Browse entries in the PDBbind-CN Database
HEADER HYDROLASE/HYDROLASE INHIBITOR 24-NOV-04 1Y3C TITLE CRYSTAL STRUCTURE OF THE COMPLEX OF SUBTILISIN BPN' WITH CHYMOTRYPSIN TITLE 2 INHIBITOR 2 R62A MUTANT COMPND MOL_ID: 1; COMPND 2 MOLECULE: SUBTILISIN BPN'; COMPND 3 CHAIN: E; COMPND 4 SYNONYM: SUBTILISIN NOVO; SUBTILISIN DFE; ALKALINE PROTEASE; COMPND 5 EC: 3.4.21.62; COMPND 6 ENGINEERED: YES; COMPND 7 MUTATION: YES; COMPND 8 MOL_ID: 2; COMPND 9 MOLECULE: CHYMOTRYPSIN INHIBITOR 2; COMPND 10 CHAIN: I; COMPND 11 ENGINEERED: YES; COMPND 12 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS AMYLOLIQUEFACIENS; SOURCE 3 ORGANISM_TAXID: 1390; SOURCE 4 GENE: APR; SOURCE 5 EXPRESSION_SYSTEM: BACILLUS SUBTILIS; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 1423; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BG2036; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PSER25; SOURCE 10 MOL_ID: 2; SOURCE 11 ORGANISM_SCIENTIFIC: HORDEUM VULGARE; SOURCE 12 ORGANISM_TAXID: 4513; SOURCE 13 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 14 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 15 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 16 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 17 EXPRESSION_SYSTEM_PLASMID: PCI2R62A KEYWDS SERINE PROTEASE; INHIBITOR, HYDROLASE-HYDROLASE INHIBITOR COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR E.S.RADISKY,C.J.LU,G.KWAN,D.E.KOSHLAND JR. REVDAT 3 11-OCT-17 1Y3C 1 REMARK REVDAT 2 24-FEB-09 1Y3C 1 VERSN REVDAT 1 17-MAY-05 1Y3C 0 JRNL AUTH E.S.RADISKY,C.J.LU,G.KWAN,D.E.KOSHLAND JR. JRNL TITL ROLE OF THE INTRAMOLECULAR HYDROGEN BOND NETWORK IN THE JRNL TITL 2 INHIBITORY POWER OF CHYMOTRYPSIN INHIBITOR 2 JRNL REF BIOCHEMISTRY V. 44 6823 2005 JRNL REFN ISSN 0006-2960 JRNL PMID 15865427 JRNL DOI 10.1021/BI047301W REMARK 2 REMARK 2 RESOLUTION. 1.69 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.1.24 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.69 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 81.65 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 97.4 REMARK 3 NUMBER OF REFLECTIONS : 50582 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : INHERITED FROM 1TM3 REMARK 3 R VALUE (WORKING + TEST SET) : 0.149 REMARK 3 R VALUE (WORKING SET) : 0.148 REMARK 3 FREE R VALUE : 0.178 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 2668 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 1.69 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.73 REMARK 3 REFLECTION IN BIN (WORKING SET) : 3626 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 BIN R VALUE (WORKING SET) : 0.2060 REMARK 3 BIN FREE R VALUE SET COUNT : 188 REMARK 3 BIN FREE R VALUE : 0.2080 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2503 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 94 REMARK 3 SOLVENT ATOMS : 474 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 17.17 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.35000 REMARK 3 B22 (A**2) : 0.35000 REMARK 3 B33 (A**2) : -0.53000 REMARK 3 B12 (A**2) : 0.18000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.073 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.077 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.048 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 1.472 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.968 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.955 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2694 ; 0.021 ; 0.021 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3650 ; 1.879 ; 1.963 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 346 ; 5.689 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): NULL ; NULL ; NULL REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 409 ; 0.147 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 2008 ; 0.008 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 1386 ; 0.222 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 370 ; 0.165 ; 0.200 REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): 9 ; 0.065 ; 0.200 REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): 46 ; 0.387 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 43 ; 0.200 ; 0.200 REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 1718 ; 0.966 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2774 ; 1.589 ; 2.000 REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 976 ; 2.735 ; 3.000 REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 875 ; 4.506 ; 4.500 REMARK 3 SIDE-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : BABINET MODEL WITH MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.40 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1Y3C COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 08-DEC-04. REMARK 100 THE DEPOSITION ID IS D_1000031063. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 28-JUN-02 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 4.6 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ALS REMARK 200 BEAMLINE : 8.3.1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.000 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 4 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : MOSFLM, TRUNCATE REMARK 200 DATA SCALING SOFTWARE : SCALA, CCP4 (SCALA, TRUNCATE REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 50582 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.690 REMARK 200 RESOLUTION RANGE LOW (A) : 81.650 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -3.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 97.4 REMARK 200 DATA REDUNDANCY : 4.800 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 0.07900 REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 12.4000 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: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: EPMR REMARK 200 STARTING MODEL: 1TM3 REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 54.20 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.70 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: SODIUM CITRATE, ISOPROPANOL, PEG 4000, REMARK 280 PH 4.6, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 277K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 65 2 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+2/3 REMARK 290 3555 -X+Y,-X,Z+1/3 REMARK 290 4555 -X,-Y,Z+1/2 REMARK 290 5555 Y,-X+Y,Z+1/6 REMARK 290 6555 X-Y,X,Z+5/6 REMARK 290 7555 Y,X,-Z+2/3 REMARK 290 8555 X-Y,-Y,-Z REMARK 290 9555 -X,-X+Y,-Z+1/3 REMARK 290 10555 -Y,-X,-Z+1/6 REMARK 290 11555 -X+Y,Y,-Z+1/2 REMARK 290 12555 X,X-Y,-Z+5/6 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 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 123.37667 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 61.68833 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 92.53250 REMARK 290 SMTRY1 5 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 5 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 30.84417 REMARK 290 SMTRY1 6 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 154.22083 REMARK 290 SMTRY1 7 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 7 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 123.37667 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 9 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 9 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 9 0.000000 0.000000 -1.000000 61.68833 REMARK 290 SMTRY1 10 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 10 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 10 0.000000 0.000000 -1.000000 30.84417 REMARK 290 SMTRY1 11 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 11 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 11 0.000000 0.000000 -1.000000 92.53250 REMARK 290 SMTRY1 12 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 12 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 12 0.000000 0.000000 -1.000000 154.22083 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2 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: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 2390 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 13200 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -24.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: E, I 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 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 5780 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 25400 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -47.