SER A 174 29.246 21.819 52.096 1.00 19.62 C -ATOM 1226 C SER A 174 27.756 21.616 52.240 1.00 19.20 C -ATOM 1227 O SER A 174 27.318 20.478 52.376 1.00 20.88 O -ATOM 1228 CB SER A 174 30.015 21.085 53.173 1.00 19.00 C -ATOM 1229 OG SER A 174 29.675 21.542 54.466 1.00 23.92 O -ATOM 1230 N SER A 175 26.928 22.660 52.158 1.00 19.31 N -ATOM 1231 CA SER A 175 25.500 22.463 52.244 1.00 19.81 C -ATOM 1232 C SER A 175 25.071 21.940 50.890 1.00 22.90 C -ATOM 1233 O SER A 175 25.757 22.156 49.872 1.00 22.99 O -ATOM 1234 CB SER A 175 24.782 23.757 52.557 1.00 17.66 C -ATOM 1235 OG SER A 175 24.702 24.666 51.472 1.00 22.90 O -ATOM 1236 N SER A 176 23.950 21.222 50.843 1.00 25.07 N -ATOM 1237 CA SER A 176 23.537 20.574 49.607 1.00 27.40 C -ATOM 1238 C SER A 176 23.314 21.487 48.400 1.00 26.86 C -ATOM 1239 O SER A 176 23.465 21.041 47.265 1.00 28.07 O -ATOM 1240 CB SER A 176 22.275 19.739 49.916 1.00 30.02 C -ATOM 1241 OG SER A 176 21.199 20.458 50.511 1.00 36.25 O -ATOM 1242 N SER A 177 23.023 22.778 48.556 1.00 27.00 N -ATOM 1243 CA SER A 177 22.851 23.663 47.403 1.00 27.03 C -ATOM 1244 C SER A 177 24.156 24.169 46.760 1.00 25.15 C -ATOM 1245 O SER A 177 24.150 24.736 45.662 1.00 24.45 O -ATOM 1246 CB SER A 177 21.947 24.858 47.831 1.00 29.12 C -ATOM 1247 OG SER A 177 22.066 25.296 49.188 1.00 35.57 O -ATOM 1248 N TYR A 178 25.282 23.972 47.467 1.00 22.58 N -ATOM 1249 CA TYR A 178 26.628 24.306 47.009 1.00 19.15 C -ATOM 1250 C TYR A 178 27.369 23.040 46.614 1.00 17.43 C -ATOM 1251 O TYR A 178 26.943 22.403 45.659 1.00 16.91 O -ATOM 1252 CB TYR A 178 27.403 25.033 48.110 1.00 19.85 C -ATOM 1253 CG TYR A 178 26.936 26.453 48.295 1.00 19.44 C -ATOM 1254 CD1 TYR A 178 25.648 26.697 48.769 1.00 20.35 C -ATOM 1255 CD2 TYR A 178 27.804 27.490 47.954 1.00 21.19 C -ATOM 1256 CE1 TYR A 178 25.208 28.000 48.907 1.00 23.84 C -ATOM 1257 CE2 TYR A 178 27.372 28.796 48.082 1.00 21.78 C -ATOM 1258 CZ TYR A 178 26.078 29.036 48.552 1.00 25.26 C -ATOM 1259 OH TYR A 178 25.630 30.337 48.640 1.00 29.53 O -ATOM 1260 N TRP A 179 28.438 22.590 47.283 1.00 15.81 N -ATOM 1261 CA TRP A 179 29.178 21.425 46.843 1.00 14.58 C -ATOM 1262 C TRP A 179 28.825 20.158 47.577 1.00 15.60 C -ATOM 1263 O TRP A 179 29.259 19.074 47.206 1.00 15.80 O -ATOM 1264 CB TRP A 179 30.638 21.704 47.014 1.00 10.68 C -ATOM 1265 CG TRP A 179 31.306 22.452 45.874 1.00 13.09 C -ATOM 1266 CD1 TRP A 179 31.641 23.789 45.945 1.00 12.92 C -ATOM 1267 CD2 TRP A 179 31.699 21.873 44.701 1.00 13.86 C -ATOM 1268 NE1 TRP A 179 32.262 24.051 44.808 1.00 12.64 N -ATOM 1269 CE2 TRP A 179 32.326 22.956 44.034 1.00 12.99 C -ATOM 1270 CE3 TRP A 179 31.605 20.616 44.123 1.00 13.14 C -ATOM 1271 CZ2 TRP A 179 32.881 22.776 42.753 1.00 12.21 C -ATOM 1272 CZ3 TRP A 179 32.149 20.444 42.847 1.00 15.91 C -ATOM 1273 CH2 TRP A 179 32.782 21.503 42.166 1.00 14.09 C -ATOM 1274 N GLY A 180 28.074 20.277 48.664 1.00 15.83 N -ATOM 1275 CA GLY A 180 27.719 19.125 49.483 1.00 16.58 C -ATOM 1276 C GLY A 180 28.944 18.478 50.082 1.00 18.19 C -ATOM 1277 O GLY A 180 29.944 19.129 50.416 1.00 18.94 O -ATOM 1278 N SER A 181 28.839 17.145 50.120 1.00 19.51 N -ATOM 1279 CA SER A 181 29.881 16.222 50.565 1.00 20.26 C -ATOM 1280 C SER A 181 31.235 16.299 49.891 1.00 17.73 C -ATOM 1281 O SER A 181 32.232 15.824 50.432 1.00 18.28 O -ATOM 1282 CB SER A 181 29.466 14.766 50.390 1.00 22.21 C -ATOM 1283 OG SER A 181 28.769 14.312 51.523 1.00 28.46 O -ATOM 1284 N THR A 182 31.291 16.821 48.682 1.00 16.34 N -ATOM 1285 CA THR A 182 32.539 16.864 47.951 1.00 15.15 C -ATOM 1286 C THR A 182 33.515 17.765 48.670 1.00 13.10 C -ATOM 1287 O THR A 182 34.690 17.421 48.625 1.00 14.50 O -ATOM 1288 CB THR A 182 32.200 17.336 46.539 1.00 17.28 C -ATOM 1289 OG1 THR A 182 31.377 16.291 46.046 1.00 18.72 O -ATOM 1290 CG2 THR A 182 33.375 17.574 45.620 1.00 17.98 C -ATOM 1291 N VAL A 183 33.120 18.855 49.356 1.00 11.33 N -ATOM 1292 CA VAL A 183 34.165 19.646 50.033 1.00 12.21 C -ATOM 1293 C VAL A 183 34.349 19.158 51.448 1.00 12.41 C -ATOM 1294 O VAL A 183 33.427 18.725 52.124 1.00 15.19 O -ATOM 1295 CB VAL A 183 33.888 21.174 50.102 1.00 14.68 C -ATOM 1296 CG1 VAL A 183 33.857 21.630 48.660 1.00 16.16 C -ATOM 1297 CG2 VAL A 183 32.628 21.552 50.801 1.00 16.59 C -ATOM 1298 N LYS A 184 35.610 19.128 51.798 1.00 11.85 N -ATOM 1299 CA LYS A 184 36.046 18.708 53.104 1.00 12.76 C -ATOM 1300 C LYS A 184 36.480 19.966 53.849 1.00 14.30 C -ATOM 1301 O LYS A 184 36.728 21.024 53.275 1.00 12.58 O -ATOM 1302 CB LYS A 184 37.248 17.747 53.006 1.00 10.65 C -ATOM 1303 CG LYS A 184 37.052 16.560 52.054 1.00 14.86 C -ATOM 1304 CD LYS A 184 35.784 15.804 52.402 1.00 15.58 C -ATOM 1305 CE LYS A 184 35.466 14.618 51.488 1.00 18.57 C -ATOM 1306 NZ LYS A 184 35.004 15.001 50.158 1.00 16.58 N -ATOM 1307 N ASN A 185 36.630 19.812 55.162 1.00 15.07 N -ATOM 1308 CA ASN A 185 37.134 20.869 56.020 1.00 17.39 C -ATOM 1309 C ASN A 185 38.643 21.147 55.792 1.00 14.69 C -ATOM 1310 O ASN A 185 39.116 22.198 56.234 1.00 14.25 O -ATOM 1311 CB ASN A 185 36.834 20.492 57.497 1.00 22.38 C -ATOM 1312 CG ASN A 185 37.098 21.662 58.459 1.00 29.56 C -ATOM 1313 OD1 ASN A 185 37.642 21.428 59.538 1.00 34.55 O -ATOM 1314 ND2 ASN A 185 36.810 22.950 58.173 1.00 31.07 N -ATOM 1315 N SER A 186 39.416 20.274 55.081 1.00 10.71 N -ATOM 1316 CA SER A 186 40.789 20.543 54.657 1.00 9.08 C -ATOM 1317 C SER A 186 40.816 21.433 53.386 1.00 8.56 C -ATOM 1318 O SER A 186 41.870 21.577 52.757 1.00 8.90 O -ATOM 1319 CB SER A 186 41.531 19.237 54.341 1.00 9.04 C -ATOM 1320 OG SER A 186 40.846 18.549 53.296 1.00 10.97 O -ATOM 1321 N MET A 187 39.692 22.023 52.979 1.00 7.52 N -ATOM 1322 CA MET A 187 39.585 22.867 51.804 1.00 10.21 C -ATOM 1323 C MET A 187 38.993 24.237 52.154 1.00 12.42 C -ATOM 1324 O MET A 187 38.270 24.386 53.138 1.00 11.96 O -ATOM 1325 CB MET A 187 38.671 22.216 50.791 1.00 10.94 C -ATOM 1326 