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: E, I 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 350 BIOMT1 2 0.500000 -0.866025 0.000000 93.87300 REMARK 350 BIOMT2 2 -0.866025 -0.500000 0.000000 162.59281 REMARK 350 BIOMT3 2 0.000000 0.000000 -1.000000 30.84417 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O HOH E 5349 O HOH E 5350 2.09 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 C7 15P E 5001 C7 15P E 5001 9765 1.74 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 ASP E 259 CB - CG - OD2 ANGL. DEV. = 5.7 DEGREES REMARK 500 ASP I 64 CB - CG - OD2 ANGL. DEV. = 5.8 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 ASP E 32 -150.57 -167.63 REMARK 500 SER E 63 -22.70 110.13 REMARK 500 ALA E 73 23.78 -152.66 REMARK 500 ASN E 77 -160.11 -161.20 REMARK 500 SER E 159 67.88 -152.15 REMARK 500 LEU E 257 -124.75 -116.46 REMARK 500 REMARK 500 REMARK: NULL REMARK 610 REMARK 610 MISSING HETEROATOM REMARK 610 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 610 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 610 I=INSERTION CODE): REMARK 610 M RES C SSEQI REMARK 610 15P E 5001 REMARK 610 15P E 5002 REMARK 610 15P E 5003 REMARK 610 15P E 5004 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 E1001 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLN E 2 OE1 REMARK 620 2 ASP E 41 OD1 157.4 REMARK 620 3 ASP E 41 OD2 151.9 47.4 REMARK 620 4 LEU E 75 O 75.0 88.0 106.6 REMARK 620 5 ASN E 77 OD1 83.6 82.0 124.0 91.5 REMARK 620 6 ILE E 79 O 98.6 95.4 83.5 168.7 78.3 REMARK 620 7 VAL E 81 O 88.1 107.9 63.9 92.7 169.4 96.5 REMARK 620 N 1 2 3 4 5 6 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 NA E1002 NA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLY E 169 O REMARK 620 2 TYR E 171 O 92.4 REMARK 620 3 VAL E 174 O 107.5 89.8 REMARK 620 4 HOH E5138 O 104.3 86.5 148.1 REMARK 620 5 HOH E5036 O 108.0 159.4 81.5 91.0 REMARK 620 N 1 2 3 4 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA E 1001 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NA E 1002 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CIT E 2001 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CIT E 2002 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CIT E 2003 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 15P E 5001 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 15P E 5002 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 15P E 5003 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 15P E 5004 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1Y1K RELATED DB: PDB REMARK 900 RELATED ID: 1Y33 RELATED DB: PDB REMARK 900 RELATED ID: 1Y34 RELATED DB: PDB REMARK 900 RELATED ID: 1Y3B RELATED DB: PDB REMARK 900 RELATED ID: 1Y3D RELATED DB: PDB REMARK 900 RELATED ID: 1Y3F RELATED DB: PDB REMARK 900 RELATED ID: 1Y48 RELATED DB: PDB REMARK 900 RELATED ID: 1Y4A RELATED DB: PDB REMARK 900 RELATED ID: 1Y4D RELATED DB: PDB DBREF 1Y3C E 1 275 UNP P00782 SUBT_BACAM 108 382 DBREF 1Y3C I 21 83 UNP Q40059 Q40059_HORVU 22 84 SEQADV 1Y3C HIS E 276 UNP P00782 EXPRESSION TAG SEQADV 1Y3C HIS E 277 UNP P00782 EXPRESSION TAG SEQADV 1Y3C HIS E 278 UNP P00782 EXPRESSION TAG SEQADV 1Y3C HIS E 279 UNP P00782 EXPRESSION TAG SEQADV 1Y3C HIS E 280 UNP P00782 EXPRESSION TAG SEQADV 1Y3C HIS E 281 UNP P00782 EXPRESSION TAG SEQADV 1Y3C MET I 20 UNP Q40059 INITIATING METHIONINE SEQADV 1Y3C ALA I 62 UNP Q40059 ARG 63 ENGINEERED SEQRES 1 E 281 ALA GLN SER VAL PRO TYR GLY VAL SER GLN ILE LYS ALA SEQRES 2 E 281 PRO ALA LEU HIS SER GLN GLY TYR THR GLY SER ASN VAL SEQRES 3 E 281 LYS VAL ALA VAL ILE ASP SER GLY ILE ASP SER SER HIS SEQRES 4 E 281 PRO ASP LEU LYS VAL ALA GLY GLY ALA SER MET VAL PRO SEQRES 5 E 281 SER GLU THR ASN PRO PHE GLN ASP ASN ASN SER HIS GLY SEQRES 6 E 281 THR HIS VAL ALA GLY THR VAL ALA ALA LEU ASN ASN SER SEQRES 7 E 281 ILE GLY VAL LEU GLY VAL ALA PRO SER ALA SER LEU TYR SEQRES 8 E 281 ALA VAL LYS VAL LEU GLY ALA ASP GLY SER GLY GLN TYR SEQRES 9 E 281 SER TRP ILE ILE ASN GLY ILE GLU TRP ALA ILE ALA ASN SEQRES 10 E 281 ASN MET ASP VAL ILE ASN MET SER LEU GLY GLY PRO SER SEQRES 11 E 281 GLY SER ALA ALA LEU LYS ALA ALA VAL ASP LYS ALA VAL SEQRES 12 E 281 ALA SER GLY VAL VAL VAL VAL ALA ALA ALA GLY ASN GLU SEQRES 13 E 281 GLY THR SER GLY SER SER SER THR VAL GLY TYR PRO GLY SEQRES 14 E 281 LYS TYR PRO SER VAL ILE ALA VAL GLY ALA VAL ASP SER SEQRES 15 E 281 SER ASN GLN ARG ALA SER PHE SER SER VAL GLY PRO GLU SEQRES 16 E 281 LEU ASP VAL MET ALA PRO GLY VAL SER ILE GLN SER THR SEQRES 17 E 281 LEU PRO GLY ASN LYS TYR GLY ALA TYR ASN GLY THR SER SEQRES 18 E 281 MET ALA SER PRO HIS VAL ALA GLY ALA ALA ALA LEU ILE SEQRES 19 E 281 LEU SER LYS HIS PRO ASN TRP THR ASN THR GLN VAL ARG SEQRES 20 E 281 SER SER LEU GLU ASN THR THR THR LYS LEU GLY ASP SER SEQRES 21 E 281 PHE TYR TYR GLY LYS GLY LEU ILE ASN VAL GLN ALA ALA SEQRES 22 E 281 ALA GLN HIS HIS HIS HIS HIS HIS SEQRES 1 I 64 MET LYS THR GLU TRP PRO GLU LEU VAL GLY LYS SER VAL SEQRES 2 I 64 GLU GLU ALA LYS LYS VAL ILE LEU GLN ASP LYS PRO ALA SEQRES 3 I 64 ALA GLN ILE ILE VAL LEU PRO VAL GLY THR ILE VAL THR SEQRES 4 I 64 MET GLU TYR ALA ILE ASP ARG VAL ARG LEU PHE VAL ASP SEQRES 5 I 64 ARG LEU ASP ASN ILE ALA GLN VAL PRO ARG VAL GLY HET CA E1001 1 HET NA E1002 1 HET CIT E2001 13 HET CIT E2002 13 HET CIT E2003 13 HET 15P E5001 11 HET 15P E5002 16 HET 15P E5003 14 HET 15P E5004 12 HETNAM CA CALCIUM ION HETNAM NA SODIUM ION HETNAM CIT CITRIC ACID HETNAM 15P POLYETHYLENE GLYCOL (N=34) HETSYN 15P PEG 1500 FORMUL 3 CA CA 2+ FORMUL 4 NA NA 1+ FORMUL 5 CIT 3(C6 H8 O7) FORMUL 8 15P 4(C69 H140 O35) FORMUL 12 HOH *474(H2 O) HELIX 1 1 PRO E 5 ILE E 11 1 7 HELIX 2 2 LYS E 12 GLY E 20 1 9 HELIX 3 3 SER E 63 ALA E 74 1 12 HELIX 4 4 GLN E 103 ASN E 117 1 15 HELIX 5 5 SER E 132 SER E 145 1 14 HELIX 6 6 GLY E 219 HIS E 238 1 20 HELIX 7 7 THR E 242 ASN E 252 1 11 HELIX 8 8 ASP E 259 GLY E 264 1 6 HELIX 9 9 ASN E 269 ALA E 274 1 6 HELIX 10 10 TRP I 24 VAL I 28 5 5 HELIX 11 11 SER I 31 LYS I 43 1 13 SHEET 1 A 7 VAL E 44 SER E 49 0 SHEET 2 A 7 SER E 89 LYS E 94 1 O LEU E 90 N ALA E 45 SHEET 3 A 7 LYS E 27 ASP E 32 1 N VAL E 28 O TYR E 91 SHEET 4 A 7 VAL E 121 MET E 124 1 O VAL E 121 N ALA E 29 SHEET 5 A 7 VAL E 148 ALA E 152 1 O VAL E 150 N ILE E 122 SHEET 6 A 7 ILE E 175 VAL E 180 1 O ILE E 175 N ALA E 151 SHEET 7 A 7 VAL E 198 PRO E 201 1 O VAL E 198 N GLY E 178 SHEET 1 B 3 SER E 101 GLY E 102 0 SHEET 2 B 3 ILE I 56 THR I 58 -1 O ILE I 56 N GLY E 102 SHEET 3 B 3 LEU E 126 GLY E 127 -1 N GLY E 127 O VAL I 57 SHEET 1 C 2 ILE E 205 LEU E 209 0 SHEET 2 C 2 LYS E 213 TYR E 217 -1 O TYR E 217 N ILE E 205 SHEET 1 D 3 GLN I 47 PRO I 52 0 SHEET 2 D 3 ALA I 62 VAL I 70 1 O ASP I 64 N GLN I 47 SHEET 3 D 3 ARG I 81 GLY I 83 -1 O GLY I 83 N ARG I 65 LINK OE1 GLN E 2 CA CA E1001 1555 1555 2.39 LINK OD1 ASP E 41 CA CA E1001 1555 1555 2.41 LINK OD2 ASP E 41 CA CA E1001 1555 1555 2.85 LINK O LEU E 75 CA CA E1001 1555 1555 2.35 LINK OD1 ASN E 77 CA CA E1001 1555 1555 2.38 LINK O ILE E 79 CA CA E1001 1555 1555 2.38 LINK O VAL E 81 CA CA E1001 1555 1555 2.34 LINK O GLY E 169 NA NA E1002 1555 1555 2.36 LINK O TYR E 171 NA NA E1002 1555 1555 2.32 LINK O VAL E 174 NA NA E1002 1555 1555 2.30 LINK NA NA E1002 O HOH E5138 1555 1555 2.42 LINK NA NA E1002 O HOH E5036 1555 1555 2.43 CISPEP 1 TYR E 167 PRO E 168 0 5.34 SITE 1 AC1 6 GLN E 2 ASP E 41 LEU E 75 ASN E 77 SITE 2 AC1 6 ILE E 79 VAL E 81 SITE 1 AC2 5 GLY E 169 TYR E 171 VAL E 174 HOH E5036 SITE 2 AC2 5 HOH E5138 SITE 1 AC3 13 ALA E 1 TYR E 21 LYS E 237 HIS E 238 SITE 2 AC3 13 ASN E 240 TRP E 241 HIS E 276 CIT E2002 SITE 3 AC3 13 HOH E5032 HOH E5085 HOH E5119 HOH E5323 SITE 4 AC3 13 HOH E5353 SITE 1 AC4 11 TRP E 241 GLN E 245 HIS E 276 CIT E2001 SITE 2 AC4 11 HOH E5064 HOH E5085 HOH E5221 HOH E5229 SITE 3 AC4 11 HOH E5304 HOH E5353 HOH E5365 SITE 1 AC5 11 PRO E 172 GLY E 211 LYS E 213 ARG E 247 SITE 2 AC5 11 HOH E5039 HOH E5065 HOH E5089 HOH E5122 SITE 3 AC5 11 HOH E5187 HOH E5214 HOH E5276 SITE 1 AC6 4 HIS E 17 THR E 22 ASN E 76 HOH E5318 SITE 1 AC7 6 ILE E 115 ASN E 118 MET E 119 SER E 145 SITE 2 AC7 6 HOH E5108 HOH E5164 SITE 1 AC8 6 SER E 37 VAL E 44 ALA E 45 GLY E 47 SITE 2 AC8 6 PHE E 58 HOH E5324 SITE 1 AC9 5 ALA E 15 GLN E 19 GLN E 271 GLN E 275 SITE 2 AC9 5 HOH E5322 CRYST1 93.873 93.873 185.065 90.00 90.00 120.00 P 65 2 2 12 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 0.010653 0.006150 0.000000 0.00000 SCALE2 0.000000 0.012301 0.000000 0.00000 SCALE3 0.000000 0.000000 0.005404 0.00000 ATOM 1 N ALA E 1 49.011 51.033 36.455 1.00 13.83 N ATOM 2 CA ALA E 1 50.451 51.076 36.031 1.00 13.38 C ATOM 3 C ALA E 1 50.452 50.860 34.524 1.00 12.83 C ATOM 4 O ALA E 1 49.582 50.143 33.961 1.00 13.93 O ATOM 5 CB ALA E 1 51.226 49.928 36.706 1.00 13.76 C ATOM 6 N GLN E 2 51.414 51.488 33.862 1.00 11.45 N ATOM 7 CA GLN E 2 51.660 51.273 32.453 1.00 11.10 C ATOM 8 C GLN E 2 52.525 50.009 32.267 1.00 10.95 C ATOM 9 O GLN E 2 53.362 49.657 33.120 1.00 11.89 O ATOM 10 CB GLN E 2 52.405 52.532 31.971 1.00 10.62 C ATOM 11 CG GLN E 2 52.921 52.487 30.523 1.00 12.87 C ATOM 12 CD GLN E 2 53.405 53.854 30.147 1.00 11.78 C ATOM 13 OE1 GLN E 2 52.621 54.668 29.600 1.00 11.64 O ATOM 14 NE2 GLN E 2 54.694 54.164 30.522 1.00 10.69 N ATOM 15 N SER E 3 52.315 49.350 31.133 1.00 10.24 N ATOM 16 CA SER E 3 53.120 48.210 30.666 1.00 11.35 C ATOM 17 C SER E 3 53.839 48.596 29.382 1.00 10.54 C ATOM 18 O SER E 3 53.300 49.311 28.531 1.00 11.91 O ATOM 19 CB SER E 3 52.200 46.969 30.402 1.00 12.59 C ATOM 20 OG ASER E 3 51.100 47.249 29.619 0.33 13.74 O ATOM 21 OG BSER E 3 52.906 45.942 29.740 0.33 12.20 O ATOM 22 OG CSER E 3 51.499 46.633 31.587 0.33 10.89 O ATOM 23 N VAL E 4 55.048 48.088 29.228 1.00 10.37 N ATOM 24 CA VAL E 4 55.796 48.339 27.998 1.00 9.99 C ATOM 25 C VAL E 4 55.677 47.053 27.158 1.00 9.94 C ATOM 26 O VAL E 4 56.240 46.022 27.545 1.00 10.86 O ATOM 27 CB VAL E 4 57.248 48.598 28.294 1.00 10.24 C ATOM 28 CG1 VAL E 4 58.034 48.838 26.971 1.00 12.13 C ATOM 29 CG2 VAL E 4 57.337 49.840 29.214 1.00 13.53 C ATOM 30 N PRO E 5 54.943 47.083 26.050 1.00 8.85 N ATOM 31 CA PRO E 5 54.839 45.864 25.234 1.00 9.93 C ATOM 32 C PRO E 5 56.230 45.365 24.822 1.00 10.99 C ATOM 33 O PRO E 5 57.143 46.165 24.574 1.00 10.42 O ATOM 34 CB PRO E 5 54.060 46.337 23.993 1.00 11.35 C ATOM 35 CG PRO E 5 53.204 47.511 24.528 1.00 12.40 C ATOM 36 CD PRO E 5 54.209 48.224 25.451 1.00 9.69 C ATOM 37 N TYR E 6 56.378 44.053 24.723 1.00 10.06 N ATOM 38 CA TYR E 6 57.720 43.484 24.458 1.00 11.78 C ATOM 39 C TYR E 6 58.364 44.043 23.197 1.00 11.14 C ATOM 40 O TYR E 6 59.600 44.236 23.175 1.00 11.25 O ATOM 41 CB TYR E 6 57.666 41.948 24.416 1.00 11.42 C ATOM 42 CG TYR E 6 57.283 41.398 23.017 1.00 13.25 C ATOM 43 CD1 TYR E 6 58.280 41.243 21.989 1.00 14.15 C ATOM 44 CD2 TYR E 6 55.965 41.049 22.711 1.00 15.15 C ATOM 45 CE1 TYR E 6 57.923 40.761 20.691 1.00 14.28 C ATOM 46 CE2 TYR E 6 55.621 40.579 21.436 1.00 12.44 C ATOM 47 CZ TYR E 6 56.608 40.418 20.443 1.00 14.72 C ATOM 48 OH TYR E 6 56.245 39.934 19.196 1.00 17.96 O ATOM 49 N GLY E 7 57.548 44.342 22.189 1.00 10.24 N ATOM 50 CA GLY E 7 58.127 44.780 20.925 1.00 10.26 C ATOM 51 C GLY E 7 58.770 46.174 21.058 1.00 10.16 C ATOM 52 O GLY E 7 59.767 46.458 20.361 1.00 10.74 O ATOM 53 N VAL E 8 58.221 47.027 21.919 1.00 9.79 N ATOM 54 CA VAL E 8 58.860 48.353 22.128 1.00 10.64 C ATOM 55 C VAL E 8 60.282 48.169 22.732 1.00 11.00 C ATOM 56 O VAL E 8 61.275 48.805 22.321 1.00 10.38 O ATOM 57 CB VAL E 8 57.974 49.192 23.074 1.00 10.78 C ATOM 58 CG1 VAL E 8 58.668 50.560 23.482 1.00 9.01 C ATOM 59 CG2 VAL E 8 56.598 49.445 22.387 1.00 9.03 C ATOM 60 N SER E 9 60.390 47.248 23.685 1.00 9.65 N ATOM 61 CA SER E 9 61.706 46.909 24.250 1.00 11.22 C ATOM 62 C SER E 9 62.618 46.244 23.248 1.00 10.25 C ATOM 63 O SER E 9 63.830 46.519 23.208 1.00 11.33 O ATOM 64 CB SER E 9 61.530 45.998 25.493 1.00 11.49 C ATOM 65 OG SER E 9 60.728 46.695 26.463 1.00 13.45 O ATOM 66 N GLN E 10 62.035 45.358 22.442 1.00 10.65 N ATOM 67 CA GLN E 10 62.833 44.566 21.505 1.00 10.51 C ATOM 68 C GLN E 10 63.569 45.440 20.464 1.00 11.50 C ATOM 69 O GLN E 10 64.704 45.069 20.063 1.00 12.28 O ATOM 70 CB GLN E 10 61.922 43.552 20.779 1.00 10.30 C ATOM 71 CG GLN E 10 62.712 42.529 19.914 1.00 12.96 C ATOM 72 CD GLN E 10 61.802 41.357 19.535 1.00 16.37 C ATOM 73 OE1 GLN E 10 60.887 41.070 20.269 1.00 21.12 O ATOM 74 NE2 GLN E 10 62.053 40.704 18.408 1.00 12.87 N ATOM 75 N ILE E 11 62.944 46.539 20.034 1.00 10.64 N ATOM 76 CA ILE E 11 63.601 47.426 19.038 1.00 10.47 C ATOM 77 C ILE E 11 64.513 48.467 19.736 1.00 11.04 C ATOM 78 O ILE E 11 65.111 49.291 19.033 1.00 10.34 O ATOM 79 CB ILE E 11 62.566 48.150 18.119 1.00 9.71 C ATOM 80 CG1 ILE E 11 61.720 49.167 18.926 1.00 10.89 C ATOM 81 CG2 ILE E 11 61.724 47.073 17.392 1.00 10.46 C ATOM 82 CD1 ILE E 11 60.933 50.104 18.014 1.00 11.00 C ATOM 83 N LYS E 12 64.605 48.393 21.064 1.00 11.28 N ATOM 84 CA LYS E 12 65.482 49.221 21.921 1.00 12.02 C ATOM 85 C LYS E 12 64.994 50.675 21.977 1.00 11.43 C ATOM 86 O LYS E 12 65.788 51.616 22.150 1.00 12.06 O ATOM 87 CB LYS E 12 66.945 49.126 21.468 1.00 12.10 C ATOM 88 CG LYS E 12 67.433 47.647 21.485 1.00 15.69 C ATOM 89 CD LYS E 12 68.932 47.524 21.272 1.00 23.73 C ATOM 90 CE LYS E 12 69.421 46.048 21.364 1.00 26.03 C ATOM 91 NZ LYS E 12 68.824 45.225 22.481 1.00 33.04 N ATOM 92 N ALA E 13 63.687 50.864 21.831 1.00 11.71 N ATOM 93 CA ALA E 13 63.118 52.194 22.055 1.00 11.56 C ATOM 94 C ALA E 13 63.417 52.768 23.463 1.00 11.88 C ATOM 95 O ALA E 13 63.639 53.975 23.571 1.00 11.69 O ATOM 96 CB ALA E 13 61.562 52.261 21.735 1.00 10.18 C ATOM 97 N PRO E 14 63.381 51.960 24.541 1.00 11.77 N ATOM 98 CA PRO E 14 63.658 52.534 25.880 1.00 11.35 C ATOM 99 C PRO E 14 65.029 53.229 25.952 1.00 11.54 C ATOM 100 O PRO E 14 65.156 54.148 26.762 1.00 11.57 O ATOM 101 CB PRO E 14 63.624 51.313 26.807 1.00 11.30 C ATOM 102 CG PRO E 14 62.433 50.408 26.063 1.00 11.94 C ATOM 103 CD PRO E 14 62.941 50.535 24.583 1.00 11.46 C ATOM 104 N ALA E 15 66.026 52.781 25.182 1.00 11.95 N ATOM 105 CA ALA E 15 67.313 53.506 25.156 1.00 13.02 C ATOM 106 C ALA E 15 67.173 54.948 24.693 1.00 13.46 C ATOM 107 O ALA E 15 67.857 55.856 25.223 1.00 14.36 O ATOM 108 CB ALA E 15 68.302 52.779 24.270 1.00 12.97 C ATOM 109 N LEU E 16 66.294 55.179 23.733 1.00 11.35 N ATOM 110 CA LEU E 16 66.037 56.546 23.279 1.00 10.88 C ATOM 111 C LEU E 16 65.265 57.296 24.363 1.00 11.02 C ATOM 112 O LEU E 16 65.582 58.463 24.641 1.00 9.86 O ATOM 113 CB LEU E 16 65.246 56.585 21.958 1.00 10.97 C ATOM 114 CG LEU E 16 66.061 56.644 20.644 1.00 11.65 C ATOM 115 CD1 LEU E 16 66.658 58.032 20.408 1.00 12.82 C ATOM 116 CD2 LEU E 16 67.156 55.512 20.662 1.00 13.21 C ATOM 117 N HIS E 17 64.239 56.658 24.965 1.00 9.85 N ATOM 118 CA HIS E 17 63.476 57.334 25.989 1.00 9.10 C ATOM 119 C HIS E 17 64.421 57.774 27.133 1.00 10.00 C ATOM 120 O HIS E 17 64.249 58.888 27.645 1.00 11.84 O ATOM 121 CB HIS E 17 62.416 56.364 26.562 1.00 9.41 C ATOM 122 CG HIS E 17 61.423 55.923 25.514 1.00 10.72 C ATOM 123 ND1 HIS E 17 60.532 54.891 25.738 1.00 12.14 N ATOM 124 CD2 HIS E 17 61.193 56.369 24.251 1.00 9.71 C ATOM 125 CE1 HIS E 17 59.832 54.688 24.624 1.00 15.44 C ATOM 126 NE2 HIS E 17 60.201 55.586 23.716 1.00 10.99 N ATOM 127 N SER E 18 65.380 56.929 27.511 1.00 10.52 N ATOM 128 CA SER E 18 66.249 57.278 28.663 1.00 10.84 C ATOM 129 C SER E 18 67.205 58.421 28.310 1.00 11.31 C ATOM 130 O SER E 18 67.661 59.103 29.205 1.00 10.79 O ATOM 131 CB SER E 18 67.095 56.086 29.152 1.00 10.82 C ATOM 132 OG ASER E 18 66.347 55.007 29.565 0.50 11.53 O ATOM 133 OG BSER E 18 67.920 55.529 28.181 0.50 8.77 O ATOM 134 N GLN E 19 67.556 58.546 27.017 1.00 11.11 N ATOM 135 CA GLN E 19 68.352 59.725 26.540 1.00 10.27 C ATOM 136 C GLN E 19 67.512 61.001 26.521 1.00 10.88 C ATOM 137 O GLN E 19 68.057 62.101 26.390 1.00 11.02 O ATOM 138 CB GLN E 19 68.874 59.470 25.121 1.00 11.02 C ATOM 139 CG GLN E 19 69.889 58.297 25.008 1.00 12.73 C ATOM 140 CD GLN E 19 70.218 58.035 23.504 1.00 16.37 C ATOM 141 OE1 GLN E 19 70.402 58.958 22.781 1.00 21.96 O ATOM 142 NE2 GLN E 19 70.161 56.768 23.042 1.00 19.16 N ATOM 143 N GLY E 20 66.177 60.861 26.648 1.00 10.61 N ATOM 144 CA GLY E 20 65.265 61.998 26.689 1.00 10.56 C ATOM 145 C GLY E 20 64.479 62.230 25.400 1.00 12.60 C ATOM 146 O GLY E 20 63.845 63.281 25.250 1.00 14.24 O ATOM 147 N TYR E 21 64.491 61.243 24.492 1.00 10.97 N ATOM 148 CA TYR E 21 63.879 61.437 23.155 1.00 10.79 C ATOM 149 C TYR E 21 62.693 60.485 22.969 1.00 11.97 C ATOM 150 O TYR E 21 62.796 59.269 23.230 1.00 12.50 O ATOM 151 CB TYR E 21 64.939 61.218 22.040 1.00 11.52 C ATOM 152 CG TYR E 21 65.987 62.298 22.126 1.00 11.98 C ATOM 153 CD1 TYR E 21 65.650 63.614 21.808 1.00 12.35 C ATOM 154 CD2 TYR E 21 67.282 62.006 22.573 1.00 13.15 C ATOM 155 CE1 TYR E 21 66.575 64.623 21.892 1.00 16.26 C ATOM 156 CE2 TYR E 21 68.251 63.055 22.684 1.00 13.26 C ATOM 157 CZ TYR E 21 67.856 64.332 22.341 1.00 13.36 C ATOM 158 OH TYR E 21 68.738 65.383 22.433 1.00 15.07 O ATOM 159 N THR E 22 61.542 61.072 22.617 1.00 10.72 N ATOM 160 CA THR E 22 60.264 60.361 22.618 1.00 10.93 C ATOM 161 C THR E 22 59.438 60.738 21.379 1.00 10.68 C ATOM 162 O THR E 22 58.243 60.431 21.345 1.00 10.88 O ATOM 163 CB THR E 22 59.436 60.745 23.856 1.00 11.06 C ATOM 164 OG1 THR E 22 59.374 62.184 23.985 1.00 12.46 O ATOM 165 CG2 THR E 22 60.098 60.212 25.167 1.00 12.06 C ATOM 166 N GLY E 23 60.042 61.383 20.385 1.00 10.58 N ATOM 167 CA GLY E 23 59.295 61.775 19.198 1.00 11.03 C ATOM 168 C GLY E 23 58.628 63.157 19.281 1.00 11.97 C ATOM 169 O GLY E 23 57.795 63.475 18.431 1.00 11.15 O ATOM 170 N SER E 24 58.976 63.973 20.284 1.00 11.40 N ATOM 171 CA SER E 24 58.336 65.299 20.405 1.00 13.99 C ATOM 172 C SER E 24 58.473 66.119 19.120 1.00 14.18 C ATOM 173 O SER E 24 59.542 66.170 18.513 1.00 13.93 O ATOM 174 CB SER E 24 58.973 66.115 21.538 1.00 14.89 C ATOM 175 OG ASER E 24 58.850 65.425 22.751 0.67 14.00 O ATOM 176 OG BSER E 24 58.182 67.266 21.813 0.33 14.85 O ATOM 177 N ASN E 25 57.364 66.728 18.731 1.00 16.12 N ATOM 178 CA ASN E 25 57.278 67.656 17.594 1.00 18.08 C ATOM 179 C ASN E 25 57.429 66.942 16.251 1.00 17.46 C ATOM 180 O ASN E 25 57.583 67.593 15.227 1.00 21.05 O ATOM 181 CB ASN E 25 58.305 68.775 17.721 1.00 19.05 C ATOM 182 CG ASN E 25 58.090 69.579 18.985 1.00 25.79 C ATOM 183 OD1 ASN E 25 56.973 69.971 19.290 1.00 33.37 O ATOM 184 ND2 ASN E 25 59.153 69.778 19.747 1.00 33.87 N ATOM 185 N VAL E 26 57.402 65.618 16.239 1.00 14.11 N ATOM 186 CA VAL E 26 57.458 64.939 14.951 1.00 11.57 C ATOM 187 C VAL E 26 56.033 64.565 14.565 1.00 12.08 C ATOM 188 O VAL E 26 55.288 63.938 15.356 1.00 11.98 O ATOM 189 CB VAL E 26 58.306 63.633 15.039 1.00 11.85 C ATOM 190 CG1 VAL E 26 58.403 62.907 13.650 1.00 13.03 C ATOM 191 CG2 VAL E 26 59.718 63.978 15.532 1.00 12.52 C ATOM 192 N LYS E 27 55.689 64.868 13.328 1.00 12.03 N ATOM 193 CA LYS E 27 54.305 64.657 12.893 1.00 12.52 C ATOM 194 C LYS E 27 54.249 63.309 12.151 1.00 12.43 C ATOM 195 O LYS E 27 54.936 63.099 11.145 1.00 13.03 O ATOM 196 CB LYS E 27 53.905 65.803 11.951 1.00 11.70 C ATOM 197 CG LYS E 27 53.786 67.137 12.705 1.00 14.66 C ATOM 198 CD LYS E 27 53.329 68.227 11.683 1.00 18.06 C ATOM 199 CE LYS E 27 53.048 69.517 12.413 1.00 25.13 C ATOM 200 NZ LYS E 27 54.433 70.142 12.485 1.00 31.99 N ATOM 201 N VAL E 28 53.400 62.405 12.665 1.00 11.65 N ATOM 202 CA VAL E 28 53.256 61.069 12.103 1.00 10.87 C ATOM 203 C VAL E 28 51.800 60.844 11.696 1.00 11.85 C ATOM 204 O VAL E 28 50.876 60.919 12.533 1.00 12.10 O ATOM 205 CB VAL E 28 53.629 59.982 13.141 1.00 10.85 C ATOM 206 CG1 VAL E 28 53.578 58.564 12.463 1.00 10.63 C ATOM 207 CG2 VAL E 28 55.016 60.256 13.718 1.00 10.52 C ATOM 208 N ALA E 29 51.620 60.588 10.409 1.00 11.99 N ATOM 209 CA ALA E 29 50.284 60.261 9.875 1.00 10.89 C ATOM 210 C ALA E 29 50.097 58.748 9.894 1.00 11.39 C ATOM 211 O ALA E 29 50.823 58.052 9.215 1.00 12.36 O ATOM 212 CB ALA E 29 50.104 60.816 8.437 1.00 11.96 C ATOM 213 N VAL E 30 49.082 58.293 10.619 1.00 11.61 N ATOM 214 CA VAL E 30 48.652 56.898 10.556 1.00 11.88 C ATOM 215 C VAL E 30 47.552 56.862 9.479 1.00 11.31 C ATOM 216 O VAL E 30 46.447 57.327 9.703 1.00 13.05 O ATOM 217 CB VAL E 30 48.210 56.414 11.941 1.00 12.56 C ATOM 218 CG1 VAL E 30 47.647 54.999 11.874 1.00 11.60 C ATOM 219 CG2 VAL E 30 49.468 56.409 12.907 1.00 13.11 C ATOM 220 N ILE E 31 47.928 56.375 8.293 1.00 12.40 N ATOM 221 CA ILE E 31 47.023 56.333 7.128 1.00 11.96 C ATOM 222 C ILE E 31 46.357 54.967 7.231 1.00 11.20 C ATOM 223 O ILE E 31 47.000 53.952 6.974 1.00 11.22 O ATOM 224 CB ILE E 31 47.807 56.512 5.834 1.00 12.73 C ATOM 225 CG1 ILE E 31 48.442 57.922 5.853 1.00 11.27 C ATOM 226 CG2 ILE E 31 46.844 56.331 4.604 1.00 11.73 C ATOM 227 CD1 ILE E 31 49.040 58.383 4.457 1.00 11.68 C ATOM 228 N ASP E 32 45.091 54.976 7.654 1.00 11.50 N ATOM 229 CA ASP E 32 44.512 53.731 8.146 1.00 11.51 C ATOM 230 C ASP E 32 42.983 53.859 8.295 1.00 12.29 C ATOM 231 O ASP E 32 42.343 54.672 7.594 1.00 11.92 O ATOM 232 CB ASP E 32 45.185 53.403 9.517 1.00 11.41 C ATOM 233 CG ASP E 32 45.308 51.885 9.760 1.00 12.76 C ATOM 234 OD1 ASP E 32 44.230 51.228 9.913 1.00 11.42 O ATOM 235 OD2 ASP E 32 46.436 51.299 9.830 1.00 12.77 O ATOM 236 N SER E 33 