CG MET A 187 39.204 20.911 50.205 1.00 11.39 C -ATOM 1327 SD MET A 187 37.858 20.000 49.438 1.00 10.12 S -ATOM 1328 CE MET A 187 38.604 18.454 49.020 1.00 10.58 C -ATOM 1329 N VAL A 188 39.304 25.263 51.350 1.00 12.50 N -ATOM 1330 CA VAL A 188 38.697 26.598 51.432 1.00 13.07 C -ATOM 1331 C VAL A 188 37.879 26.815 50.155 1.00 11.00 C -ATOM 1332 O VAL A 188 38.297 26.453 49.077 1.00 13.48 O -ATOM 1333 CB VAL A 188 39.768 27.717 51.529 1.00 13.39 C -ATOM 1334 CG1 VAL A 188 39.170 29.107 51.572 1.00 13.79 C -ATOM 1335 CG2 VAL A 188 40.536 27.482 52.798 1.00 12.84 C -ATOM 1336 N CYS A 189 36.697 27.373 50.265 1.00 12.00 N -ATOM 1337 CA CYS A 189 35.841 27.710 49.152 1.00 11.22 C -ATOM 1338 C CYS A 189 35.862 29.210 49.013 1.00 12.82 C -ATOM 1339 O CYS A 189 35.793 29.898 50.024 1.00 11.42 O -ATOM 1340 CB CYS A 189 34.411 27.300 49.402 1.00 13.78 C -ATOM 1341 SG CYS A 189 34.212 25.515 49.558 1.00 12.57 S -ATOM 1342 N ALA A 190 35.977 29.752 47.793 1.00 11.38 N -ATOM 1343 CA ALA A 190 35.901 31.199 47.611 1.00 10.48 C -ATOM 1344 C ALA A 190 35.139 31.493 46.321 1.00 10.01 C -ATOM 1345 O ALA A 190 35.229 30.723 45.356 1.00 10.78 O -ATOM 1346 CB ALA A 190 37.304 31.764 47.552 1.00 7.99 C -ATOM 1347 N GLY A 191 34.278 32.528 46.318 1.00 9.54 N -ATOM 1348 CA GLY A 191 33.535 32.923 45.138 1.00 10.94 C -ATOM 1349 C GLY A 191 32.145 32.340 45.049 1.00 11.49 C -ATOM 1350 O GLY A 191 31.391 32.402 46.015 1.00 15.03 O -ATOM 1351 N GLY A 192 31.795 31.810 43.883 1.00 11.09 N -ATOM 1352 CA GLY A 192 30.468 31.222 43.705 1.00 11.75 C -ATOM 1353 C GLY A 192 29.407 32.187 43.205 1.00 13.13 C -ATOM 1354 O GLY A 192 28.250 31.816 43.138 1.00 12.39 O -ATOM 1355 N ASP A 193 29.761 33.422 42.839 1.00 14.59 N -ATOM 1356 CA ASP A 193 28.770 34.392 42.363 1.00 16.42 C -ATOM 1357 C ASP A 193 28.282 34.182 40.922 1.00 17.95 C -ATOM 1358 O ASP A 193 27.339 34.831 40.484 1.00 20.10 O -ATOM 1359 CB ASP A 193 29.326 35.854 42.519 1.00 17.13 C -ATOM 1360 CG ASP A 193 30.544 36.360 41.725 1.00 19.55 C -ATOM 1361 OD1 ASP A 193 31.034 35.665 40.846 1.00 19.13 O -ATOM 1362 OD2 ASP A 193 31.043 37.457 41.995 1.00 20.30 O -ATOM 1363 N GLY A 194 28.878 33.264 40.170 1.00 17.24 N -ATOM 1364 CA GLY A 194 28.495 33.016 38.790 1.00 17.43 C -ATOM 1365 C GLY A 194 29.245 33.916 37.820 1.00 18.50 C -ATOM 1366 O GLY A 194 29.095 33.748 36.617 1.00 21.56 O -ATOM 1367 N VAL A 195 30.084 34.850 38.281 1.00 16.91 N -ATOM 1368 CA VAL A 195 30.838 35.793 37.447 1.00 16.26 C -ATOM 1369 C VAL A 195 32.346 35.605 37.463 1.00 15.66 C -ATOM 1370 O VAL A 195 33.052 35.707 36.457 1.00 15.31 O -ATOM 1371 CB VAL A 195 30.553 37.275 37.882 1.00 15.62 C -ATOM 1372 CG1 VAL A 195 31.218 38.227 36.885 1.00 12.84 C -ATOM 1373 CG2 VAL A 195 29.042 37.511 37.993 1.00 17.52 C -ATOM 1374 N ARG A 196 32.829 35.354 38.673 1.00 14.43 N -ATOM 1375 CA ARG A 196 34.244 35.333 38.967 1.00 13.75 C -ATOM 1376 C ARG A 196 34.619 33.972 39.483 1.00 10.11 C -ATOM 1377 O ARG A 196 33.910 33.436 40.322 1.00 11.55 O -ATOM 1378 CB ARG A 196 34.598 36.365 40.036 1.00 16.23 C -ATOM 1379 CG ARG A 196 34.460 37.700 39.378 1.00 21.25 C -ATOM 1380 CD ARG A 196 34.743 38.820 40.316 1.00 20.80 C -ATOM 1381 NE ARG A 196 33.700 38.932 41.323 1.00 21.73 N -ATOM 1382 CZ ARG A 196 33.610 40.024 42.086 1.00 22.00 C -ATOM 1383 NH1 ARG A 196 34.467 41.054 41.927 1.00 20.62 N -ATOM 1384 NH2 ARG A 196 32.717 40.033 43.077 1.00 21.75 N -ATOM 1385 N SER A 197 35.713 33.421 38.988 1.00 10.11 N -ATOM 1386 CA SER A 197 36.198 32.147 39.479 1.00 9.45 C -ATOM 1387 C SER A 197 37.592 31.883 39.001 1.00 6.91 C -ATOM 1388 O SER A 197 38.159 32.562 38.140 1.00 9.22 O -ATOM 1389 CB SER A 197 35.297 31.007 38.996 1.00 12.93 C -ATOM 1390 OG SER A 197 35.336 30.935 37.577 1.00 20.65 O -ATOM 1391 N GLY A 198 38.160 30.827 39.565 1.00 7.32 N -ATOM 1392 CA GLY A 198 39.364 30.208 39.003 1.00 8.03 C -ATOM 1393 C GLY A 198 38.972 29.406 37.764 1.00 7.77 C -ATOM 1394 O GLY A 198 37.780 29.191 37.521 1.00 11.00 O -ATOM 1395 N CYS A 199 39.901 28.961 36.939 1.00 8.22 N -ATOM 1396 CA CYS A 199 39.509 28.154 35.759 1.00 8.73 C -ATOM 1397 C CYS A 199 40.744 27.340 35.398 1.00 8.78 C -ATOM 1398 O CYS A 199 41.796 27.568 35.999 1.00 10.58 O -ATOM 1399 CB CYS A 199 39.096 29.056 34.534 1.00 9.70 C -ATOM 1400 SG CYS A 199 37.954 28.233 33.374 1.00 10.88 S -ATOM 1401 N GLN A 200 40.713 26.389 34.451 1.00 10.41 N -ATOM 1402 CA GLN A 200 41.885 25.592 34.095 1.00 9.08 C -ATOM 1403 C GLN A 200 43.107 26.415 33.856 1.00 9.28 C -ATOM 1404 O GLN A 200 42.942 27.456 33.234 1.00 10.66 O -ATOM 1405 CB GLN A 200 41.655 24.810 32.835 1.00 15.06 C -ATOM 1406 CG GLN A 200 40.680 23.683 33.098 1.00 23.03 C -ATOM 1407 CD GLN A 200 39.292 24.017 32.633 1.00 28.01 C -ATOM 1408 OE1 GLN A 200 38.840 23.535 31.590 1.00 34.19 O -ATOM 1409 NE2 GLN A 200 38.569 24.812 33.404 1.00 30.17 N -ATOM 1410 N GLY A 201 44.286 26.022 34.354 1.00 5.85 N -ATOM 1411 CA GLY A 201 45.546 26.785 34.241 1.00 7.92 C -ATOM 1412 C GLY A 201 45.821 27.690 35.457 1.00 5.59 C -ATOM 1413 O GLY A 201 46.904 28.245 35.569 1.00 8.61 O -ATOM 1414 N ASP A 202 44.808 27.926 36.298 1.00 7.47 N -ATOM 1415 CA ASP A 202 44.988 28.610 37.575 1.00 6.56 C -ATOM 1416 C ASP A 202 45.353 27.604 38.678 1.00 9.54 C -ATOM 1417 O ASP A 202 45.887 27.999 39.703 1.00 6.94 O -ATOM 1418 CB ASP A 202 43.733 29.345 38.003 1.00 6.07 C -ATOM 1419 CG ASP A 202 43.380 30.501 37.103 1.00 4.86 C -ATOM 1420 OD1 ASP A 202 44.282 31.198 36.652 1.00 8.85 O -ATOM 1421 OD2 ASP A 202 42.199 30.695 36.860 1.00 7.20 O -ATOM 1422 N SER A 203 45.120 26.301 38.460 1.00 12.03 N -ATOM 1423 CA SER A 203 45.496 25.184 39.340 1.00 11.28 C -ATOM 1424 C SER A 203 46.832 25.356 40.015 1.00 8.97 C -ATOM 1425 O SER A 203 47.781 25.791 39.370 1.00 7.68 O -ATOM 1426 CB SER A 203 45.580 23.890 38.534 1.00 13.93 C -ATOM 1427 OG SER A 203 44.314 23.381 38.110 