42.413 53.116 9.237 1.00 12.12 N ATOM 237 CA SER E 33 40.960 53.136 9.441 1.00 12.58 C ATOM 238 C SER E 33 40.460 54.212 10.384 1.00 13.51 C ATOM 239 O SER E 33 39.295 54.111 10.843 1.00 13.39 O ATOM 240 CB SER E 33 40.500 51.738 9.951 1.00 13.49 C ATOM 241 OG SER E 33 40.885 51.521 11.329 1.00 14.00 O ATOM 242 N GLY E 34 41.284 55.230 10.662 1.00 12.62 N ATOM 243 CA GLY E 34 40.919 56.229 11.658 1.00 13.54 C ATOM 244 C GLY E 34 41.651 55.959 12.980 1.00 14.46 C ATOM 245 O GLY E 34 42.403 54.985 13.082 1.00 13.50 O ATOM 246 N ILE E 35 41.477 56.852 13.958 1.00 12.91 N ATOM 247 CA ILE E 35 42.032 56.596 15.297 1.00 13.13 C ATOM 248 C ILE E 35 41.007 57.019 16.297 1.00 13.85 C ATOM 249 O ILE E 35 40.529 58.138 16.225 1.00 14.30 O ATOM 250 CB ILE E 35 43.344 57.436 15.560 1.00 12.73 C ATOM 251 CG1 ILE E 35 44.437 57.176 14.479 1.00 12.70 C ATOM 252 CG2 ILE E 35 43.897 57.063 16.973 1.00 11.96 C ATOM 253 CD1 ILE E 35 45.675 58.090 14.639 1.00 10.78 C ATOM 254 N ASP E 36 40.700 56.188 17.275 1.00 13.95 N ATOM 255 CA ASP E 36 39.768 56.589 18.325 1.00 13.82 C ATOM 256 C ASP E 36 40.398 57.627 19.258 1.00 15.33 C ATOM 257 O ASP E 36 41.115 57.290 20.206 1.00 14.16 O ATOM 258 CB ASP E 36 39.334 55.358 19.112 1.00 14.32 C ATOM 259 CG ASP E 36 38.322 55.707 20.194 1.00 18.48 C ATOM 260 OD1 ASP E 36 37.904 56.901 20.335 1.00 18.86 O ATOM 261 OD2 ASP E 36 37.894 54.851 20.954 1.00 21.62 O ATOM 262 N SER E 37 40.119 58.893 18.994 1.00 16.27 N ATOM 263 CA SER E 37 40.747 59.981 19.756 1.00 18.81 C ATOM 264 C SER E 37 40.265 60.063 21.193 1.00 18.68 C ATOM 265 O SER E 37 40.912 60.755 22.001 1.00 22.23 O ATOM 266 CB SER E 37 40.510 61.345 19.059 1.00 19.66 C ATOM 267 OG SER E 37 39.137 61.640 19.026 1.00 21.19 O ATOM 268 N SER E 38 39.169 59.387 21.536 1.00 16.06 N ATOM 269 CA SER E 38 38.722 59.394 22.942 1.00 16.30 C ATOM 270 C SER E 38 39.505 58.422 23.819 1.00 15.14 C ATOM 271 O SER E 38 39.255 58.344 25.039 1.00 14.86 O ATOM 272 CB SER E 38 37.234 59.026 23.058 1.00 15.85 C ATOM 273 OG ASER E 38 37.054 57.657 22.790 0.50 14.83 O ATOM 274 OG BSER E 38 36.406 60.078 22.591 0.50 18.54 O ATOM 275 N HIS E 39 40.416 57.633 23.230 1.00 12.92 N ATOM 276 CA HIS E 39 41.143 56.661 24.070 1.00 13.39 C ATOM 277 C HIS E 39 42.043 57.458 25.028 1.00 12.23 C ATOM 278 O HIS E 39 42.781 58.308 24.559 1.00 12.78 O ATOM 279 CB HIS E 39 42.013 55.752 23.194 1.00 11.26 C ATOM 280 CG HIS E 39 42.407 54.477 23.886 1.00 12.87 C ATOM 281 ND1 HIS E 39 43.252 54.469 24.976 1.00 12.61 N ATOM 282 CD2 HIS E 39 42.079 53.181 23.649 1.00 9.81 C ATOM 283 CE1 HIS E 39 43.415 53.224 25.397 1.00 10.76 C ATOM 284 NE2 HIS E 39 42.728 52.421 24.597 1.00 11.41 N ATOM 285 N PRO E 40 42.042 57.162 26.325 1.00 12.80 N ATOM 286 CA PRO E 40 42.862 57.962 27.257 1.00 13.61 C ATOM 287 C PRO E 40 44.349 57.694 27.131 1.00 13.52 C ATOM 288 O PRO E 40 45.146 58.476 27.675 1.00 13.35 O ATOM 289 CB PRO E 40 42.378 57.542 28.636 1.00 14.42 C ATOM 290 CG PRO E 40 41.907 56.142 28.451 1.00 13.30 C ATOM 291 CD PRO E 40 41.258 56.122 27.031 1.00 13.41 C ATOM 292 N ASP E 41 44.731 56.666 26.387 1.00 12.65 N ATOM 293 CA ASP E 41 46.170 56.423 26.158 1.00 11.94 C ATOM 294 C ASP E 41 46.654 56.911 24.795 1.00 12.16 C ATOM 295 O ASP E 41 47.741 56.513 24.371 1.00 11.01 O ATOM 296 CB ASP E 41 46.509 54.937 26.383 1.00 12.65 C ATOM 297 CG ASP E 41 47.943 54.734 26.967 1.00 11.22 C ATOM 298 OD1 ASP E 41 48.466 55.645 27.613 1.00 12.41 O ATOM 299 OD2 ASP E 41 48.532 53.671 26.748 1.00 15.55 O ATOM 300 N LEU E 42 45.865 57.750 24.114 1.00 11.17 N ATOM 301 CA LEU E 42 46.305 58.338 22.842 1.00 12.18 C ATOM 302 C LEU E 42 46.019 59.821 22.866 1.00 13.55 C ATOM 303 O LEU E 42 45.021 60.284 23.512 1.00 14.58 O ATOM 304 CB LEU E 42 45.480 57.740 21.659 1.00 11.63 C ATOM 305 CG LEU E 42 45.691 56.233 21.423 1.00 10.08 C ATOM 306 CD1 LEU E 42 44.766 55.735 20.291 1.00 10.74 C ATOM 307 CD2 LEU E 42 47.136 55.894 21.036 1.00 11.71 C ATOM 308 N LYS E 43 46.848 60.579 22.178 1.00 13.21 N ATOM 309 CA LYS E 43 46.538 62.006 21.964 1.00 14.57 C ATOM 310 C LYS E 43 46.576 62.227 20.470 1.00 14.78 C ATOM 311 O LYS E 43 47.620 62.076 19.846 1.00 16.97 O ATOM 312 CB LYS E 43 47.581 62.913 22.639 1.00 15.47 C ATOM 313 CG LYS E 43 47.262 64.433 22.451 1.00 17.99 C ATOM 314 CD LYS E 43 48.402 65.249 23.146 1.00 26.57 C ATOM 315 CE LYS E 43 47.963 66.664 23.508 1.00 33.71 C ATOM 316 NZ LYS E 43 49.184 67.506 23.782 1.00 37.61 N ATOM 317 N VAL E 44 45.435 62.512 19.870 1.00 14.38 N ATOM 318 CA VAL E 44 45.425 62.720 18.421 1.00 14.61 C ATOM 319 C VAL E 44 45.463 64.216 18.139 1.00 16.25 C ATOM 320 O VAL E 44 44.606 64.951 18.635 1.00 16.17 O ATOM 321 CB VAL E 44 44.187 62.096 17.747 1.00 15.42 C ATOM 322 CG1 VAL E 44 44.188 62.356 16.204 1.00 16.94 C ATOM 323 CG2 VAL E 44 44.118 60.600 18.058 1.00 16.25 C ATOM 324 N ALA E 45 46.432 64.640 17.330 1.00 15.39 N ATOM 325 CA ALA E 45 46.713 66.071 17.114 1.00 16.41 C ATOM 326 C ALA E 45 45.859 66.635 15.975 1.00 17.51 C ATOM 327 O ALA E 45 45.688 67.854 15.876 1.00 18.90 O ATOM 328 CB ALA E 45 48.213 66.289 16.773 1.00 15.75 C ATOM 329 N GLY E 46 45.394 65.776 15.082 1.00 15.95 N ATOM 330 CA GLY E 46 44.692 66.254 13.895 1.00 16.16 C ATOM 331 C GLY E 46 44.441 65.108 12.951 1.00 16.55 C ATOM 332 O GLY E 46 44.659 63.946 13.295 1.00 16.36 O ATOM 333 N GLY E 47 43.953 65.427 11.761 1.00 16.42 N ATOM 334 CA GLY E 47 43.665 64.363 10.800 1.00 16.00 C ATOM 335 C GLY E 47 42.593 64.775 9.809 1.00 16.84 C ATOM 336 O GLY E 47 42.149 65.930 9.782 1.00 17.18 O ATOM 337 N ALA E 48 42.244 63.840 8.961 1.00 16.31 N ATOM 338 CA ALA E 48 41.231 64.108 7.913 1.00 16.54 C ATOM 339 C ALA E 48 40.757 62.774 7.436 1.00 17.57 C ATOM 340 O ALA E 48 41.515 61.793 7.486 1.00 16.42 O ATOM 341 CB ALA E 48 41.877 64.908 6.771 1.00 16.39 C ATOM 342 N SER E 49 39.497 62.699 6.961 1.00 16.38 N ATOM 343 CA SER E 49 39.010 61.450 6.395 1.00 16.99 C ATOM 344 C SER E 49 38.817 61.543 4.883 1.00 18.19 C ATOM 345 O SER E 49 38.209 62.513 4.393 1.00 19.27 O ATOM 346 CB SER E 49 37.663 61.051 6.994 1.00 17.31 C ATOM 347 OG SER E 49 37.208 59.887 6.272 1.00 18.74 O ATOM 348 N MET E 50 39.303 60.542 4.166 1.00 17.64 N ATOM 349 CA MET E 50 39.121 60.414 2.717 1.00 18.13 C ATOM 350 C MET E 50 38.047 59.373 2.370 1.00 18.94 C ATOM 351 O MET E 50 37.895 59.003 1.190 1.00 21.54 O ATOM 352 CB MET E 50 40.428 59.993 2.050 1.00 17.38 C ATOM 353 CG MET E 50 41.647 60.776 2.486 1.00 19.24 C ATOM 354 SD MET E 50 41.360 62.573 2.162 1.00 22.03 S ATOM 355 CE MET E 50 42.282 63.297 3.557 1.00 24.75 C ATOM 356 N VAL E 51 37.378 58.838 3.388 1.00 18.48 N ATOM 357 CA VAL E 51 36.375 57.800 3.168 1.00 20.25 C ATOM 358 C VAL E 51 35.012 58.501 2.998 1.00 21.20 C ATOM 359 O VAL E 51 34.495 59.085 3.953 1.00 20.78 O ATOM 360 CB VAL E 51 36.337 56.787 4.345 1.00 20.09 C ATOM 361 CG1 VAL E 51 35.146 55.760 4.198 1.00 22.08 C ATOM 362 CG2 VAL E 51 37.710 56.053 4.465 1.00 16.97 C ATOM 363 N PRO E 52 34.416 58.418 1.799 1.00 22.76 N ATOM 364 CA PRO E 52 33.179 59.190 1.539 1.00 23.54 C ATOM 365 C PRO E 52 32.025 58.934 2.539 1.00 24.25 C ATOM 366 O PRO E 52 31.360 59.889 2.949 1.00 24.48 O ATOM 367 CB PRO E 52 32.808 58.798 0.091 1.00 24.82 C ATOM 368 CG PRO E 52 34.100 58.310 -0.515 1.00 24.12 C ATOM 369 CD PRO E 52 34.854 57.640 0.631 1.00 22.35 C ATOM 370 N SER E 53 31.808 57.693 2.963 1.00 23.88 N ATOM 371 CA SER E 53 30.711 57.415 3.878 1.00 26.15 C ATOM 372 C SER E 53 31.067 57.441 5.378 1.00 26.21 C ATOM 373 O SER E 53 30.195 57.205 6.240 1.00 25.55 O ATOM 374 CB SER E 53 30.059 56.082 3.523 1.00 27.28 C ATOM 375 OG SER E 53 30.922 55.001 3.845 1.00 32.18 O ATOM 376 N GLU E 54 32.339 57.727 5.699 1.00 25.11 N ATOM 377 CA GLU E 54 32.773 57.811 7.108 1.00 24.01 C ATOM 378 C GLU E 54 33.629 59.058 7.238 1.00 23.82 C ATOM 379 O GLU E 54 34.862 58.976 7.092 1.00 23.62 O ATOM 380 CB GLU E 54 33.619 56.597 7.478 1.00 24.69 C ATOM 381 CG GLU E 54 32.864 55.285 7.444 1.00 24.24 C ATOM 382 CD GLU E 54 33.668 54.130 8.026 1.00 27.85 C ATOM 383 OE1 GLU E 54 34.564 54.381 8.891 1.00 27.49 O ATOM 384 OE2 GLU E 54 33.400 52.988 7.615 1.00 26.57 O ATOM 385 N THR E 55 32.997 60.199 7.511 1.00 22.39 N ATOM 386 CA THR E 55 33.681 61.474 7.394 1.00 23.15 C ATOM 387 C THR E 55 34.472 61.893 8.619 1.00 20.76 C ATOM 388 O THR E 55 35.175 62.906 8.550 1.00 21.26 O ATOM 389 CB THR E 55 32.667 62.631 7.080 1.00 23.81 C ATOM 390 OG1 THR E 55 31.678 62.664 8.112 1.00 25.93 O ATOM 391 CG2 THR E 55 31.905 62.323 5.795 1.00 26.46 C ATOM 392 N ASN E 56 34.375 61.127 9.716 1.00 19.84 N ATOM 393 CA ASN E 56 35.074 61.488 10.949 1.00 18.81 C ATOM 394 C ASN E 56 36.345 60.638 11.103 1.00 17.64 C ATOM 395 O ASN E 56 36.219 59.447 11.368 1.00 16.86 O ATOM 396 CB ASN E 56 34.193 61.222 12.165 1.00 19.81 C ATOM 397 CG ASN E 56 34.783 61.802 13.445 1.00 20.60 C ATOM 398 OD1 ASN E 56 35.942 62.202 13.488 1.00 19.54 O ATOM 399 ND2 ASN E 56 33.963 61.894 14.486 1.00 24.06 N ATOM 400 N PRO E 57 37.537 61.215 10.937 1.00 16.56 N ATOM 401 CA PRO E 57 38.765 60.393 11.055 1.00 17.40 C ATOM 402 C PRO E 57 39.042 59.961 12.523 1.00 17.22 C ATOM 403 O PRO E 57 39.916 59.099 12.761 1.00 15.55 O ATOM 404 CB PRO E 57 39.860 61.325 10.555 1.00 16.57 C ATOM 405 CG PRO E 57 39.352 62.700 10.971 1.00 17.14 C ATOM 406 CD PRO E 57 37.848 62.632 10.681 1.00 16.28 C ATOM 407 N PHE E 58 38.324 60.561 13.481 1.00 17.00 N ATOM 408 CA PHE E 58 38.531 60.308 14.911 1.00 16.77 C ATOM 409 C PHE E 58 37.597 59.252 15.461 1.00 16.41 C ATOM 410 O PHE E 58 37.532 59.011 16.660 1.00 16.58 O ATOM 411 CB PHE E 58 38.394 61.625 15.658 1.00 15.70 C ATOM 412 CG PHE E 58 39.236 62.726 15.036 1.00 18.86 C ATOM 413 CD1 PHE E 58 40.607 62.529 14.842 1.00 16.65 C ATOM 414 CD2 PHE E 58 38.649 63.927 14.582 1.00 19.48 C ATOM 415 CE1 PHE E 58 41.413 63.524 14.254 1.00 17.59 C ATOM 416 CE2 PHE E 58 39.414 64.925 13.969 1.00 19.49 C ATOM 417 CZ PHE E 58 40.795 64.755 