1.00 16.67 O -ATOM 1428 N GLY A 204 46.951 25.077 41.300 1.00 7.04 N -ATOM 1429 CA GLY A 204 48.247 25.158 41.935 1.00 6.36 C -ATOM 1430 C GLY A 204 48.566 26.524 42.502 1.00 7.46 C -ATOM 1431 O GLY A 204 49.417 26.631 43.396 1.00 6.58 O -ATOM 1432 N GLY A 205 47.878 27.567 41.978 1.00 7.72 N -ATOM 1433 CA GLY A 205 48.228 28.922 42.354 1.00 6.49 C -ATOM 1434 C GLY A 205 47.653 29.337 43.694 1.00 7.96 C -ATOM 1435 O GLY A 205 46.865 28.597 44.306 1.00 9.08 O -ATOM 1436 N PRO A 206 48.010 30.549 44.151 1.00 7.38 N -ATOM 1437 CA PRO A 206 47.538 31.146 45.403 1.00 6.75 C -ATOM 1438 C PRO A 206 46.131 31.751 45.478 1.00 7.46 C -ATOM 1439 O PRO A 206 45.570 32.262 44.485 1.00 6.98 O -ATOM 1440 CB PRO A 206 48.619 32.164 45.712 1.00 3.94 C -ATOM 1441 CG PRO A 206 48.841 32.717 44.308 1.00 7.28 C -ATOM 1442 CD PRO A 206 48.937 31.463 43.457 1.00 4.71 C -ATOM 1443 N LEU A 207 45.556 31.637 46.682 1.00 6.01 N -ATOM 1444 CA LEU A 207 44.400 32.439 47.073 1.00 6.18 C -ATOM 1445 C LEU A 207 45.077 33.308 48.157 1.00 7.30 C -ATOM 1446 O LEU A 207 45.624 32.791 49.148 1.00 7.76 O -ATOM 1447 CB LEU A 207 43.247 31.589 47.693 1.00 5.97 C -ATOM 1448 CG LEU A 207 41.992 32.358 48.218 1.00 4.05 C -ATOM 1449 CD1 LEU A 207 41.246 33.024 47.068 1.00 6.67 C -ATOM 1450 CD2 LEU A 207 41.077 31.399 48.970 1.00 7.99 C -ATOM 1451 N HIS A 208 45.156 34.627 47.931 1.00 7.62 N -ATOM 1452 CA HIS A 208 45.818 35.576 48.844 1.00 7.94 C -ATOM 1453 C HIS A 208 44.728 36.187 49.672 1.00 8.26 C -ATOM 1454 O HIS A 208 43.806 36.778 49.103 1.00 8.96 O -ATOM 1455 CB HIS A 208 46.483 36.740 48.138 1.00 6.17 C -ATOM 1456 CG HIS A 208 47.324 36.319 46.959 1.00 9.32 C -ATOM 1457 ND1 HIS A 208 48.604 35.971 46.999 1.00 8.26 N -ATOM 1458 CD2 HIS A 208 46.916 36.270 45.636 1.00 10.85 C -ATOM 1459 CE1 HIS A 208 49.011 35.724 45.759 1.00 10.58 C -ATOM 1460 NE2 HIS A 208 47.979 35.909 44.963 1.00 12.70 N -ATOM 1461 N CYS A 209 44.794 36.094 51.003 1.00 10.31 N -ATOM 1462 CA CYS A 209 43.768 36.662 51.874 1.00 9.59 C -ATOM 1463 C CYS A 209 44.396 37.619 52.867 1.00 10.04 C -ATOM 1464 O CYS A 209 45.472 37.361 53.397 1.00 9.32 O -ATOM 1465 CB CYS A 209 43.045 35.584 52.653 1.00 10.10 C -ATOM 1466 SG CYS A 209 42.199 34.388 51.566 1.00 10.46 S -ATOM 1467 N LEU A 210 43.710 38.746 53.064 1.00 12.01 N -ATOM 1468 CA LEU A 210 44.150 39.791 53.975 1.00 16.22 C -ATOM 1469 C LEU A 210 43.758 39.469 55.432 1.00 16.11 C -ATOM 1470 O LEU A 210 42.593 39.391 55.823 1.00 16.56 O -ATOM 1471 CB LEU A 210 43.540 41.143 53.518 1.00 18.02 C -ATOM 1472 CG LEU A 210 44.065 42.433 54.201 1.00 21.65 C -ATOM 1473 CD1 LEU A 210 45.570 42.555 53.951 1.00 22.49 C -ATOM 1474 CD2 LEU A 210 43.335 43.663 53.655 1.00 21.54 C -ATOM 1475 N VAL A 211 44.793 39.255 56.242 1.00 16.99 N -ATOM 1476 CA VAL A 211 44.675 38.906 57.646 1.00 19.04 C -ATOM 1477 C VAL A 211 45.700 39.779 58.367 1.00 18.36 C -ATOM 1478 O VAL A 211 46.889 39.687 58.062 1.00 18.05 O -ATOM 1479 CB VAL A 211 45.020 37.417 57.848 1.00 22.08 C -ATOM 1480 CG1 VAL A 211 45.077 37.062 59.313 1.00 23.93 C -ATOM 1481 CG2 VAL A 211 43.955 36.568 57.209 1.00 22.44 C -ATOM 1482 N ASN A 212 45.276 40.627 59.315 1.00 18.74 N -ATOM 1483 CA ASN A 212 46.155 41.475 60.132 1.00 19.98 C -ATOM 1484 C ASN A 212 47.094 42.352 59.310 1.00 17.73 C -ATOM 1485 O ASN A 212 48.302 42.401 59.529 1.00 18.87 O -ATOM 1486 CB ASN A 212 47.006 40.618 61.097 1.00 23.71 C -ATOM 1487 CG ASN A 212 46.182 39.752 62.055 1.00 29.76 C -ATOM 1488 OD1 ASN A 212 46.465 38.561 62.278 1.00 32.63 O -ATOM 1489 ND2 ASN A 212 45.134 40.342 62.634 1.00 31.27 N -ATOM 1490 N GLY A 213 46.493 42.964 58.294 1.00 14.91 N -ATOM 1491 CA GLY A 213 47.178 43.897 57.444 1.00 11.87 C -ATOM 1492 C GLY A 213 48.185 43.275 56.525 1.00 14.76 C -ATOM 1493 O GLY A 213 48.959 43.999 55.912 1.00 15.07 O -ATOM 1494 N GLN A 214 48.179 41.950 56.359 1.00 14.17 N -ATOM 1495 CA GLN A 214 49.205 41.263 55.586 1.00 15.43 C -ATOM 1496 C GLN A 214 48.533 40.284 54.615 1.00 14.62 C -ATOM 1497 O GLN A 214 47.610 39.603 55.041 1.00 14.30 O -ATOM 1498 CB GLN A 214 50.066 40.555 56.605 1.00 15.94 C -ATOM 1499 CG GLN A 214 51.264 39.860 56.048 1.00 19.80 C -ATOM 1500 CD GLN A 214 52.128 39.170 57.107 1.00 20.39 C -ATOM 1501 OE1 GLN A 214 53.320 39.473 57.259 1.00 24.35 O -ATOM 1502 NE2 GLN A 214 51.558 38.197 57.822 1.00 22.43 N -ATOM 1503 N TYR A 215 48.833 40.202 53.315 1.00 14.11 N -ATOM 1504 CA TYR A 215 48.265 39.149 52.483 1.00 13.61 C -ATOM 1505 C TYR A 215 48.968 37.829 52.723 1.00 12.39 C -ATOM 1506 O TYR A 215 50.180 37.793 52.619 1.00 14.64 O -ATOM 1507 CB TYR A 215 48.425 39.498 51.061 1.00 14.44 C -ATOM 1508 CG TYR A 215 47.258 40.356 50.629 1.00 17.88 C -ATOM 1509 CD1 TYR A 215 46.036 39.744 50.371 1.00 16.16 C -ATOM 1510 CD2 TYR A 215 47.408 41.735 50.451 1.00 21.97 C -ATOM 1511 CE1 TYR A 215 44.961 40.494 49.925 1.00 19.19 C -ATOM 1512 CE2 TYR A 215 46.325 42.500 50.006 1.00 24.30 C -ATOM 1513 CZ TYR A 215 45.117 41.856 49.746 1.00 24.11 C -ATOM 1514 OH TYR A 215 44.033 42.565 49.282 1.00 30.65 O -ATOM 1515 N ALA A 216 48.285 36.763 53.100 1.00 11.17 N -ATOM 1516 CA ALA A 216 48.944 35.488 53.251 1.00 8.90 C -ATOM 1517 C ALA A 216 48.295 34.521 52.289 1.00 9.12 C -ATOM 1518 O ALA A 216 47.155 34.705 51.878 1.00 6.94 O -ATOM 1519 CB ALA A 216 48.780 34.987 54.667 1.00 9.71 C -ATOM 1520 N VAL A 217 49.005 33.475 51.896 1.00 9.17 N -ATOM 1521 CA VAL A 217 48.483 32.483 50.937 1.00 9.15 C -ATOM 1522 C VAL A 217 47.743 31.400 51.731 1.00 8.85 C -ATOM 1523 O VAL A 217 48.356 30.558 52.388 1.00 10.09 O -ATOM 1524 CB VAL A 217 49.665 31.869 50.140 1.00 12.18 C -ATOM 1525 CG1 VAL A 217 49.106 30.837 49.159 1.00 11.76 C -ATOM 1526 CG2 VAL A 217 50.492 32.965 49.462 1.00 10.13 C -ATOM 1527 N HIS A 218 46.408 31.436 51.679 1.00 7.84 N -ATOM 1528 CA HIS A 218 45.553 30.528 52.425 1.00 7.30 C -ATOM 1529 C HIS A 218 