13.790 1.00 18.87 C ATOM 418 N GLN E 59 36.855 58.631 14.557 1.00 16.35 N ATOM 419 CA GLN E 59 36.007 57.500 14.870 1.00 17.91 C ATOM 420 C GLN E 59 36.587 56.327 14.082 1.00 17.45 C ATOM 421 O GLN E 59 36.630 56.324 12.825 1.00 18.07 O ATOM 422 CB GLN E 59 34.531 57.771 14.460 1.00 19.45 C ATOM 423 CG GLN E 59 33.653 56.516 14.645 1.00 23.20 C ATOM 424 CD AGLN E 59 32.172 56.839 14.753 0.67 28.87 C ATOM 425 CD BGLN E 59 33.352 56.214 16.098 0.33 23.99 C ATOM 426 OE1AGLN E 59 31.792 57.814 15.396 0.67 34.87 O ATOM 427 OE1BGLN E 59 33.377 57.107 16.941 0.33 24.87 O ATOM 428 NE2AGLN E 59 31.338 56.020 14.129 0.67 32.43 N ATOM 429 NE2BGLN E 59 33.076 54.950 16.396 0.33 25.18 N ATOM 430 N ASP E 60 37.016 55.307 14.821 1.00 15.30 N ATOM 431 CA ASP E 60 37.592 54.161 14.178 1.00 15.22 C ATOM 432 C ASP E 60 36.625 52.978 14.333 1.00 15.41 C ATOM 433 O ASP E 60 36.549 52.367 15.380 1.00 15.92 O ATOM 434 CB ASP E 60 38.964 53.850 14.836 1.00 15.25 C ATOM 435 CG ASP E 60 39.555 52.531 14.341 1.00 16.33 C ATOM 436 OD1 ASP E 60 39.064 51.912 13.348 1.00 15.53 O ATOM 437 OD2 ASP E 60 40.560 52.030 14.901 1.00 13.04 O ATOM 438 N ASN E 61 35.848 52.717 13.275 1.00 16.77 N ATOM 439 CA ASN E 61 34.845 51.646 13.277 1.00 18.58 C ATOM 440 C ASN E 61 35.388 50.263 12.988 1.00 18.40 C ATOM 441 O ASN E 61 34.631 49.286 12.957 1.00 19.68 O ATOM 442 CB ASN E 61 33.767 52.009 12.236 1.00 19.51 C ATOM 443 CG ASN E 61 33.096 53.317 12.570 1.00 20.40 C ATOM 444 OD1 ASN E 61 32.542 53.463 13.662 1.00 24.21 O ATOM 445 ND2 ASN E 61 33.176 54.273 11.665 1.00 24.50 N ATOM 446 N ASN E 62 36.704 50.152 12.778 1.00 15.34 N ATOM 447 CA ASN E 62 37.309 48.853 12.480 1.00 14.28 C ATOM 448 C ASN E 62 38.086 48.327 13.697 1.00 14.28 C ATOM 449 O ASN E 62 37.953 47.158 14.086 1.00 14.69 O ATOM 450 CB ASN E 62 38.277 49.028 11.280 1.00 13.49 C ATOM 451 CG ASN E 62 39.020 47.773 10.961 1.00 13.56 C ATOM 452 OD1 ASN E 62 39.949 47.387 11.677 1.00 15.33 O ATOM 453 ND2 ASN E 62 38.595 47.065 9.892 1.00 15.07 N ATOM 454 N SER E 63 38.914 49.235 14.251 1.00 13.38 N ATOM 455 CA SER E 63 39.820 49.001 15.421 1.00 12.87 C ATOM 456 C SER E 63 41.308 48.988 15.037 1.00 12.37 C ATOM 457 O SER E 63 42.169 49.276 15.873 1.00 13.17 O ATOM 458 CB SER E 63 39.493 47.701 16.226 1.00 13.78 C ATOM 459 OG SER E 63 40.105 46.578 15.614 1.00 17.59 O ATOM 460 N HIS E 64 41.591 48.714 13.773 1.00 11.99 N ATOM 461 CA HIS E 64 42.959 48.474 13.317 1.00 11.74 C ATOM 462 C HIS E 64 43.781 49.762 13.421 1.00 11.34 C ATOM 463 O HIS E 64 44.941 49.703 13.900 1.00 12.02 O ATOM 464 CB HIS E 64 42.903 47.996 11.856 1.00 12.04 C ATOM 465 CG HIS E 64 44.235 47.747 11.215 1.00 11.45 C ATOM 466 ND1 HIS E 64 44.904 48.713 10.500 1.00 11.63 N ATOM 467 CD2 HIS E 64 44.960 46.604 11.075 1.00 11.42 C ATOM 468 CE1 HIS E 64 46.000 48.185 9.977 1.00 10.87 C ATOM 469 NE2 HIS E 64 46.051 46.908 10.295 1.00 13.83 N ATOM 470 N GLY E 65 43.239 50.886 12.944 1.00 11.40 N ATOM 471 CA GLY E 65 44.008 52.145 12.961 1.00 11.38 C ATOM 472 C GLY E 65 44.380 52.544 14.393 1.00 11.80 C ATOM 473 O GLY E 65 45.460 53.140 14.638 1.00 11.95 O ATOM 474 N THR E 66 43.488 52.275 15.333 1.00 12.11 N ATOM 475 CA THR E 66 43.736 52.620 16.743 1.00 11.96 C ATOM 476 C THR E 66 44.869 51.741 17.308 1.00 11.77 C ATOM 477 O THR E 66 45.704 52.226 18.062 1.00 10.89 O ATOM 478 CB THR E 66 42.414 52.433 17.527 1.00 12.76 C ATOM 479 OG1 THR E 66 41.463 53.386 17.010 1.00 13.79 O ATOM 480 CG2 THR E 66 42.596 52.784 19.043 1.00 11.88 C ATOM 481 N HIS E 67 44.893 50.477 16.918 1.00 11.25 N ATOM 482 CA HIS E 67 45.922 49.571 17.427 1.00 10.57 C ATOM 483 C HIS E 67 47.292 50.057 16.843 1.00 11.68 C ATOM 484 O HIS E 67 48.310 50.149 17.577 1.00 11.46 O ATOM 485 CB HIS E 67 45.572 48.138 16.976 1.00 10.63 C ATOM 486 CG HIS E 67 46.409 47.105 17.651 1.00 11.60 C ATOM 487 ND1 HIS E 67 47.710 46.827 17.264 1.00 10.51 N ATOM 488 CD2 HIS E 67 46.163 46.342 18.733 1.00 9.76 C ATOM 489 CE1 HIS E 67 48.204 45.903 18.057 1.00 8.95 C ATOM 490 NE2 HIS E 67 47.294 45.599 18.968 1.00 10.39 N ATOM 491 N VAL E 68 47.323 50.271 15.519 1.00 10.53 N ATOM 492 CA VAL E 68 48.540 50.772 14.876 1.00 10.28 C ATOM 493 C VAL E 68 49.011 52.060 15.556 1.00 10.73 C ATOM 494 O VAL E 68 50.245 52.234 15.835 1.00 10.24 O ATOM 495 CB VAL E 68 48.313 50.970 13.362 1.00 10.75 C ATOM 496 CG1 VAL E 68 49.484 51.716 12.659 1.00 9.95 C ATOM 497 CG2 VAL E 68 48.081 49.521 12.706 1.00 8.43 C ATOM 498 N ALA E 69 48.072 52.966 15.791 1.00 11.15 N ATOM 499 CA ALA E 69 48.439 54.253 16.385 1.00 10.14 C ATOM 500 C ALA E 69 49.089 54.066 17.751 1.00 10.95 C ATOM 501 O ALA E 69 50.020 54.790 18.098 1.00 10.55 O ATOM 502 CB ALA E 69 47.188 55.166 16.493 1.00 10.40 C ATOM 503 N GLY E 70 48.563 53.147 18.573 1.00 9.70 N ATOM 504 CA GLY E 70 49.130 52.933 19.904 1.00 9.94 C ATOM 505 C GLY E 70 50.525 52.355 19.885 1.00 10.70 C ATOM 506 O GLY E 70 51.357 52.650 20.755 1.00 10.12 O ATOM 507 N THR E 71 50.844 51.582 18.856 1.00 9.86 N ATOM 508 CA THR E 71 52.235 51.147 18.733 1.00 9.42 C ATOM 509 C THR E 71 53.152 52.335 18.379 1.00 10.14 C ATOM 510 O THR E 71 54.254 52.459 18.938 1.00 10.38 O ATOM 511 CB THR E 71 52.336 50.035 17.691 1.00 10.49 C ATOM 512 OG1 THR E 71 51.607 48.884 18.163 1.00 10.94 O ATOM 513 CG2 THR E 71 53.849 49.574 17.500 1.00 10.31 C ATOM 514 N VAL E 72 52.682 53.219 17.515 1.00 9.19 N ATOM 515 CA VAL E 72 53.473 54.418 17.201 1.00 9.77 C ATOM 516 C VAL E 72 53.667 55.264 18.461 1.00 9.83 C ATOM 517 O VAL E 72 54.780 55.737 18.741 1.00 11.06 O ATOM 518 CB VAL E 72 52.821 55.282 16.111 1.00 9.84 C ATOM 519 CG1 VAL E 72 53.764 56.512 15.775 1.00 11.41 C ATOM 520 CG2 VAL E 72 52.642 54.438 14.841 1.00 8.98 C ATOM 521 N ALA E 73 52.575 55.526 19.175 1.00 10.24 N ATOM 522 CA ALA E 73 52.575 56.722 20.035 1.00 11.06 C ATOM 523 C ALA E 73 51.657 56.635 21.259 1.00 10.97 C ATOM 524 O ALA E 73 51.281 57.691 21.820 1.00 10.25 O ATOM 525 CB ALA E 73 52.229 57.994 19.183 1.00 12.33 C ATOM 526 N ALA E 74 51.320 55.423 21.745 1.00 10.65 N ATOM 527 CA ALA E 74 50.567 55.413 23.013 1.00 10.51 C ATOM 528 C ALA E 74 51.339 56.241 24.083 1.00 9.81 C ATOM 529 O ALA E 74 52.577 56.190 24.194 1.00 9.81 O ATOM 530 CB ALA E 74 50.320 53.987 23.505 1.00 9.82 C ATOM 531 N LEU E 75 50.584 56.986 24.864 1.00 9.28 N ATOM 532 CA LEU E 75 51.175 58.004 25.742 1.00 10.32 C ATOM 533 C LEU E 75 51.983 57.401 26.918 1.00 10.13 C ATOM 534 O LEU E 75 51.703 56.314 27.417 1.00 11.00 O ATOM 535 CB LEU E 75 50.044 58.839 26.363 1.00 9.93 C ATOM 536 CG LEU E 75 49.217 59.623 25.326 1.00 11.49 C ATOM 537 CD1 LEU E 75 48.012 60.205 26.083 1.00 11.62 C ATOM 538 CD2 LEU E 75 50.073 60.751 24.701 1.00 12.16 C ATOM 539 N ASN E 76 52.968 58.181 27.367 1.00 10.49 N ATOM 540 CA ASN E 76 53.790 57.781 28.488 1.00 11.09 C ATOM 541 C ASN E 76 53.140 58.376 29.744 1.00 11.58 C ATOM 542 O ASN E 76 53.140 59.618 29.972 1.00 12.91 O ATOM 543 CB ASN E 76 55.199 58.380 28.288 1.00 10.71 C ATOM 544 CG ASN E 76 56.149 57.974 29.424 1.00 12.66 C ATOM 545 OD1 ASN E 76 55.896 56.956 30.070 1.00 11.65 O ATOM 546 ND2 ASN E 76 57.224 58.800 29.708 1.00 12.68 N ATOM 547 N ASN E 77 52.552 57.490 30.531 1.00 11.60 N ATOM 548 CA ASN E 77 51.746 57.887 31.681 1.00 10.98 C ATOM 549 C ASN E 77 51.647 56.653 32.583 1.00 12.02 C ATOM 550 O ASN E 77 52.534 55.778 32.533 1.00 11.66 O ATOM 551 CB ASN E 77 50.379 58.427 31.212 1.00 11.32 C ATOM 552 CG ASN E 77 49.665 57.461 30.304 1.00 10.72 C ATOM 553 OD1 ASN E 77 49.956 56.241 30.320 1.00 11.42 O ATOM 554 ND2 ASN E 77 48.691 57.992 29.510 1.00 13.24 N ATOM 555 N SER E 78 50.656 56.615 33.475 1.00 10.99 N ATOM 556 CA SER E 78 50.557 55.462 34.346 1.00 12.57 C ATOM 557 C SER E 78 49.467 54.477 33.909 1.00 11.89 C ATOM 558 O SER E 78 49.012 53.675 34.712 1.00 11.76 O ATOM 559 CB SER E 78 50.367 55.922 35.816 1.00 13.66 C ATOM 560 OG SER E 78 49.126 56.622 35.926 1.00 16.04 O ATOM 561 N ILE E 79 49.108 54.457 32.632 1.00 12.76 N ATOM 562 CA ILE E 79 48.089 53.534 32.196 1.00 12.98 C ATOM 563 C ILE E 79 48.461 52.822 30.903 1.00 12.79 C ATOM 564 O ILE E 79 49.315 53.307 30.145 1.00 11.28 O ATOM 565 CB ILE E 79 46.722 54.263 31.948 1.00 14.11 C ATOM 566 CG1 ILE E 79 46.863 55.279 30.832 1.00 13.81 C ATOM 567 CG2 ILE E 79 46.173 54.944 33.238 1.00 15.80 C ATOM 568 CD1 ILE E 79 45.448 55.697 30.247 1.00 15.66 C ATOM 569 N GLY E 80 47.754 51.715 30.649 1.00 11.46 N ATOM 570 CA GLY E 80 47.792 51.110 29.325 1.00 11.57 C ATOM 571 C GLY E 80 49.165 50.636 28.886 1.00 11.82 C ATOM 572 O GLY E 80 49.906 49.991 29.647 1.00 12.47 O ATOM 573 N VAL E 81 49.494 51.005 27.659 1.00 10.89 N ATOM 574 CA VAL E 81 50.778 50.590 27.091 1.00 11.01 C ATOM 575 C VAL E 81 51.630 51.859 26.891 1.00 11.86 C ATOM 576 O VAL E 81 51.189 52.969 27.182 1.00 15.85 O ATOM 577 CB VAL E 81 50.558 49.834 25.745 1.00 11.17 C ATOM 578 CG1 VAL E 81 49.906 48.438 25.986 1.00 11.81 C ATOM 579 CG2 VAL E 81 49.684 50.654 24.741 1.00 11.49 C ATOM 580 N LEU E 82 52.811 51.692 26.331 1.00 13.26 N ATOM 581 CA LEU E 82 53.734 52.804 26.031 1.00 11.42 C ATOM 582 C LEU E 82 54.070 52.652 24.580 1.00 11.33 C ATOM 583 O LEU E 82 54.420 51.543 24.125 1.00 12.35 O ATOM 584 CB LEU E 82 55.012 52.608 26.844 1.00 10.73 C ATOM 585 CG LEU E 82 56.127 53.651 26.547 1.00 10.94 C ATOM 586 CD1 LEU E 82 55.668 55.077 26.943 1.00 9.98 C ATOM 587 CD2 LEU E 82 57.450 53.245 27.286 1.00 12.49 C ATOM 588 N GLY E 83 53.914 53.733 23.824 1.00 10.16 N ATOM 589 CA GLY E 83 54.243 53.764 22.407 1.00 10.08 C ATOM 590 C GLY E 83 55.741 53.836 22.157 1.00 11.23 C ATOM 591 O GLY E 83 56.536 54.176 23.050 1.00 11.12 O ATOM 592 N VAL E 84 56.123 53.493 20.933 1.00 10.77 N ATOM 593 CA VAL E 84 57.530 53.690 20.556 1.00 10.42 C ATOM 594 C VAL E 84 57.956 55.168 20.675 1.00 10.46 C ATOM 595 O VAL E 84 59.045 55.428 21.167 1.00 10.33 O ATOM 596 CB VAL E 84 57.796 53.167 19.136 1.00 11.26 C ATOM 597 CG1 VAL E 84 59.233 53.474 18.683 1.00 9.56 C ATOM 598 CG2 VAL E 84 57.576 51.596 19.090 1.00 10.33 C ATOM 599 N ALA E 85 57.101 56.082 20.198 1.00 9.73 N ATOM 600 CA ALA E 85 57.378 57.519 20.180 1.00 10.18 C ATOM 601 C ALA E 85 56.208 58.241 20.880 1.00 9.42 C ATOM 602 O ALA E 85 55.339 58.799 20.208 1.00 9.49 O ATOM 603 CB ALA E 85 57.522 57.997 18.654 1.00 10.51 C ATOM 604 N PRO E 86 56.170 58.157 22.212 1.00 9.71 N ATOM 605 CA PRO E 86 54.956 58.509 22.969 1.00 10.48 C ATOM 606 C PRO E 86 54.696 60.011 22.946 1.00 11.10 C ATOM 607 O PRO E 86 53.592 60.363 23.319 1.00 11.22 O ATOM 608 CB PRO E 86 55.271 58.013 24.375 1.00 12.19 C ATOM 609 CG PRO E 86 56.796 58.056 24.443 1.00 10.36 C ATOM 610 CD PRO E 86 57.189 57.537 23.087 1.00 9.52 C ATOM 611 N SER E 87 55.654 60.856 22.533 1.00 10.61 N ATOM 612 CA SER E 87 55.355 62.321 22.389 1.00 11.90 C ATOM 613 C SER E 87 55.053 62.742 20.949 1.00 11.28 C ATOM 614 O SER E 87 54.920 63.925 20.648 1.00 12.30 O ATOM 615 CB SER E 87 56.516 63.172 22.922 1.00 11.04 C ATOM 616 OG SER E 87 56.711 62.851 24.296 1.00 13.20 O ATOM 617 N ALA E 88 55.019 61.793 20.015 1.00 11.60 N ATOM 618 CA ALA E 88 54.793 62.185 18.636 1.00 11.45 C ATOM 619 C ALA E 88 53.454 62.887 18.460 1.00 12.26 C ATOM 620 O ALA E 88 52.476 62.603 19.174 1.00 12.78 O ATOM 621 CB ALA E 88 54.830 60.928 17.699 1.00 11.97 C ATOM 622 N SER E 89 53.397 63.746 17.448 1.00 11.61 N ATOM 623 CA SER E 89 52.137 64.396 17.058 1.00 12.42 C ATOM 624 C SER E 89 51.463 63.443 16.101 1.00 12.75 C ATOM 625 O SER E 89 51.945 63.218 14.989 1.00 12.59 O ATOM 626 CB SER E 89 52.436 65.733 16.356 1.00 14.53 C ATOM 627 OG SER E 89 52.927 66.633 17.347 1.00 15.70 O ATOM 628 N LEU E 90 50.373 62.851 16.564 1.00 12.54 N ATOM 629 CA LEU E 90 49.714 61.771 15.846 1.00 12.81 C ATOM 630 C LEU E 90 48.558 62.273 15.005 1.00 13.71 C ATOM 631 O LEU E 90 47.651 62.889 15.551 1.00 14.34 O ATOM 632 CB LEU E 90 49.198 60.786 16.914 1.00 13.62 C ATOM 633 CG LEU E 90 48.539 59.467 16.632 1.00 18.14 C ATOM 634 CD1 LEU E 90 49.581 58.574 15.875 1.00 16.35 C ATOM 635 CD2 LEU E 90 48.108 58.783 17.927 1.00 16.89 C ATOM 636 N TYR E 91 48.514 61.916 13.726 1.00 13.08 N ATOM 637 CA TYR E 91 47.418 62.353 12.819 1.00 12.88 C ATOM 638 C TYR E 91 46.640 61.160 12.303 1.00 13.00 C ATOM 639 O TYR E 91 47.215 60.192 11.813 1.00 13.39 O ATOM 640 CB TYR E 91 47.973 63.174 11.651 1.00 12.07 C ATOM 641 CG TYR E 91 48.531 64.485 12.178 1.00 11.22 C ATOM 642 CD1 TYR E 91 49.802 64.519 12.791 1.00 12.59 C ATOM 643 CD2 TYR E 91 47.767 65.660 12.132 1.00 14.79 C ATOM 644 CE1 TYR E 91 50.314 65.700 13.330 1.00 12.92 C ATOM 645 CE2 TYR E 91 48.265 66.847 12.692 1.00 14.84 C ATOM 646 CZ TYR E 91 49.541 66.850 13.251 1.00 16.29 C ATOM 647 OH TYR E 91 50.110 67.990 13.802 1.00 20.60 O ATOM 648 N ALA E 92 45.319 61.208 12.487 1.00 12.60 N ATOM 649 CA ALA E 92 44.463 60.148 11.965 1.00 13.49 C ATOM 650 C ALA E 92 44.092 60.484 10.511 1.00 13.89 C ATOM 651 O ALA E 92 43.299 61.421 10.274 1.00 14.51 O ATOM 652 CB ALA E 92 43.149 60.072 12.839 1.00 13.24 C ATOM 653 N VAL E 93 44.616 59.700 9.551 1.00 12.56 N ATOM 654 CA VAL E 93 44.332 59.949 8.135 1.00 14.13 C ATOM 655 C VAL E 93 43.538 58.760 7.694 1.00 13.76 C ATOM 656 O VAL E 93 44.084 57.723 7.356 1.00 13.33 O ATOM 657 CB VAL E 93 45.626 60.191 7.300 1.00 13.60 C ATOM 658 CG1 VAL E 93 45.232 60.460 5.795 1.00 13.50 C ATOM 659 CG2 VAL E 93 46.403 61.403 7.910 1.00 15.11 C ATOM 660 N LYS E 94 42.203 58.908 7.754 1.00 14.34 N ATOM 661 CA LYS E 94 41.322 57.779 7.564 1.00 14.33 C ATOM 662 C LYS E 94 41.113 57.562 6.061 1.00 15.21 C ATOM 663 O LYS E 94 40.559 58.427 5.383 1.00 15.11 O ATOM 664 CB LYS E 94 39.968 58.020 8.265 1.00 14.70 C ATOM 665 CG LYS E 94 39.047 56.788 8.151 1.00 16.44 C ATOM 666 CD LYS E 94 37.621 57.097 8.578 1.00 22.21 C ATOM 667 CE LYS E 94 37.375 56.668 9.910 1.00 25.94 C ATOM 668 NZ LYS E 94 35.879 56.514 10.253 1.00 20.74 N ATOM 669 N VAL E 95 41.586 56.418 5.571 1.00 13.16 N ATOM 670 CA VAL E 95 41.405 56.024 4.175 1.00 14.83 C ATOM 671 C VAL E 95 40.779 54.642 4.010 1.00 14.78 C ATOM 672 O VAL E 95 40.600 54.190 2.854 1.00 14.41 O ATOM 673 CB VAL E 95 42.750 56.014 3.427 1.00 14.70 C ATOM 674 CG1 VAL E 95 43.397 57.460 3.576 1.00 15.03 C ATOM 675 CG2 VAL E 95 43.698 54.908 3.950 1.00 14.28 C ATOM 676 N LEU E 96 40.496 53.983 5.144 1.00 15.45 N ATOM 677 CA LEU E 96 39.907 52.631 5.142 1.00 17.00 C ATOM 678 C LEU E 96 38.587 52.747 5.937 1.00 16.75 C ATOM 679 O LEU E 96 38.524 53.448 6.958 1.00 16.13 O ATOM 680 CB LEU E 96 40.827 51.592 5.833 1.00 15.52 C ATOM 681 CG LEU E 96 42.249 51.504 5.270 1.00 16.61 C ATOM 682 CD1 LEU E 96 43.096 50.489 6.025 1.00 13.89 C ATOM 683 CD2 LEU E 96 42.194 51.126 3.771 1.00 15.29 C ATOM 684 N GLY E 97 37.518 52.118 5.428 1.00 18.80 N ATOM 685 CA GLY E 97 36.264 52.109 6.162 1.00 18.87 C ATOM 686 C GLY E 97 36.227 50.986 7.177 1.00 19.89 C ATOM 687 O GLY E 97 37.224 50.241 7.389 1.00 19.07 O ATOM 688 N ALA E 98 35.075 50.863 7.835 1.00 17.34 N ATOM 689 CA ALA E 98 34.858 49.842 8.848 1.00 18.15 C ATOM 690 C ALA E 98 35.297 48.442 8.444 1.00 17.84 C ATOM 691 O ALA E 98 35.780 47.665 9.296 1.00 16.27 O ATOM 692 CB ALA E 98 33.347 49.811 9.283 1.00 16.97 C ATOM 693 N ASP E 99 35.103 48.094 7.163 1.00 17.14 N ATOM 694 CA ASP E 99 35.422 46.735 6.739 1.00 17.53 C ATOM 695 C ASP E 99 36.897 46.489 6.466 1.00 16.86 C ATOM 696 O ASP E 99 37.264 45.400 6.019 1.00 16.64 O ATOM 697 CB ASP E 99 34.535 46.238 5.549 1.00 18.39 C ATOM 698 CG ASP E 99 34.792 46.974 4.267 1.00 21.89 C ATOM 699 OD1 ASP E 99 35.796 47.735 4.159 1.00 17.58 O ATOM 700 OD2 ASP E 99 34.002 46.870 3.295 1.00 23.64 O ATOM 701 N GLY E 100 37.753 47.493 6.705 1.00 16.23 N ATOM 702 CA GLY E 100 39.183 47.259 6.532 1.00 15.71 C ATOM 703 C GLY E 100 39.719 47.591 5.148 1.00 15.28 C ATOM 704 O GLY E 100 40.891 47.367 4.881 1.00 14.54 O ATOM 705 N SER E 101 38.856 48.093 4.256 1.00 15.20 N ATOM 706 CA SER E 101 39.224 48.260 2.844 1.00 14.95 C ATOM 707 C SER E 101 39.051 49.718 2.401 1.00 15.14 C ATOM 708 O SER E 101 38.226 50.437 2.941 1.00 15.69 O ATOM 709 CB SER E 101 38.417 47.308 1.964 1.00 15.48 C ATOM 710 OG ASER E 101 37.132 47.887 1.739 0.67 12.20 O ATOM 711 OG BSER E 101 38.042 47.867 0.727 0.33 16.38 O ATOM 712 N GLY E 102 39.821 50.135 1.405 1.00 14.80 N ATOM 713 CA GLY E 102 39.658 51.457 0.808 1.00 15.02 C ATOM 714 C GLY E 102 40.002 51.392 -0.662 1.00 16.14 C ATOM 715 O GLY E 102 40.792 50.558 -1.112 1.00 16.48 O ATOM 716 N GLN E 103 39.439 52.327 -1.410 1.00 16.64 N ATOM 717 CA GLN E 103 39.757 52.459 -2.820 1.00 18.32 C ATOM 718 C GLN E 103 41.136 53.091 -2.961 1.00 18.38 C ATOM 719 O GLN E 103 41.539 53.901 -2.095 1.00 18.48 O ATOM 720 CB AGLN E 103 38.668 53.334 -3.465 0.67 18.62 C ATOM 721 CB BGLN E 103 38.708 53.351 -3.502 0.33 18.29 C ATOM 722 CG AGLN E 103 37.348 52.544 -3.556 0.67 21.39 C ATOM 723 CG BGLN E 103 37.369 52.646 -3.772 0.33 19.99 C ATOM 724 CD AGLN E 103 36.201 53.313 -4.149 0.67 26.64 C ATOM 725 CD BGLN E 103 37.471 51.509 -4.781 0.33 22.02 C ATOM 726 OE1AGLN E 103 36.398 54.232 -4.951 0.67 28.73 O ATOM 727 OE1BGLN E 103 38.246 51.577 -5.734 0.33 23.50 O ATOM 728 NE2AGLN E 103 34.983 52.921 -3.784 0.67 29.40 N ATOM 729 NE2BGLN E 103 36.678 50.460 -4.572 0.33 25.40 N ATOM 730 N TYR E 104 41.851 52.770 -4.040 1.00 17.27 N ATOM 731 CA TYR E 104 43.163 53.384 -4.245 1.00 18.84 C ATOM 732 C TYR E 104 43.128 54.912 -4.164 1.00 19.34 C ATOM 733 O TYR E 104 43.991 55.512 -3.558 1.00 18.70 O ATOM 734 CB TYR E 104 43.791 52.953 -5.586 1.00 18.77 C ATOM 735 CG TYR E 104 44.519 51.621 -5.522 1.00 20.11 C ATOM 736 CD1 TYR E 104 43.863 50.455 -5.051 1.00 22.04 C ATOM 737 CD2 TYR E 104 45.868 51.501 -5.937 1.00 21.58 C ATOM 738 CE1 TYR E 104 44.533 49.227 -5.002 1.00 22.30 C ATOM 739 CE2 TYR E 104 46.531 50.255 -5.890 1.00 22.66 C ATOM 740 CZ TYR E 104 45.855 49.137 -5.412 1.00 25.07 C ATOM 741 OH TYR E 104 46.469 47.907 -5.317 1.00 28.00 O ATOM 742 N SER E 105 42.148 55.545 -4.796 1.00 18.75 N ATOM 743 CA SER E 105 42.078 57.006 -4.720 1.00 19.40 C ATOM 744 C SER E 105 41.952 57.562 -3.279 1.00 18.28 C ATOM 745 O SER E 105 42.456 58.655 -3.003 1.00 18.14 O ATOM 746 CB SER E 105 40.927 57.542 -5.593 1.00 20.51 C ATOM 747 OG SER E 105 39.690 57.130 -5.031 1.00 21.07 O ATOM 748 N TRP E 106 41.322 56.820 -2.363 1.00 17.24 N ATOM 749 CA TRP E 106 41.240 57.251 -0.964 1.00 18.14 C ATOM 750 C TRP E 106 42.628 57.242 -0.317 1.00 17.59 C ATOM 751 O TRP E 106 42.985 58.198 0.375 1.00 17.29 O ATOM 752 CB TRP E 106 40.328 56.332 -0.153 1.00 18.12 C ATOM 753 CG TRP E 106 38.902 56.173 -0.728 1.00 18.16 C ATOM 754 CD1 TRP E 106 38.326 56.865 -1.807 1.00 20.37 C ATOM 755 CD2 TRP E 106 37.901 55.262 -0.260 1.00 19.27 C ATOM 756 NE1 TRP E 106 37.035 56.416 -1.994 1.00 21.62 N ATOM 757 CE2 TRP E 106 36.751 55.429 -1.083 1.00 19.59 C ATOM 758 CE3 TRP E 106 37.849 54.333 0.793 1.00 17.49 C ATOM 759 CZ2 TRP E 106 35.588 54.680 -0.904 1.00 20.92 C ATOM 760 CZ3 TRP E 106 36.690 53.579 0.972 1.00 20.67 C ATOM 761 CH2 TRP E 106 35.571 53.759 0.116 1.00 19.30 C ATOM 762 N ILE E 107 43.393 56.177 -0.575 1.00 16.36 N ATOM 763 CA ILE E 107 44.751 56.048 0.004 1.00 15.72 C ATOM 764 C ILE E 107 45.606 57.188 -0.558 1.00 15.95 C ATOM 765 O ILE E 107 46.310 57.915 0.190 1.00 16.60 O ATOM 766 CB ILE E 107 45.366 54.661 -0.344 1.00 16.73 C ATOM 767 CG1 ILE E 107 44.903 53.555 0.637 1.00 18.43 C ATOM 768 CG2 ILE E 107 46.925 54.681 -0.161 1.00 17.66 C ATOM 769 CD1 ILE E 107 43.417 53.210 0.656 1.00 20.11 C ATOM 770 N ILE E 108 45.499 57.394 -1.872 1.00 14.47 N ATOM 771 CA ILE E 108 46.269 58.441 -2.538 1.00 16.02 C ATOM 772 C ILE E 108 45.879 59.820 -1.993 1.00 16.48 C ATOM 773 O ILE E 108 46.753 60.633 -1.687 1.00 16.76 O ATOM 774 CB ILE E 108 46.061 58.371 -4.090 1.00 17.61 C ATOM 775 CG1 ILE E 108 46.820 57.168 -4.644 1.00 16.55 C ATOM 776 CG2 ILE E 108 46.630 59.678 -4.804 1.00 17.23 C ATOM 777 CD1 ILE E 108 46.329 56.753 -6.086 1.00 19.41 C ATOM 778 N ASN E 109 44.582 60.076 -1.835 1.00 15.51 N ATOM 779 CA ASN E 109 44.152 61.349 -1.251 1.00 17.16 C ATOM 780 C ASN E 109 44.714 61.538 0.183 1.00 17.09 C ATOM 781 O ASN E 109 45.068 62.660 0.594 1.00 16.95 O ATOM 782 CB ASN E 109 42.615 61.478 -1.199 1.00 17.00 C ATOM 783 CG ASN E 109 42.017 61.737 -2.559 1.00 21.45 C ATOM 784 OD1 ASN E 109 42.721 62.122 -3.485 1.00 24.24 O ATOM 785 ND2 ASN E 109 40.722 61.489 -2.690 1.00 22.48 N ATOM 786 N GLY E 110 44.811 60.434 0.933 1.00 15.99 N ATOM 787 CA GLY E 110 45.371 60.515 2.286 1.00 15.01 C ATOM 788 C GLY E 110 46.871 60.848 2.243 1.00 14.98 C ATOM 789 O GLY E 110 47.376 61.626 3.075 1.00 14.30 O ATOM 790 N ILE E 111 47.601 60.213 1.321 1.00 13.50 N ATOM 791 CA ILE E 111 49.029 60.525 1.155 1.00 14.18 C ATOM 792 C ILE E 111 49.204 61.997 0.747 1.00 15.17 C ATOM 793 O ILE E 111 50.037 62.700 1.316 1.00 14.51 O ATOM 794 CB ILE E 111 49.687 59.579 0.103 1.00 14.17 C ATOM 795 CG1 ILE E 111 49.686 58.135 0.610 1.00 14.59 C ATOM 796 CG2 ILE E 111 51.143 59.996 -0.217 1.00 13.01 C ATOM 797 CD1 ILE E 111 49.900 57.118 -0.514 1.00 14.15 C ATOM 798 N GLU E 112 48.371 62.468 -0.187 1.00 15.96 N ATOM 799 CA GLU E 112 48.433 63.897 -0.563 1.00 16.33 C ATOM 800 C GLU E 112 48.140 64.811 0.606 1.00 16.03 C ATOM 801 O GLU E 112 48.811 65.869 0.738 1.00 16.60 O ATOM 802 CB GLU E 112 47.488 64.185 -1.755 1.00 18.05 C ATOM 803 CG GLU E 112 47.905 63.442 -3.017 1.00 18.35 C ATOM 804 CD GLU E 112 49.019 64.137 -3.808 1.00 27.49 C ATOM 805 OE1 GLU E 112 49.632 65.150 -3.326 1.00 24.55 O ATOM 806 OE2 GLU E 112 49.296 63.663 -4.944 1.00 30.83 O ATOM 807 N TRP E 113 47.150 64.467 1.438 1.00 14.28 N ATOM 808 CA TRP E 113 46.854 65.283 2.632 1.00 15.25 C ATOM 809 C TRP E 113 48.100 65.334 3.535 1.00 15.69 C ATOM 810 O TRP E 113 48.479 66.390 4.049 1.00 15.18 O ATOM 811 CB TRP E 113 45.638 64.718 3.415 1.00 14.60 C ATOM 812 CG TRP E 113 45.245 65.541 4.571 1.00 16.91 C ATOM 813 CD1 TRP E 113 44.289 66.526 4.586 1.00 19.55 C ATOM 814 CD2 TRP E 113 45.818 65.514 5.893 1.00 17.88 C ATOM 815 NE1 TRP E 113 44.213 67.089 5.838 1.00 18.90 N ATOM 816 CE2 TRP E 113 45.146 66.488 6.657 1.00 18.32 C ATOM 817 CE3 TRP E 113 46.817 64.731 6.523 1.00 16.27 C ATOM 818 CZ2 TRP E 113 45.432 66.718 8.015 1.00 18.45 C ATOM 819 CZ3 TRP E 113 47.146 64.999 7.873 1.00 18.63 C ATOM 820 CH2 TRP E 113 46.434 65.971 8.604 1.00 16.33 C ATOM 821 N ALA E 114 48.740 64.179 3.705 1.00 15.29 N ATOM 822 CA ALA E 114 49.907 64.098 4.583 1.00 15.18 C ATOM 823 C ALA E 114 50.998 65.030 4.073 1.00 15.65 C ATOM 824 O ALA E 114 51.612 65.781 4.864 1.00 15.92 O ATOM 825 CB ALA E 114 50.361 62.630 4.673 1.00 15.87 C ATOM 826 N ILE E 115 51.230 65.024 2.748 1.00 16.05 N ATOM 827 CA ILE E 115 52.263 65.893 2.144 1.00 16.07 C ATOM 828 C ILE E 115 51.904 67.365 2.375 1.00 17.13 C ATOM 829 O ILE E 115 52.749 68.160 2.845 1.00 17.16 O ATOM 830 CB ILE E 115 52.420 65.616 0.654 1.00 16.42 C ATOM 831 CG1 ILE E 115 52.946 64.204 0.430 1.00 16.82 C ATOM 832 CG2 ILE E 115 53.416 66.622 0.029 1.00 17.63 C ATOM 833 CD1 ILE E 115 52.741 63.709 -1.059 1.00 14.99 C ATOM 834 N ALA E 116 50.639 67.696 2.124 1.00 16.63 N ATOM 835 CA ALA E 116 50.144 69.106 2.195 1.00 18.11 C ATOM 836 C ALA E 116 50.180 69.621 3.628 1.00 18.25 C ATOM 837 O ALA E 116 50.283 70.823 3.854 1.00 18.71 O ATOM 838 CB ALA E 116 48.703 69.232 1.647 1.00 18.90 C ATOM 839 N ASN E 117 50.101 68.704 4.607 1.00 16.88 N ATOM 840 CA ASN E 117 50.117 69.063 6.014 1.00 16.99 C ATOM 841 C ASN E 117 51.459 68.834 6.732 1.00 15.68 C ATOM 842 O ASN E 117 51.526 68.855 7.977 1.00 16.46 O ATOM 843 CB ASN E 117 48.937 68.371 6.702 1.00 16.24 C ATOM 844 CG ASN E 117 47.597 69.032 6.302 1.00 19.37 C ATOM 845 OD1 ASN E 117 47.172 70.002 6.934 1.00 22.71 O ATOM 846 ND2 ASN E 117 46.976 68.551 5.227 1.00 17.28 N ATOM 847 N ASN E 118 52.515 68.664 5.946 1.00 15.71 N ATOM 848 CA ASN E 118 53.890 68.621 6.424 1.00 15.83 C ATOM 849 C ASN E 118 54.143 67.490 7.424 1.00 16.20 C ATOM 850 O ASN E 118 54.858 67.672 8.386 1.00 16.10 O ATOM 851 CB ASN E 118 54.318 69.983 7.020 1.00 17.95 C ATOM 852 CG ASN E 118 54.112 71.128 6.003 1.00 21.63 C ATOM 853 OD1 ASN E 118 54.572 71.047 4.877 1.00 25.08 O ATOM 854 ND2 ASN E 118 53.369 72.146 6.390 1.00 29.18 N ATOM 855 N MET E 119 53.567 66.319 7.150 1.00 14.96 N ATOM 856 CA MET E 119 53.830 65.141 7.986 1.00 13.32 C ATOM 857 C MET E 119 55.296 64.760 7.791 1.00 14.23 C ATOM 858 O MET E 119 55.817 64.848 6.687 1.00 15.85 O ATOM 859 CB MET E 119 52.946 63.971 7.513 1.00 14.10 C ATOM 860 CG MET E 119 51.451 64.177 7.811 1.00 13.04 C ATOM 861 SD MET E 119 51.039 64.340 9.565 1.00 14.52 S ATOM 862 CE MET E 119 50.518 66.144 9.675 1.00 12.83 C ATOM 863 N ASP E 120 55.976 64.400 8.882 1.00 12.96 N ATOM 864 CA ASP E 120 57.366 63.925 8.813 1.00 11.68 C ATOM 865 C ASP E 120 57.473 62.441 8.490 1.00 11.83 C ATOM 866 O ASP E 120 58.448 61.985 7.881 1.00 11.43 O ATOM 867 CB ASP E 120 58.035 64.159 10.172 1.00 12.75 C ATOM 868 CG ASP E 120 58.087 65.665 10.521 1.00 15.70 C ATOM 869 OD1 ASP E 120 58.725 66.433 9.730 1.00 14.94 O ATOM 870 OD2 ASP E 120 57.493 66.152 11.511 1.00 13.06 O ATOM 871 N VAL E 121 56.447 61.694 8.905 1.00 10.85 N ATOM 872 CA VAL E 121 56.450 60.234 8.738 1.00 10.54 C ATOM 873 C VAL E 121 55.023 59.820 8.372 1.00 10.49 C ATOM 874 O VAL E 121 54.052 60.366 8.899 1.00 11.62 O ATOM 875 CB VAL E 121 56.800 59.525 10.099 1.00 11.03 C ATOM 876 CG1 VAL E 121 56.898 57.983 9.922 1.00 9.59 C ATOM 877 CG2 VAL E 121 58.138 60.028 10.680 1.00 10.77 C ATOM 878 N ILE E 122 54.917 58.867 7.444 1.00 10.57 N ATOM 879 CA ILE E 122 53.665 58.188 7.144 1.00 11.18 C ATOM 880 C ILE E 122 53.834 56.717 7.478 1.00 11.92 C ATOM 881 O ILE E 122 54.848 56.096 7.119 1.00 12.71 O ATOM 882 CB ILE E 122 53.372 58.305 5.622 1.00 11.90 C ATOM 883 CG1 ILE E 122 52.860 59.711 5.304 1.00 11.26 C ATOM 884 CG2 ILE E 122 52.350 57.195 5.157 1.00 11.62 C ATOM 885 CD1 ILE E 122 52.847 60.033 3.767 1.00 11.19 C ATOM 886 N ASN E 123 52.834 56.173 8.165 1.00 11.02 N ATOM 887 CA ASN E 123 52.735 54.723 8.350 1.00 10.63 C ATOM 888 C ASN E 123 51.539 54.258 7.564 1.00 11.02 C ATOM 889 O ASN E 123 50.433 54.793 7.733 1.00 11.61 O ATOM 890 CB ASN E 123 52.473 54.373 9.800 1.00 9.64 C ATOM 891 CG ASN E 123 52.480 52.881 9.998 1.00 10.35 C ATOM 892 OD1 ASN E 123 53.547 52.266 10.161 1.00 10.67 O ATOM 893 ND2 ASN E 123 51.294 52.270 10.003 1.00 10.03 N ATOM 894 N MET E 124 51.753 53.222 6.743 1.00 11.17 N ATOM 895 CA MET E 124 50.652 52.565 6.020 1.00 10.06 C ATOM 896 C MET E 124 50.643 51.054 6.326 1.00 10.64 C ATOM 897 O MET E 124 51.310 50.284 5.627 1.00 11.67 O ATOM 898 CB MET E 124 50.846 52.775 4.523 1.00 11.83 C ATOM 899 CG MET E 124 50.300 54.180 4.168 1.00 13.25 C ATOM 900 SD MET E 124 50.423 54.554 2.374 1.00 15.26 S ATOM 901 CE MET E 124 52.106 54.653 2.150 1.00 15.37 C ATOM 902 N SER E 125 49.861 50.666 7.334 1.00 11.51 N ATOM 903 CA SER E 125 49.730 49.270 7.690 1.00 10.94 C ATOM 904 C SER E 125 48.634 48.661 6.790 1.00 12.49 C ATOM 905 O SER E 125 47.576 48.247 7.268 1.00 11.82 O ATOM 906 CB SER E 125 49.384 49.164 9.169 1.00 10.36 C ATOM 907 OG SER E 125 50.578 49.407 9.944 1.00 10.77 O ATOM 908 N LEU E 126 48.926 48.646 5.500 1.00 12.56 N ATOM 909 CA LEU E 126 47.899 48.337 4.526 1.00 12.92 C ATOM 910 C LEU E 126 48.564 47.919 3.238 1.00 12.94 C ATOM 911 O LEU E 126 49.784 48.104 3.016 1.00 13.34 O ATOM 912 CB LEU E 126 46.934 49.548 4.345 1.00 12.73 C ATOM 913 CG LEU E 126 47.507 50.952 4.087 1.00 13.75 C ATOM 914 CD1 LEU E 126 48.256 50.992 2.734 1.00 16.57 C ATOM 915 CD2 LEU E 126 46.402 52.023 4.130 1.00 16.57 C ATOM 916 N GLY E 127 47.768 47.331 2.346 1.00 14.10 N ATOM 917 CA GLY E 127 48.408 46.929 1.100 1.00 15.54 C ATOM 918 C GLY E 127 47.441 46.224 0.161 1.00 17.38 C ATOM 919 O GLY E 127 46.274 45.949 0.507 1.00 15.92 O ATOM 920 N GLY E 128 47.940 45.981 -1.043 1.00 17.22 N ATOM 921 CA GLY E 128 47.197 45.180 -2.019 1.00 18.72 C ATOM 922 C GLY E 128 48.184 44.577 -2.985 1.00 20.40 C ATOM 923 O GLY E 128 49.331 44.981 -3.070 1.00 18.16 O ATOM 924 N PRO E 129 47.736 43.578 -3.746 1.00 21.79 N ATOM 925 CA PRO E 129 48.647 42.842 -4.630 1.00 22.19 C ATOM 926 C PRO E 129 49.008 43.551 -5.914 1.00 23.54 C ATOM 927 O PRO E 129 50.011 43.132 -6.514 1.00 25.07 O ATOM 928 CB PRO E 129 47.874 41.556 -4.936 1.00 22.53 C ATOM 929 CG PRO E 129 46.467 41.968 -4.818 1.00 21.84 C ATOM 930 CD PRO E 129 46.380 42.999 -3.698 1.00 22.35 C ATOM 931 N SER E 130 48.285 44.586 -6.319 1.00 24.22 N ATOM 932 CA SER E 130 48.645 45.272 -7.558 1.00 26.88 C ATOM 933 C SER E 130 49.071 46.703 -7.255 1.00 27.10 C ATOM 934 O SER E 130 48.578 47.316 -6.320 1.00 29.52 O ATOM 935 CB SER E 130 47.466 45.332 -8.539 1.00 26.57 C ATOM 936 OG ASER E 130 46.312 45.879 -7.933 0.33 25.76 O ATOM 937 OG BSER E 130 46.575 44.249 -8.332 0.67 28.13 O ATOM 938 N GLY E 131 49.957 47.248 -8.045 1.00 27.50 N ATOM 939 CA GLY E 131 50.197 48.658 -7.821 1.00 27.54 C ATOM 940 C GLY E 131 49.349 49.473 -8.762 1.00 26.95 C ATOM 941 O GLY E 131 48.445 48.940 -9.438 1.00 27.49 O ATOM 942 N SER E 132 49.585 50.770 -8.761 1.00 24.52 N ATOM 943 CA SER E 132 49.098 51.638 -9.831 1.00 22.69 C ATOM 944 C SER E 132 50.108 52.760 -10.005 1.00 23.12 C ATOM 945 O SER E 132 50.826 53.147 -9.057 1.00 21.32 O ATOM 946 CB SER E 132 47.703 52.184 -9.530 1.00 22.51 C ATOM 947 OG SER E 132 47.672 53.298 -8.624 1.00 20.06 O ATOM 948 N ALA E 133 50.155 53.309 -11.212 1.00 22.16 N ATOM 949 CA ALA E 133 51.004 54.439 -11.417 1.00 22.06 C ATOM 950 C ALA E 133 50.695 55.592 -10.453 1.00 20.36 C ATOM 951 O ALA E 133 51.629 56.250 -9.987 1.00 21.27 O ATOM 952 CB ALA E 133 50.918 54.914 -12.900 1.00 22.67 C ATOM 953 N ALA E 134 49.414 55.849 -10.185 1.00 19.66 N ATOM 954 CA ALA E 134 49.007 56.988 -9.360 1.00 18.71 C ATOM 955 C ALA E 134 49.454 56.701 -7.905 1.00 19.32 C ATOM 956 O ALA E 134 