45.050 29.356 51.584 1.00 8.46 C -ATOM 1530 O HIS A 218 44.526 28.366 52.131 1.00 8.23 O -ATOM 1531 CB HIS A 218 44.340 31.284 52.967 1.00 8.92 C -ATOM 1532 CG HIS A 218 44.628 32.019 54.279 1.00 10.64 C -ATOM 1533 ND1 HIS A 218 44.180 31.691 55.493 1.00 10.75 N -ATOM 1534 CD2 HIS A 218 45.483 33.092 54.419 1.00 14.34 C -ATOM 1535 CE1 HIS A 218 44.743 32.506 56.359 1.00 14.78 C -ATOM 1536 NE2 HIS A 218 45.531 33.354 55.706 1.00 12.41 N -ATOM 1537 N GLY A 219 45.180 29.445 50.250 1.00 7.23 N -ATOM 1538 CA GLY A 219 44.659 28.367 49.401 1.00 6.28 C -ATOM 1539 C GLY A 219 45.628 27.993 48.288 1.00 5.34 C -ATOM 1540 O GLY A 219 46.475 28.794 47.905 1.00 6.80 O -ATOM 1541 N VAL A 220 45.573 26.746 47.822 1.00 7.32 N -ATOM 1542 CA VAL A 220 46.273 26.292 46.615 1.00 5.62 C -ATOM 1543 C VAL A 220 45.097 25.897 45.701 1.00 6.97 C -ATOM 1544 O VAL A 220 44.303 25.011 46.059 1.00 5.93 O -ATOM 1545 CB VAL A 220 47.187 25.074 46.930 1.00 6.49 C -ATOM 1546 CG1 VAL A 220 47.723 24.488 45.651 1.00 7.98 C -ATOM 1547 CG2 VAL A 220 48.425 25.493 47.714 1.00 7.83 C -ATOM 1548 N THR A 221 44.896 26.517 44.525 1.00 6.24 N -ATOM 1549 CA THR A 221 43.697 26.257 43.694 1.00 7.32 C -ATOM 1550 C THR A 221 43.632 24.790 43.246 1.00 7.97 C -ATOM 1551 O THR A 221 44.609 24.220 42.746 1.00 8.36 O -ATOM 1552 CB THR A 221 43.699 27.186 42.439 1.00 9.07 C -ATOM 1553 OG1 THR A 221 43.998 28.538 42.827 1.00 9.53 O -ATOM 1554 CG2 THR A 221 42.359 27.127 41.752 1.00 5.81 C -ATOM 1555 N SER A 222 42.478 24.167 43.465 1.00 8.65 N -ATOM 1556 CA SER A 222 42.342 22.742 43.256 1.00 9.57 C -ATOM 1557 C SER A 222 41.283 22.365 42.225 1.00 9.40 C -ATOM 1558 O SER A 222 41.618 21.664 41.264 1.00 11.94 O -ATOM 1559 CB SER A 222 42.014 22.028 44.615 1.00 10.44 C -ATOM 1560 OG SER A 222 41.964 20.601 44.518 1.00 7.17 O -ATOM 1561 N PHE A 223 40.015 22.755 42.350 1.00 8.26 N -ATOM 1562 CA PHE A 223 39.055 22.358 41.358 1.00 9.14 C -ATOM 1563 C PHE A 223 37.867 23.321 41.302 1.00 10.35 C -ATOM 1564 O PHE A 223 37.628 24.147 42.198 1.00 9.64 O -ATOM 1565 CB PHE A 223 38.609 20.871 41.646 1.00 11.15 C -ATOM 1566 CG PHE A 223 37.853 20.540 42.948 1.00 11.44 C -ATOM 1567 CD1 PHE A 223 36.468 20.640 42.988 1.00 10.26 C -ATOM 1568 CD2 PHE A 223 38.546 20.139 44.094 1.00 12.61 C -ATOM 1569 CE1 PHE A 223 35.764 20.354 44.151 1.00 9.32 C -ATOM 1570 CE2 PHE A 223 37.825 19.861 45.254 1.00 9.67 C -ATOM 1571 CZ PHE A 223 36.444 19.968 45.285 1.00 9.35 C -ATOM 1572 N VAL A 224 37.205 23.238 40.143 1.00 7.66 N -ATOM 1573 CA VAL A 224 35.974 23.926 39.837 1.00 8.11 C -ATOM 1574 C VAL A 224 34.993 22.874 39.315 1.00 8.11 C -ATOM 1575 O VAL A 224 35.315 21.698 39.126 1.00 9.71 O -ATOM 1576 CB VAL A 224 36.170 25.046 38.756 1.00 8.31 C -ATOM 1577 CG1 VAL A 224 36.999 26.192 39.339 1.00 8.77 C -ATOM 1578 CG2 VAL A 224 36.889 24.517 37.531 1.00 10.84 C -ATOM 1579 N SER A 225 33.761 23.296 39.101 1.00 10.38 N -ATOM 1580 CA SER A 225 32.715 22.444 38.562 1.00 12.28 C -ATOM 1581 C SER A 225 33.063 21.936 37.174 1.00 14.77 C -ATOM 1582 O SER A 225 33.660 22.645 36.369 1.00 12.00 O -ATOM 1583 CB SER A 225 31.448 23.248 38.492 1.00 14.44 C -ATOM 1584 OG SER A 225 30.392 22.488 37.935 1.00 13.00 O -ATOM 1585 N ARG A 226 32.699 20.687 36.902 1.00 17.12 N -ATOM 1586 CA ARG A 226 32.858 20.143 35.565 1.00 18.88 C -ATOM 1587 C ARG A 226 31.826 20.845 34.693 1.00 18.19 C -ATOM 1588 O ARG A 226 32.024 20.845 33.488 1.00 19.46 O -ATOM 1589 CB AARG A 226 32.636 18.611 35.532 0.50 18.28 C -ATOM 1590 CB BARG A 226 32.590 18.632 35.482 0.50 18.93 C -ATOM 1591 CG AARG A 226 31.274 18.031 35.871 0.50 19.97 C -ATOM 1592 CG BARG A 226 31.198 18.143 35.851 0.50 21.01 C -ATOM 1593 CD AARG A 226 31.123 16.550 35.440 0.50 21.61 C -ATOM 1594 CD BARG A 226 30.827 16.839 35.111 0.50 23.47 C -ATOM 1595 NE AARG A 226 29.720 16.126 35.490 0.50 19.41 N -ATOM 1596 NE BARG A 226 29.972 15.985 35.932 0.50 20.33 N -ATOM 1597 CZ AARG A 226 28.822 16.412 34.535 0.50 19.53 C -ATOM 1598 CZ BARG A 226 30.508 15.244 36.903 0.50 19.45 C -ATOM 1599 NH1AARG A 226 29.112 17.100 33.426 0.50 18.71 N -ATOM 1600 NH1BARG A 226 31.826 15.276 37.111 0.50 22.46 N -ATOM 1601 NH2AARG A 226 27.558 16.055 34.720 0.50 20.95 N -ATOM 1602 NH2BARG A 226 29.738 14.534 37.714 0.50 11.80 N -ATOM 1603 N LEU A 227 30.761 21.462 35.235 1.00 17.41 N -ATOM 1604 CA LEU A 227 29.799 22.189 34.417 1.00 18.32 C -ATOM 1605 C LEU A 227 30.280 23.526 33.867 1.00 19.58 C -ATOM 1606 O LEU A 227 29.765 24.026 32.857 1.00 21.27 O -ATOM 1607 CB LEU A 227 28.570 22.446 35.200 1.00 19.76 C -ATOM 1608 CG LEU A 227 27.946 21.156 35.747 1.00 24.84 C -ATOM 1609 CD1 LEU A 227 26.872 21.537 36.753 1.00 27.60 C -ATOM 1610 CD2 LEU A 227 27.428 20.276 34.617 1.00 23.53 C -ATOM 1611 N GLY A 228 31.285 24.109 34.509 1.00 16.77 N -ATOM 1612 CA GLY A 228 31.799 25.392 34.104 1.00 13.99 C -ATOM 1613 C GLY A 228 32.636 25.950 35.224 1.00 10.47 C -ATOM 1614 O GLY A 228 32.480 25.567 36.365 1.00 10.66 O -ATOM 1615 N CYS A 229 33.551 26.837 34.870 1.00 10.47 N -ATOM 1616 CA CYS A 229 34.368 27.501 35.845 1.00 9.12 C -ATOM 1617 C CYS A 229 33.579 28.478 36.699 1.00 9.74 C -ATOM 1618 O CYS A 229 33.635 28.351 37.904 1.00 11.86 O -ATOM 1619 CB CYS A 229 35.461 28.201 35.116 1.00 5.24 C -ATOM 1620 SG CYS A 229 36.647 27.064 34.364 1.00 9.50 S -ATOM 1621 N ASN A 230 32.806 29.430 36.175 1.00 12.90 N -ATOM 1622 CA ASN A 230 32.052 30.403 36.965 1.00 11.67 C -ATOM 1623 C ASN A 230 30.624 29.969 37.036 1.00 13.70 C -ATOM 1624 O ASN A 230 29.784 30.262 36.200 1.00 18.68 O -ATOM 1625 CB ASN A 230 32.150 31.779 36.328 1.00 12.51 C -ATOM 1626 CG ASN A 230 31.776 31.810 34.847 1.00 14.26 C -ATOM 1627 OD1 ASN A 230 32.319 31.047 34.041 1.00 13.98 O -ATOM 1628 ND2 ASN A 230 30.828 32.648 34.433 1.00 14.78 N -ATOM 1629 N VAL A 231 30.309 29.176 38.027 1.00 15.22 N -ATOM 1630 CA VAL A 231 28.962 28.665 38.205 1.00 17.57 C -ATOM 1631 C VAL A 231 28.460 29.105 39.581 1.00 18.17 C -ATOM 1632 O VAL A 231 29.160 29.026 40.604 1.00 18.32 O -ATOM 1633 CB VAL A 231 29.033 27.119 38.028 1.00 18.26 C -ATOM 1634 CG1 VAL A 231 27.718 26.430 38.416 1.00 19.20 C -ATOM 1635 CG2 VAL A 231 29.253 26.822 36.552 1.00 18.38 C -ATOM 1636 N THR A 232 27.252 29.684 39.547 1.00 19.07 N -ATOM 1637 CA THR A 232 26.557 30.130 40.750 1.00 22.11 C -ATOM 1638 C THR A 232 26.427 28.953 41.724 1.00 21.83 C -ATOM 1639 O THR A 232 26.035 27.833 41.361 1.00 21.80 O -ATOM 1640 CB THR A 232 25.152 30.674 40.380 1.00 23.60 C -ATOM 1641 OG1 THR A 232 25.324 31.816 39.534 1.00 26.85 O -ATOM 1642 CG2 THR A 232 24.377 31.112 41.603 1.00 26.52 C -ATOM 1643 N ARG A 233 26.805 29.244 42.976 1.00 20.88 N -ATOM 1644 CA ARG A 233 26.821 28.277 44.076 1.00 21.90 C -ATOM 1645 C ARG A 233 27.770 27.111 43.913 1.00 19.36 C -ATOM 1646 O ARG A 233 27.629 26.100 44.590 1.00 18.62 O -ATOM 1647 CB ARG A 233 25.423 27.699 44.343 1.00 25.56 C -ATOM 1648 CG ARG A 233 24.583 28.792 44.884 1.00 29.13 C -ATOM 1649 CD ARG A 233 23.164 28.370 45.144 1.00 37.78 C -ATOM 1650 NE ARG A 233 22.633 29.481 45.910 1.00 47.82 N -ATOM 1651 CZ ARG A 233 22.098 30.584 45.350 1.00 53.44 C -ATOM 1652 NH1 ARG A 233 21.979 30.739 44.010 1.00 54.84 N -ATOM 1653 NH2 ARG A 233 21.777 31.606 46.168 1.00 56.42 N -ATOM 1654 N LYS A 234 28.756 27.231 43.015 1.00 16.50 N -ATOM 1655 CA LYS A 234 29.833 26.254 42.974 1.00 14.24 C -ATOM 1656 C LYS A 234 31.094 27.079 43.073 1.00 12.98 C -ATOM 1657 O LYS A 234 31.812 27.264 42.098 1.00 11.14 O -ATOM 1658 CB LYS A 234 29.881 25.453 41.686 1.00 13.88 C -ATOM 1659 CG LYS A 234 28.765 24.457 41.559 1.00 20.97 C -ATOM 1660 CD LYS A 234 29.059 23.243 42.404 1.00 24.77 C -ATOM 1661 CE LYS A 234 27.987 22.184 42.249 1.00 31.09 C -ATOM 1662 NZ LYS A 234 26.726 22.697 42.765 1.00 35.24 N -ATOM 1663 N PRO A 235 31.448 27.607 44.239 1.00 12.98 N -ATOM 1664 CA PRO A 235 32.662 28.391 44.392 1.00 11.47 C -ATOM 1665 C PRO A 235 33.895 27.618 44.007 1.00 10.04 C -ATOM 1666 O PRO A 235 33.837 26.388 43.918 1.00 9.33 O -ATOM 1667 CB PRO A 235 32.591 28.818 45.835 1.00 11.41 C -ATOM 1668 CG PRO A 235 31.722 27.811 46.523 1.00 13.56 C -ATOM 1669 CD PRO A 235 30.701 27.457 45.487 1.00 11.50 C -ATOM 1670 N THR A 236 34.982 28.324 43.701 1.00 7.10 N -ATOM 1671 CA THR A 236 36.247 27.684 43.400 1.00 7.02 C -ATOM 1672 C THR A 236 36.744 27.023 44.699 1.00 8.02 C -ATOM 1673 O THR A 236 36.590 27.597 45.793 1.00 7.37 O -ATOM 1674 CB THR A 236 37.265 28.728 42.925 1.00 5.25 C -ATOM 1675 OG1 THR A 236 36.707 29.407 41.795 1.00 8.21 O -ATOM 1676 CG2 THR A 236 38.580 28.104 42.538 1.00 2.88 C -ATOM 1677 N VAL A 237 37.346 25.819 44.586 1.00 6.84 N -ATOM 1678 CA VAL A 237 37.793 25.077 45.766 1.00 7.14 C -ATOM 1679 C VAL A 237 39.310 24.989 45.794 1.00 7.29 C -ATOM 1680 O VAL A 237 39.975 24.661 44.795 1.00 7.33 O -ATOM 1681 CB VAL A 237 37.184 23.639 45.789 1.00 7.85 C -ATOM 1682 CG1 VAL A 237 37.542 22.927 47.128 1.00 8.17 C -ATOM 1683 CG2 VAL A 237 35.682 23.721 45.640 1.00 9.59 C -ATOM 1684 N PHE A 238 39.836 25.268 47.011 1.00 7.55 N -ATOM 1685 CA PHE A 238 41.248 25.374 47.286 1.00 5.97 C -ATOM 1686 C PHE A 238 41.704 24.385 48.358 1.00 6.46 C -ATOM 1687 O PHE A 238 40.933 24.045 49.248 1.00 8.93 O -ATOM 1688 CB PHE A 238 41.577 26.786 47.779 1.00 7.26 C -ATOM 1689 CG PHE A 238 41.203 27.888 46.803 1.00 7.68 C -ATOM 1690 CD1 PHE A 238 39.888 28.361 46.738 1.00 8.41 C -ATOM 1691 CD2 PHE A 238 42.187 28.379 45.927 1.00 5.27 C -ATOM 1692 CE1 PHE A 238 39.554 29.319 45.788 1.00 6.40 C -ATOM 1693 CE2 PHE A 238 41.836 29.339 44.976 1.00 5.48 C -ATOM 1694 CZ PHE A 238 40.528 29.801 44.914 1.00 6.98 C -ATOM 1695 N THR A 239 42.930 23.878 48.300 1.00 5.52 N -ATOM 1696 CA THR A 239 43.525 23.120 49.397 1.00 6.64 C -ATOM 1697 C THR A 239 43.773 24.150 50.507 1.00 7.11 C -ATOM 1698 O THR A 239 44.362 25.190 50.204 1.00 7.28 O -ATOM 1699 CB THR A 239 44.839 22.513 48.957 1.00 5.02 C -ATOM 1700 OG1 THR A 239 44.467 21.693 47.867 1.00 7.25 O -ATOM 1701 CG2 THR A 239 45.551 21.690 49.984 1.00 8.52 C -ATOM 1702 N ARG A 240 43.355 23.877 51.761 1.00 7.86 N -ATOM 1703 CA ARG A 240 43.561 24.827 52.848 1.00 6.80 C -ATOM 1704 C ARG A 240 44.978 24.704 53.338 1.00 7.30 C -ATOM 1705 O ARG A 240 45.380 23.731 53.990 1.00 10.68 O -ATOM 1706 CB ARG A 240 42.520 24.564 53.993 1.00 8.62 C -ATOM 1707 CG ARG A 240 42.716 25.564 55.145 1.00 8.87 C -ATOM 1708 CD ARG A 240 41.536 25.653 56.067 1.00 8.61 C -ATOM 1709 NE ARG A 240 41.221 24.374 56.687 1.00 11.56 N -ATOM 1710 CZ ARG A 240 41.903 23.795 57.693 1.00 9.55 C -ATOM 1711 NH1 ARG A 240 42.978 24.334 58.250 1.00 8.42 N -ATOM 1712 NH2 ARG A 240 41.432 22.638 58.178 1.00 8.69 N -ATOM 1713 N VAL A 241 45.804 25.730 53.047 1.00 6.78 N -ATOM 1714 CA VAL A 241 47.224 25.673 53.358 1.00 7.67 C -ATOM 1715 C VAL A 241 47.477 25.524 54.872 1.00 7.96 C -ATOM 1716 O VAL A 241 48.393 24.794 55.248 1.00 7.52 O -ATOM 1717 CB VAL A 241 47.932 26.945 52.800 1.00 8.15 C -ATOM 1718 CG1 VAL A 241 49.359 27.081 53.289 1.00 5.92 C -ATOM 1719 CG2 VAL A 241 47.919 26.850 51.265 1.00 6.16 C -ATOM 1720 N SER A 242 46.633 26.129 55.732 1.00 6.90 N -ATOM 1721 CA SER A 242 46.862 26.061 57.180 1.00 9.87 C -ATOM 1722 C SER A 242 46.687 24.647 57.739 1.00 11.50 C -ATOM 1723 O SER A 242 47.135 24.390 58.850 1.00 10.55 O -ATOM 1724 CB SER A 242 45.909 27.017 57.926 1.00 6.38 C -ATOM 1725 OG SER A 242 44.558 26.626 57.971 1.00 7.15 O -ATOM 1726 N ALA A 243 46.080 23.711 56.973 1.00 11.57 N -ATOM 1727 CA ALA A 243 45.964 22.335 57.399 1.00 11.12 C -ATOM 1728 C ALA A 243 47.248 21.578 57.116 1.00 11.17 C -ATOM 1729 O ALA A 243 47.410 20.456 57.591 1.00 13.38 O -ATOM 1730 CB ALA A 243 44.809 21.659 56.669 1.00 8.87 C -ATOM 1731 N TYR A 244 48.231 22.171 56.442 1.00 8.71 N -ATOM 1732 CA TYR A 244 49.429 21.466 56.001 1.00 9.59 C -ATOM 1733 C TYR A 244 50.741 22.034 56.457 1.00 9.55 C -ATOM 1734 O TYR A 244 51.796 21.637 55.969 1.00 10.53 O -ATOM 1735 CB TYR A 244 49.437 21.389 54.445 1.00 9.85 C -ATOM 1736 CG TYR A 244 48.266 20.543 53.912 1.00 11.66 C -ATOM 1737 CD1 TYR A 244 48.373 19.146 53.905 1.00 11.24 C -ATOM 1738 CD2 TYR A 244 47.065 21.160 53.517 1.00 8.56 C -ATOM 1739 CE1 TYR A 244 47.283 18.375 53.511 1.00 9.19 C -ATOM 1740 CE2 TYR A 244 45.975 20.388 53.133 1.00 6.79 C -ATOM 1741 CZ TYR A 244 46.101 19.005 53.137 1.00 8.12 C -ATOM 1742 OH TYR A 244 45.004 18.234 52.809 1.00 10.18 O -ATOM 1743 N ILE A 245 50.728 22.928 57.441 1.00 11.15 N -ATOM 1744 CA ILE A 245 51.951 23.617 57.834 1.00 11.13 C -ATOM 1745 C ILE A 245 53.013 22.684 58.391 1.00 10.97 C -ATOM 1746 O ILE A 245 54.177 22.828 58.026 1.00 11.37 O -ATOM 1747 CB ILE A 245 51.557 24.735 58.842 1.00 9.25 C -ATOM 1748 CG1 ILE A 245 50.595 25.722 58.155 1.00 10.37 C -ATOM 1749 CG2 ILE A 245 52.831 25.389 59.412 1.00 10.03 C -ATOM 1750 CD1 ILE A 245 51.125 26.399 56.881 1.00 11.86 C -ATOM 1751 N SER A 246 52.652 21.695 59.223 1.00 12.45 N -ATOM 1752 CA SER A 246 53.628 20.737 59.730 1.00 11.85 C -ATOM 1753 C SER A 246 54.232 19.877 58.649 1.00 11.14 C -ATOM 1754 O SER A 246 55.438 19.646 58.683 1.00 13.26 O -ATOM 1755 CB SER A 246 52.986 19.821 60.742 1.00 17.42 C -ATOM 1756 OG SER A 246 52.876 20.618 61.884 1.00 25.47 O -ATOM 1757 N TRP A 247 53.436 19.436 57.656 1.00 11.38 N -ATOM 1758 CA TRP A 247 53.987 18.615 56.574 1.00 10.46 C -ATOM 1759 C TRP A 247 54.981 19.446 55.762 1.00 12.43 C -ATOM 1760 O TRP A 247 56.126 19.023 55.545 1.00 10.24 O -ATOM 1761 CB TRP A 247 52.812 18.090 55.707 1.00 10.33 C -ATOM 1762 CG TRP A 247 53.261 17.313 54.467 1.00 14.12 C -ATOM 1763 CD1 TRP A 247 53.714 16.023 54.550 1.00 15.22 C -ATOM 1764 CD2 TRP A 247 53.360 17.829 53.179 1.00 14.99 C -ATOM 1765 NE1 TRP A 247 54.129 15.729 53.320 1.00 15.11 N -ATOM 1766 CE2 TRP A 247 53.946 16.760 52.474 1.00 14.91 C -ATOM 1767 CE3 TRP A 247 53.042 19.022 52.516 1.00 15.78 C -ATOM 1768 CZ2 TRP A 247 54.234 16.862 51.111 1.00 13.51 C -ATOM 1769 CZ3 TRP A 247 53.332 19.115 51.144 1.00 16.23 C -ATOM 1770 CH2 TRP A 247 53.922 18.049 50.455 1.00 16.23 C -ATOM 1771 N ILE A 248 54.572 20.698 55.405 1.00 13.24 N -ATOM 1772 CA ILE A 248 55.437 21.603 54.640 1.00 13.46 C -ATOM 1773 C ILE A 248 56.740 21.840 55.356 1.00 13.85 C -ATOM 1774 O ILE A 248 57.794 21.685 54.756 1.00 15.18 O -ATOM 1775 CB ILE A 248 54.751 22.959 54.394 1.00 11.46 C -ATOM 1776 CG1 ILE A 248 53.573 22.727 53.471 1.00 10.52 C -ATOM 1777 CG2 ILE A 248 55.735 23.964 53.791 1.00 13.13 C -ATOM 1778 CD1 ILE A 248 52.650 23.931 53.358 1.00 13.12 C -ATOM 1779 N ASN A 249 56.708 22.167 56.643 1.00 15.66 N -ATOM 1780 CA ASN A 249 57.966 22.361 57.335 1.00 18.53 C -ATOM 1781 C ASN A 249 58.814 21.119 57.539 1.00 16.43 C -ATOM 1782 O ASN A 249 60.031 21.260 57.491 1.00 17.80 O -ATOM 1783 CB ASN A 249 57.724 23.020 58.681 1.00 21.46 C -ATOM 1784 CG ASN A 249 57.244 24.449 58.519 1.00 22.86 C -ATOM 1785 OD1 ASN A 249 56.449 24.895 59.330 1.00 29.97 O -ATOM 1786 ND2 ASN A 249 57.638 25.244 57.531 1.00 26.91 N -ATOM 1787 N ASN A 250 58.213 19.930 57.696 1.00 16.83 N -ATOM 1788 CA ASN A 250 58.941 18.651 57.807 1.00 16.47 C -ATOM 1789 C ASN A 250 59.611 18.253 56.486 1.00 16.56 C -ATOM 1790 O ASN A 250 60.651 17.609 56.494 1.00 16.74 O -ATOM 1791 CB ASN A 250 57.970 17.526 58.243 1.00 13.56 C -ATOM 1792 CG ASN A 250 57.466 17.622 59.681 1.00 15.43 C -ATOM 1793 OD1 ASN A 250 56.398 17.164 60.074 1.00 18.41 O -ATOM 1794 ND2 ASN A 250 58.233 18.199 60.557 1.00 14.31 N -ATOM 1795 N VAL A 251 59.059 18.618 55.314 1.00 17.64 N -ATOM 1796 CA VAL A 251 59.696 18.335 54.019 1.00 16.18 C -ATOM 1797 C VAL A 251 60.857 19.283 53.790 1.00 17.67 C -ATOM 1798 O VAL A 251 61.933 18.839 53.397 1.00 18.03 O -ATOM 1799 CB VAL A 251 58.690 18.486 52.860 1.00 15.59 C -ATOM 1800 CG1 VAL A 251 59.319 18.240 51.489 1.00 12.59 C -ATOM 1801 CG2 VAL A 251 57.588 17.488 53.087 1.00 13.13 C -ATOM 1802 N ILE A 252 60.702 20.573 54.053 1.00 19.04 N -ATOM 1803 CA ILE A 252 61.769 21.530 53.775 1.00 25.61 C -ATOM 1804 C ILE A 252 63.003 21.300 54.650 1.00 29.58 C -ATOM 1805 O ILE A 252 64.137 21.321 54.168 1.00 31.98 O -ATOM 1806 CB ILE A 252 61.160 22.946 53.947 1.00 25.94 C -ATOM 1807 CG1 ILE A 252 60.223 23.219 52.786 1.00 26.02 C -ATOM 1808 CG2 ILE A 252 62.248 24.007 53.990 1.00 28.18 C -ATOM 1809 CD1 ILE A 252 59.431 24.496 53.108 1.00 31.12 C -ATOM 1810 N ALA A 253 62.773 21.069 55.941 1.00 33.64 N -ATOM 1811 CA ALA A 253 63.826 20.729 56.888 1.00 39.90 C -ATOM 1812 C ALA A 253 64.486 19.356 56.643 1.00 44.78 C -ATOM 1813 O ALA A 253 65.631 19.154 57.073 1.00 46.42 O -ATOM 1814 CB ALA A 253 63.273 20.715 58.302 1.00 37.88 C -ATOM 1815 N SER A 254 63.845 18.359 55.999 1.00 48.99 N -ATOM 1816 CA SER A 254 64.540 17.101 55.772 1.00 52.68 C -ATOM 1817 C SER A 254 65.070 16.922 54.351 1.00 55.19 C -ATOM 1818 O SER A 254 65.847 15.987 54.133 1.00 56.64 O -ATOM 1819 CB SER A 254 63.621 15.919 56.142 1.00 53.68 C -ATOM 1820 OG SER A 254 62.413 15.811 55.394 1.00 55.52 O -ATOM 1821 N ASN A 255 64.721 17.786 53.381 1.00 57.18 N -ATOM 1822 CA ASN A 255 65.204 17.656 52.004 1.00 59.60 C -ATOM 1823 C ASN A 255 66.166 18.765 51.639 1.00 60.68 C -ATOM 1824 O ASN A 255 65.878 19.922 51.956 1.00 63.35 O -ATOM 1825 CB ASN A 255 64.083 17.715 50.981 1.00 60.00 C -ATOM 1826 CG ASN A 255 63.104 16.556 51.026 1.00 60.85 C -ATOM 1827 OD1 ASN A 255 63.035 15.771 50.087 1.00 61.78 O -ATOM 1828 ND2 ASN A 255 62.301 16.382 52.075 1.00 60.59 N -ATOM 1829 OXT ASN A 255 67.187 18.458 51.029 1.00 62.36 O -TER 1830 ASN A 255 -HETATM 1831 CA CA A 280 57.314 37.378 30.072 1.00 20.84 CA -HETATM 1832 S SO4 A 290 43.528 21.842 61.312 1.00 42.65 S -HETATM 1833 O1 SO4 A 290 43.862 22.938 60.486 1.00 41.10 O -HETATM 1834 O2 SO4 A 290 44.637 20.950 61.397 1.00 43.95 O -HETATM 1835 O3 SO4 A 290 42.382 21.153 60.795 1.00 41.19 O -HETATM 1836 O4 SO4 A 290 43.258 22.304 62.628 1.00 44.27 O -HETATM 1837 C1 0QH A 256 41.149 23.354 37.644 1.00 31.55 C -HETATM 1838 C2 0QH A 256 41.347 24.616 38.562 1.00 29.79 C -HETATM 1839 O 0QH A 256 40.738 23.466 36.483 1.00 31.48 O -HETATM 1840 F1 0QH A 256 41.871 24.392 39.754 1.00 30.45 F -HETATM 1841 F2 0QH A 256 42.130 25.537 38.058 1.00 27.87 F -HETATM 1842 F3 0QH A 256 40.210 25.231 38.787 1.00 30.74 F -HETATM 1843 N 0QH A 256 41.428 22.136 38.149 1.00 32.72 N -HETATM 1844 CA 0QH A 256 40.800 20.919 37.702 1.00 35.06 C -HETATM 1845 C 0QH A 256 39.307 21.048 37.435 1.00 37.47 C -HETATM 1846 O1 0QH A 256 38.514 21.565 38.211 1.00 36.15 O -HETATM 1847 CB 0QH A 256 41.100 19.869 38.747 1.00 34.44 C -HETATM 1848 CG 0QH A 256 41.280 18.443 38.288 1.00 36.76 C -HETATM 1849 CD1 0QH A 256 42.225 18.333 37.087 1.00 36.80 C -HETATM 1850 CD2 0QH A 256 41.811 17.676 39.479 1.00 38.25 C -HETATM 1851 N1 0QH A 256 37.773 20.686 35.406 1.00 44.05 N -HETATM 1852 N2 0QH A 256 39.121 20.568 36.190 1.00 41.52 N -HETATM 1853 C3 0QH A 256 37.712 22.117 34.940 1.00 46.64 C -HETATM 1854 C11 0QH A 256 36.522 22.554 34.080 1.00 51.49 C -HETATM 1855 C21 0QH A 256 35.753 23.641 34.490 1.00 50.39 C -HETATM 1856 C31 0QH A 256 34.724 24.077 33.677 1.00 52.00 C -HETATM 1857 C4 0QH A 256 34.426 23.461 32.459 1.00 53.48 C -HETATM 1858 C5 0QH A 256 35.179 22.373 32.039 1.00 54.08 C -HETATM 1859 C6 0QH A 256 36.225 21.923 32.850 1.00 54.40 C -HETATM 1860 C1M 0QH A 256 38.160 19.713 34.316 1.00 46.35 C -HETATM 1861 CA2 0QH A 256 36.531 20.238 36.106 1.00 42.79 C -HETATM 1862 CA1 0QH A 256 36.544 18.892 36.812 1.00 41.97 C -HETATM 1863 O2 0QH A 256 36.668 17.792 36.251 1.00 40.89 O -HETATM 1864 C12 0QH A 256 36.195 18.351 39.070 1.00 41.34 C -HETATM 1865 N11 0QH A 256 36.432 19.241 38.103 1.00 41.27 N -HETATM 1866 C22 0QH A 256 36.820 17.094 39.138 1.00 41.18 C -HETATM 1867 C32 0QH A 256 36.529 16.229 40.207 1.00 42.70 C -HETATM 1868 C41 0QH A 256 35.613 16.613 41.216 1.00 40.91 C -HETATM 1869 C51 0QH A 256 35.007 17.872 41.125 1.00 42.28 C -HETATM 1870 C61 0QH A 256 35.290 18.723 40.059 1.00 41.35 C -HETATM 1871 C1' 0QH A 256 35.273 15.697 42.414 1.00 38.52 C -HETATM 1872 C2' 0QH A 256 35.742 14.242 42.251 1.00 36.76 C -HETATM 1873 C3' 0QH A 256 33.777 15.691 42.501 1.00 38.27 C -HETATM 1874 O HOH A 301 32.882 26.020 39.606 1.00 17.65 O -HETATM 1875 O HOH A 302 32.442 29.522 40.356 1.00 21.49 O -HETATM 1876 O HOH A 303 31.364 32.109 40.271 1.00 14.39 O -HETATM 1877 O HOH A 304 34.013 31.083 41.939 1.00 14.29 O -HETATM 1878 O HOH A 305 35.685 27.451 53.086 1.00 14.08 O -HETATM 1879 O HOH A 306 35.231 24.442 53.127 1.00 28.89 O -HETATM 1880 O HOH A 307 35.490 31.094 55.192 1.00 19.23 O -HETATM 1881 O HOH A 308 39.761 29.106 55.841 1.00 14.63 O -HETATM 1882 O HOH A 309 53.144 39.621 37.336 1.00 26.14 O -HETATM 1883 O HOH A 310 57.464 42.102 35.337 1.00 30.84 O -HETATM 1884 O HOH A 311 56.295 39.174 39.811 1.00 21.08 O -HETATM 1885 O HOH A 312 45.452 30.812 42.008 1.00 6.92 O -HETATM 1886 O HOH A 313 47.449 30.520 39.380 1.00 6.92 O -HETATM 1887 O HOH A 314 48.283 30.372 36.744 1.00 10.12 O -HETATM 1888 O HOH A 315 50.127 28.060 45.624 1.00 9.45 O -HETATM 1889 O HOH A 316 42.549 29.375 56.136 1.00 12.87 O -HETATM 1890 O HOH A 317 45.102 28.273 54.960 1.00 9.55 O -HETATM 1891 O HOH A 318 41.167 18.810 46.507 1.00 11.18 O -HETATM 1892 O HOH A 319 42.862 19.540 48.578 1.00 9.49 O -HETATM 1893 O HOH A 320 42.969 19.206 51.337 1.00 13.03 O -HETATM 1894 O HOH A 321 57.440 35.699 40.935 1.00 14.74 O -HETATM 1895 O HOH A 322 55.936 34.579 38.033 1.00 23.30 O -HETATM 1896 O HOH A 323 52.785 39.989 40.333 1.00 25.89 O -HETATM 1897 O HOH A 324 33.689 36.733 43.984 1.00 22.09 O -HETATM 1898 O HOH A 325 32.752 34.434 42.638 1.00 19.00 O -HETATM 1899 O HOH A 326 61.296 18.059 35.669 1.00 30.78 O -HETATM 1900 O HOH A 327 60.418 37.615 50.653 1.00 26.97 O -HETATM 1901 O HOH A 328 52.092 36.358 50.688 1.00 17.16 O -HETATM 1902 O HOH A 329 32.883 31.561 31.264 1.00 23.33 O -HETATM 1903 O HOH A 330 43.307 12.818 47.113 1.00 10.74 O -HETATM 1904 O HOH A 331 36.720 37.088 32.045 1.00 23.95 O -HETATM 1905 O HOH A 332 43.583 34.271 34.093 1.00 8.71 O -HETATM 1906 O HOH A 333 64.151 38.662 38.603 1.00 17.67 O -HETATM 1907 O HOH A 334 52.858 37.863 46.914 1.00 23.65 O -HETATM 1908 O HOH A 335 50.321 18.976 58.535 1.00 26.76 O -HETATM 1909 O HOH A 336 40.093 37.345 33.628 1.00 25.03 O -HETATM 1910 O HOH A 337 32.158 36.439 33.842 1.00 28.27 O -HETATM 1911 O HOH A 338 54.965 37.964 49.272 1.00 44.50 O -HETATM 1912 O HOH A 339 48.863 37.454 57.934 1.00 30.43 O -HETATM 1913 O HOH A 340 41.448 24.662 62.587 1.00 24.01 O -HETATM 1914 O HOH A 341 61.601 23.704 58.048 1.00 33.41 O -HETATM 1915 O HOH A 342 66.904 32.764 34.214 1.00 30.56 O -HETATM 1916 O HOH A 343 49.238 33.132 26.847 1.00 35.15 O -HETATM 1917 O HOH A 344 47.105 44.440 40.996 1.00 20.82 O -HETATM 1918 O HOH A 345 47.069 22.275 61.044 1.00 31.32 O -HETATM 1919 O HOH A 346 34.646 30.080 59.205 1.00 27.77 O -HETATM 1920 O HOH A 347 43.223 10.806 49.056 1.00 30.40 O -HETATM 1921 O HOH A 348 67.980 25.297 36.489 1.00 28.90 O -HETATM 1922 O HOH A 349 68.279 36.872 47.286 1.00 33.84 O -HETATM 1923 O HOH A 350 52.212 27.533 62.384 1.00 28.11 O -HETATM 1924 O HOH A 351 57.507 31.607 53.559 1.00 40.44 O -HETATM 1925 O HOH A 352 50.195 37.258 48.866 1.00 31.37 O -HETATM 1926 O HOH A 353 64.855 31.038 51.212 1.00 39.73 O -HETATM 1927 O HOH A 354 48.078 43.679 46.695 1.00 44.90 O -HETATM 1928 O HOH A 355 58.415 35.335 29.066 1.00 27.17 O -HETATM 1929 O HOH A 356 45.710 38.988 29.308 1.00 38.47 O -HETATM 1930 O HOH A 357 51.043 14.003 41.579 1.00 21.25 O -HETATM 1931 O HOH A 358 67.908 23.479 45.499 1.00 32.89 O -HETATM 1932 O HOH A 359 61.233 13.914 42.154 1.00 33.27 O -HETATM 1933 O HOH A 360 36.842 25.273 30.915 1.00 13.93 O -HETATM 1934 O HOH A 361 56.471 41.206 37.704 1.00 27.85 O -HETATM 1935 O HOH A 362 44.959 29.044 25.226 1.00 33.57 O -HETATM 1936 O HOH A 363 38.998 33.020 26.805 1.00 20.64 O -HETATM 1937 O HOH A 364 64.429 26.904 30.756 1.00 27.82 O -HETATM 1938 O HOH A 365 49.235 16.475 56.392 1.00 29.93 O -HETATM 1939 O HOH A 366 44.125 17.192 55.905 1.00 39.61 O -HETATM 1940 O HOH A 367 49.797 21.805 60.380 1.00 27.84 O -HETATM 1941 O HOH A 368 50.024 19.785 34.563 1.00 30.97 O -HETATM 1942 O HOH A 369 46.429 32.844 24.842 1.00 41.62 O -HETATM 1943 O HOH A 370 47.931 33.256 60.045 1.00 28.11 O -HETATM 1944 O HOH A 371 41.806 45.255 34.043 1.00 30.30 O -HETATM 1945 O HOH A 372 63.874 21.873 33.271 1.00 41.07 O -HETATM 1946 O HOH A 373 56.782 32.378 30.107 1.00 26.11 O -HETATM 1947 O HOH A 374 47.243 34.732 57.808 1.00 23.62 O -HETATM 1948 O HOH A 375 37.066 28.697 55.048 1.00 34.12 O -HETATM 1949 O HOH A 376 37.249 25.085 56.044 1.00 40.37 O -HETATM 1950 O HOH A 377 28.275 17.000 45.695 1.00 37.97 O -HETATM 1951 O HOH A 378 42.408 40.137 59.903 1.00 44.03 O -HETATM 1952 O HOH A 379 49.251 46.251 34.415 1.00 43.84 O -HETATM 1953 O HOH A 380 54.093 37.592 39.323 1.00 34.41 O -HETATM 1954 O HOH A 381 48.187 22.582 30.415 1.00 39.01 O -HETATM 1955 O HOH A 382 51.483 31.033 26.492 1.00 51.83 O -HETATM 1956 O HOH A 383 56.607 12.499 46.037 1.00 23.19 O -HETATM 1957 O HOH A 384 55.626 11.776 48.780 1.00 40.69 O -HETATM 1958 O HOH A 385 52.534 35.789 59.363 1.00 38.05 O -HETATM 1959 O HOH A 386 35.031 27.253 57.241 1.00 29.30 O -HETATM 1960 O HOH A 387 32.125 31.879 59.654 1.00 34.45 O -HETATM 1961 O HOH A 388 28.198 29.575 58.752 1.00 42.72 O -HETATM 1962 O HOH A 389 45.086 35.683 25.607 1.00 31.08 O -HETATM 1963 O HOH A 390 32.348 34.623 31.387 1.00 31.83 O -HETATM 1964 O HOH A 391 38.765 35.716 59.975 1.00 31.57 O -HETATM 1965 O HOH A 392 44.103 41.461 30.834 1.00 49.81 O -HETATM 1966 O HOH A 393 41.972 15.911 53.072 1.00 32.93 O -HETATM 1967 O HOH A 394 28.002 18.208 53.733 1.00 35.56 O -HETATM 1968 O HOH A 395 44.375 23.297 35.373 1.00 22.03 O -HETATM 1969 O HOH A 396 30.702 31.211 29.539 1.00 51.18 O -HETATM 1970 O HOH A 397 30.494 28.541 32.709 1.00 49.36 O -HETATM 1971 O HOH A 398 56.412 21.054 62.131 1.00 43.25 O -HETATM 1972 O HOH A 399 44.542 44.447 44.699 1.00 48.81 O -HETATM 1973 O HOH A 400 31.898 26.937 58.945 1.00 37.09 O -HETATM 1974 O HOH A 401 37.218 41.186 40.473 1.00 38.21 O -HETATM 1975 O HOH A 402 26.032 29.330 36.708 1.00 41.30 O -HETATM 1976 O HOH A 403 26.133 32.573 45.021 1.00 40.73 O -HETATM 1977 O HOH A 404 55.838 42.729 28.694 1.00 41.47 O -HETATM 1978 O HOH A 405 42.852 35.753 27.210 1.00 41.44 O -HETATM 1979 O HOH A 406 52.225 44.186 55.156 1.00 45.19 O -HETATM 1980 O HOH A 407 41.877 18.854 58.058 1.00 45.51 O -HETATM 1981 O HOH A 408 26.732 21.589 55.886 1.00 47.70 O -HETATM 1982 O HOH A 409 32.690 16.791 53.773 1.00 39.34 O -HETATM 1983 O HOH A 410 58.623 17.123 24.197 1.00 44.44 O -HETATM 1984 O HOH A 411 65.260 20.092 24.330 1.00 37.78 O -HETATM 1985 O HOH A 412 45.751 7.536 49.944 1.00 45.48 O -HETATM 1986 O HOH A 413 57.867 17.562 29.038 1.00 39.83 O -HETATM 1987 O HOH A 414 28.283 22.782 30.998 1.00 43.50 O -HETATM 1988 O HOH A 415 67.326 26.052 33.737 1.00 65.89 O -HETATM 1989 O HOH A 416 58.019 14.849 36.117 1.00 20.44 O -HETATM 1990 O HOH A 417 51.753 33.322 44.908 1.00 39.55 O -HETATM 1991 O HOH A 418 56.671 43.846 45.568 1.00 48.93 O -HETATM 1992 O HOH A 419 39.120 23.034 61.598 1.00 42.00 O -HETATM 1993 O HOH A 420 41.306 15.026 56.005 1.00 47.08 O -HETATM 1994 O HOH A 421 26.653 15.602 48.462 1.00 44.38 O -HETATM 1995 O HOH A 422 25.367 17.571 33.210 1.00 40.94 O -HETATM 1996 O HOH A 423 42.962 20.877 34.581 1.00 39.92 O -HETATM 1997 O HOH A 424 63.325 17.648 23.374 1.00 51.93 O -HETATM 1998 O HOH A 425 51.125 42.005 52.466 1.00 33.24 O -HETATM 1999 O HOH A 426 44.781 6.738 38.029 1.00 35.75 O -HETATM 2000 O HOH A 427 40.801 45.034 42.972 1.00 37.80 O -HETATM 2001 O HOH A 428 41.185 41.488 32.038 1.00 41.78 O -HETATM 2002 O HOH A 429 50.800 44.806 30.573 1.00 46.30 O -HETATM 2003 O HOH A 430 57.885 37.456 52.108 1.00 38.46 O -HETATM 2004 O HOH A 431 22.145 21.543 53.132 1.00 41.38 O -HETATM 2005 O HOH A 432 41.352 34.096 61.758 1.00 45.89 O -HETATM 2006 O HOH A 433 48.397 9.654 43.158 1.00 40.50 O -HETATM 2007 O HOH A 434 42.265 45.255 31.328 1.00 40.72 O -CONECT 231 352 -CONECT 352 231 -CONECT 457 1831 -CONECT 458 1831 -CONECT 472 1831 -CONECT 496 1831 -CONECT 516 1831 -CONECT 537 1831 -CONECT 980 1466 -CONECT 1223 1341 -CONECT 1341 1223 -CONECT 1400 1620 -CONECT 1466 980 -CONECT 1620 1400 -CONECT 1831 457 458 472 496 -CONECT 1831 516 537 1928 -CONECT 1832 1833 1834 1835 1836 -CONECT 1833 1832 -CONECT 1834 1832 -CONECT 1835 1832 -CONECT 1836 1832 -CONECT 1837 1838 1839 1843 -CONECT 1838 1837 1840 1841 1842 -CONECT 1839 1837 -CONECT 1840 1838 -CONECT 1841 1838 -CONECT 1842 1838 -CONECT 1843 1837 1844 -CONECT 1844 1843 1845 1847 -CONECT 1845 1844 1846 1852 -CONECT 1846 1845 -CONECT 1847 1844 1848 -CONECT 1848 1847 1849 1850 -CONECT 1849 1848 -CONECT 1850 1848 -CONECT 1851 1852 1853 1860 1861 -CONECT 1852 1845 1851 -CONECT 1853 1851 1854 -CONECT 1854 1853 1855 1859 -CONECT 1855 1854 1856 -CONECT 1856 1855 1857 -CONECT 1857 1856 1858 -CONECT 1858 1857 1859 -CONECT 1859 1854 1858 -CONECT 1860 1851 -CONECT 1861 1851 1862 -CONECT 1862 1861 1863 1865 -CONECT 1863 1862 -CONECT 1864 1865 1866 1870 -CONECT 1865 1862 1864 -CONECT 1866 1864 1867 -CONECT 1867 1866 1868 -CONECT 1868 1867 1869 1871 -CONECT 1869 1868 1870 -CONECT 1870 1864 1869 -CONECT 1871 1868 1872 1873 -CONECT 1872 1871 -CONECT 1873 1871 -CONECT 1928 1831 -MASTER 392 0 3 2 17 0 10 6 1999 1 59 19 -END |