49.850 57.629 -7.193 1.00 18.49 O ATOM 957 CB ALA E 134 47.465 57.248 -9.426 1.00 19.05 C ATOM 958 N LEU E 135 49.415 55.429 -7.495 1.00 18.11 N ATOM 959 CA LEU E 135 49.849 55.093 -6.122 1.00 18.31 C ATOM 960 C LEU E 135 51.357 55.283 -5.984 1.00 17.99 C ATOM 961 O LEU E 135 51.832 55.910 -5.018 1.00 16.82 O ATOM 962 CB LEU E 135 49.433 53.667 -5.713 1.00 16.80 C ATOM 963 CG LEU E 135 49.869 53.270 -4.281 1.00 17.22 C ATOM 964 CD1 LEU E 135 49.198 54.130 -3.204 1.00 14.62 C ATOM 965 CD2 LEU E 135 49.565 51.740 -4.050 1.00 16.92 C ATOM 966 N LYS E 136 52.110 54.742 -6.948 1.00 17.47 N ATOM 967 CA LYS E 136 53.539 54.935 -6.957 1.00 17.57 C ATOM 968 C LYS E 136 53.876 56.444 -6.982 1.00 17.64 C ATOM 969 O LYS E 136 54.788 56.911 -6.295 1.00 16.75 O ATOM 970 CB LYS E 136 54.181 54.194 -8.155 1.00 16.90 C ATOM 971 CG LYS E 136 55.721 54.216 -8.085 1.00 17.84 C ATOM 972 CD LYS E 136 56.446 53.487 -9.217 1.00 20.43 C ATOM 973 CE LYS E 136 57.918 53.354 -8.869 1.00 21.75 C ATOM 974 NZ LYS E 136 58.634 54.649 -9.057 1.00 23.40 N ATOM 975 N ALA E 137 53.162 57.205 -7.805 1.00 17.99 N ATOM 976 CA ALA E 137 53.480 58.627 -7.910 1.00 18.78 C ATOM 977 C ALA E 137 53.264 59.333 -6.550 1.00 18.25 C ATOM 978 O ALA E 137 54.030 60.245 -6.178 1.00 18.56 O ATOM 979 CB ALA E 137 52.605 59.254 -9.001 1.00 18.14 C ATOM 980 N ALA E 138 52.233 58.904 -5.809 1.00 17.03 N ATOM 981 CA ALA E 138 51.900 59.566 -4.532 1.00 16.44 C ATOM 982 C ALA E 138 52.976 59.281 -3.508 1.00 15.33 C ATOM 983 O ALA E 138 53.418 60.213 -2.813 1.00 14.99 O ATOM 984 CB ALA E 138 50.550 59.112 -3.988 1.00 16.56 C ATOM 985 N VAL E 139 53.373 58.006 -3.389 1.00 14.61 N ATOM 986 CA VAL E 139 54.463 57.693 -2.426 1.00 15.28 C ATOM 987 C VAL E 139 55.802 58.290 -2.839 1.00 16.15 C ATOM 988 O VAL E 139 56.521 58.818 -2.000 1.00 16.19 O ATOM 989 CB VAL E 139 54.612 56.168 -2.055 1.00 14.76 C ATOM 990 CG1 VAL E 139 53.325 55.629 -1.341 1.00 16.01 C ATOM 991 CG2 VAL E 139 54.988 55.313 -3.262 1.00 15.86 C ATOM 992 N ASP E 140 56.104 58.287 -4.141 1.00 16.36 N ATOM 993 CA ASP E 140 57.318 58.904 -4.610 1.00 16.90 C ATOM 994 C ASP E 140 57.307 60.401 -4.328 1.00 16.25 C ATOM 995 O ASP E 140 58.351 60.968 -3.950 1.00 17.67 O ATOM 996 CB ASP E 140 57.488 58.686 -6.116 1.00 16.71 C ATOM 997 CG ASP E 140 57.812 57.248 -6.466 1.00 19.96 C ATOM 998 OD1 ASP E 140 58.034 56.401 -5.537 1.00 17.07 O ATOM 999 OD2 ASP E 140 57.945 56.890 -7.659 1.00 19.90 O ATOM 1000 N LYS E 141 56.152 61.038 -4.491 1.00 15.67 N ATOM 1001 CA LYS E 141 56.069 62.470 -4.243 1.00 16.77 C ATOM 1002 C LYS E 141 56.266 62.760 -2.746 1.00 16.46 C ATOM 1003 O LYS E 141 56.933 63.736 -2.371 1.00 15.79 O ATOM 1004 CB LYS E 141 54.714 63.021 -4.751 1.00 16.34 C ATOM 1005 CG LYS E 141 54.473 64.490 -4.450 1.00 17.67 C ATOM 1006 CD LYS E 141 53.017 64.895 -4.813 1.00 21.50 C ATOM 1007 CE LYS E 141 52.703 66.370 -4.593 1.00 24.12 C ATOM 1008 NZ LYS E 141 51.241 66.565 -4.953 1.00 24.57 N ATOM 1009 N ALA E 142 55.681 61.918 -1.886 1.00 15.82 N ATOM 1010 CA ALA E 142 55.847 62.120 -0.433 1.00 15.39 C ATOM 1011 C ALA E 142 57.307 62.002 -0.063 1.00 14.53 C ATOM 1012 O ALA E 142 57.844 62.836 0.683 1.00 14.07 O ATOM 1013 CB ALA E 142 55.015 61.042 0.361 1.00 14.36 C ATOM 1014 N VAL E 143 57.978 60.990 -0.617 1.00 14.05 N ATOM 1015 CA VAL E 143 59.424 60.832 -0.353 1.00 13.96 C ATOM 1016 C VAL E 143 60.256 62.006 -0.913 1.00 14.71 C ATOM 1017 O VAL E 143 61.161 62.505 -0.238 1.00 14.03 O ATOM 1018 CB VAL E 143 59.923 59.443 -0.827 1.00 14.70 C ATOM 1019 CG1 VAL E 143 61.445 59.298 -0.774 1.00 14.73 C ATOM 1020 CG2 VAL E 143 59.233 58.369 0.065 1.00 13.09 C ATOM 1021 N ALA E 144 59.941 62.431 -2.139 1.00 15.28 N ATOM 1022 CA ALA E 144 60.648 63.575 -2.742 1.00 16.84 C ATOM 1023 C ALA E 144 60.476 64.826 -1.873 1.00 17.58 C ATOM 1024 O ALA E 144 61.379 65.705 -1.853 1.00 18.85 O ATOM 1025 CB ALA E 144 60.123 63.845 -4.152 1.00 16.08 C ATOM 1026 N SER E 145 59.368 64.882 -1.141 1.00 16.69 N ATOM 1027 CA SER E 145 59.016 66.048 -0.347 1.00 17.79 C ATOM 1028 C SER E 145 59.631 65.982 1.055 1.00 16.12 C ATOM 1029 O SER E 145 59.438 66.913 1.820 1.00 17.02 O ATOM 1030 CB SER E 145 57.513 66.259 -0.232 1.00 17.31 C ATOM 1031 OG SER E 145 56.945 66.446 -1.502 1.00 23.20 O ATOM 1032 N GLY E 146 60.318 64.882 1.380 1.00 14.39 N ATOM 1033 CA GLY E 146 61.012 64.766 2.661 1.00 13.75 C ATOM 1034 C GLY E 146 60.316 63.858 3.700 1.00 13.40 C ATOM 1035 O GLY E 146 60.802 63.784 4.840 1.00 13.09 O ATOM 1036 N VAL E 147 59.227 63.191 3.311 1.00 12.93 N ATOM 1037 CA VAL E 147 58.483 62.325 4.283 1.00 12.59 C ATOM 1038 C VAL E 147 59.134 60.927 4.369 1.00 12.20 C ATOM 1039 O VAL E 147 59.493 60.347 3.343 1.00 13.56 O ATOM 1040 CB VAL E 147 57.000 62.144 3.872 1.00 14.38 C ATOM 1041 CG1 VAL E 147 56.236 61.364 5.012 1.00 14.36 C ATOM 1042 CG2 VAL E 147 56.323 63.508 3.586 1.00 12.92 C ATOM 1043 N VAL E 148 59.272 60.369 5.583 1.00 10.96 N ATOM 1044 CA VAL E 148 59.686 58.982 5.737 1.00 11.16 C ATOM 1045 C VAL E 148 58.416 58.164 5.519 1.00 12.05 C ATOM 1046 O VAL E 148 57.480 58.350 6.275 1.00 12.35 O ATOM 1047 CB VAL E 148 60.223 58.708 7.190 1.00 11.32 C ATOM 1048 CG1 VAL E 148 60.493 57.248 7.400 1.00 12.52 C ATOM 1049 CG2 VAL E 148 61.568 59.496 7.419 1.00 10.04 C ATOM 1050 N VAL E 149 58.404 57.237 4.551 1.00 11.15 N ATOM 1051 CA VAL E 149 57.189 56.467 4.296 1.00 11.07 C ATOM 1052 C VAL E 149 57.465 55.007 4.636 1.00 10.25 C ATOM 1053 O VAL E 149 58.369 54.382 4.074 1.00 12.09 O ATOM 1054 CB VAL E 149 56.753 56.611 2.791 1.00 11.22 C ATOM 1055 CG1 VAL E 149 55.434 55.847 2.608 1.00 10.60 C ATOM 1056 CG2 VAL E 149 56.505 58.100 2.481 1.00 12.75 C ATOM 1057 N VAL E 150 56.638 54.455 5.524 1.00 11.50 N ATOM 1058 CA VAL E 150 56.857 53.095 6.039 1.00 11.01 C ATOM 1059 C VAL E 150 55.565 52.344 5.751 1.00 11.97 C ATOM 1060 O VAL E 150 54.476 52.891 5.956 1.00 11.42 O ATOM 1061 CB VAL E 150 57.052 53.115 7.568 1.00 11.88 C ATOM 1062 CG1 VAL E 150 57.363 51.661 8.095 1.00 10.40 C ATOM 1063 CG2 VAL E 150 58.181 54.149 7.947 1.00 10.21 C ATOM 1064 N ALA E 151 55.664 51.100 5.301 1.00 11.34 N ATOM 1065 CA ALA E 151 54.441 50.283 5.071 1.00 11.55 C ATOM 1066 C ALA E 151 54.664 48.827 5.490 1.00 11.78 C ATOM 1067 O ALA E 151 55.771 48.328 5.466 1.00 11.70 O ATOM 1068 CB ALA E 151 54.017 50.304 3.600 1.00 12.17 C ATOM 1069 N ALA E 152 53.584 48.164 5.849 1.00 11.36 N ATOM 1070 CA ALA E 152 53.600 46.704 6.063 1.00 11.65 C ATOM 1071 C ALA E 152 54.034 45.988 4.776 1.00 11.73 C ATOM 1072 O ALA E 152 53.586 46.356 3.683 1.00 13.14 O ATOM 1073 CB ALA E 152 52.163 46.264 6.454 1.00 12.61 C ATOM 1074 N ALA E 153 54.859 44.954 4.922 1.00 11.83 N ATOM 1075 CA ALA E 153 55.314 44.189 3.734 1.00 12.77 C ATOM 1076 C ALA E 153 54.172 43.377 3.135 1.00 13.34 C ATOM 1077 O ALA E 153 54.175 43.146 1.917 1.00 13.91 O ATOM 1078 CB ALA E 153 56.548 43.227 4.067 1.00 12.95 C ATOM 1079 N GLY E 154 53.215 42.970 3.972 1.00 12.63 N ATOM 1080 CA GLY E 154 52.128 42.094 3.538 1.00 13.38 C ATOM 1081 C GLY E 154 52.160 40.773 4.329 1.00 13.22 C ATOM 1082 O GLY E 154 53.179 40.410 4.933 1.00 13.30 O ATOM 1083 N ASN E 155 51.025 40.046 4.325 1.00 13.50 N ATOM 1084 CA ASN E 155 50.916 38.815 5.095 1.00 13.61 C ATOM 1085 C ASN E 155 50.685 37.613 4.178 1.00 15.84 C ATOM 1086 O ASN E 155 49.907 36.711 4.533 1.00 16.10 O ATOM 1087 CB ASN E 155 49.712 38.888 6.064 1.00 14.47 C ATOM 1088 CG ASN E 155 49.848 40.002 7.096 1.00 16.16 C ATOM 1089 OD1 ASN E 155 50.983 40.464 7.415 1.00 14.43 O ATOM 1090 ND2 ASN E 155 48.707 40.396 7.667 1.00 14.53 N ATOM 1091 N GLU E 156 51.413 37.584 3.061 1.00 16.10 N ATOM 1092 CA GLU E 156 51.215 36.529 2.030 1.00 17.68 C ATOM 1093 C GLU E 156 52.126 35.303 2.240 1.00 19.54 C ATOM 1094 O GLU E 156 52.034 34.308 1.479 1.00 21.38 O ATOM 1095 CB GLU E 156 51.445 37.113 0.643 1.00 17.78 C ATOM 1096 CG GLU E 156 50.465 38.186 0.240 1.00 19.26 C ATOM 1097 CD GLU E 156 49.035 37.716 0.345 1.00 24.96 C ATOM 1098 OE1 GLU E 156 48.785 36.533 0.082 1.00 26.11 O ATOM 1099 OE2 GLU E 156 48.154 38.502 0.711 1.00 26.07 O ATOM 1100 N GLY E 157 53.024 35.352 3.226 1.00 17.20 N ATOM 1101 CA GLY E 157 53.910 34.240 3.531 1.00 18.78 C ATOM 1102 C GLY E 157 54.816 33.949 2.345 1.00 20.06 C ATOM 1103 O GLY E 157 55.182 34.864 1.626 1.00 19.85 O ATOM 1104 N THR E 158 55.135 32.678 2.100 1.00 21.50 N ATOM 1105 CA THR E 158 56.074 32.371 1.002 1.00 23.98 C ATOM 1106 C THR E 158 55.339 31.845 -0.214 1.00 25.66 C ATOM 1107 O THR E 158 54.195 31.391 -0.106 1.00 26.02 O ATOM 1108 CB THR E 158 57.118 31.328 1.414 1.00 24.54 C ATOM 1109 OG1 THR E 158 56.439 30.117 1.784 1.00 25.49 O ATOM 1110 CG2 THR E 158 57.897 31.746 2.672 1.00 24.18 C ATOM 1111 N SER E 159 55.994 31.898 -1.371 1.00 26.92 N ATOM 1112 CA SER E 159 55.408 31.308 -2.572 1.00 29.13 C ATOM 1113 C SER E 159 56.575 30.906 -3.455 1.00 29.62 C ATOM 1114 O SER E 159 56.852 31.552 -4.478 1.00 29.45 O ATOM 1115 CB SER E 159 54.489 32.297 -3.259 1.00 29.34 C ATOM 1116 OG SER E 159 54.081 31.761 -4.502 1.00 33.84 O ATOM 1117 N GLY E 160 57.320 29.904 -2.984 1.00 30.36 N ATOM 1118 CA GLY E 160 58.478 29.421 -3.712 1.00 31.78 C ATOM 1119 C GLY E 160 59.547 30.482 -3.732 1.00 31.95 C ATOM 1120 O GLY E 160 59.938 30.991 -2.674 1.00 32.68 O ATOM 1121 N SER E 161 60.016 30.833 -4.925 1.00 31.37 N ATOM 1122 CA SER E 161 61.043 31.865 -5.077 1.00 30.48 C ATOM 1123 C SER E 161 60.440 33.221 -5.455 1.00 28.71 C ATOM 1124 O SER E 161 61.177 34.142 -5.770 1.00 28.90 O ATOM 1125 CB SER E 161 62.074 31.435 -6.161 1.00 32.18 C ATOM 1126 OG ASER E 161 61.428 31.360 -7.422 0.67 32.93 O ATOM 1127 OG BSER E 161 62.752 30.247 -5.790 0.33 31.62 O ATOM 1128 N SER E 162 59.116 33.356 -5.438 1.00 26.84 N ATOM 1129 CA SER E 162 58.474 34.588 -5.876 1.00 26.41 C ATOM 1130 C SER E 162 58.433 35.582 -4.705 1.00 24.82 C ATOM 1131 O SER E 162 58.246 35.179 -3.570 1.00 23.27 O ATOM 1132 CB SER E 162 57.027 34.356 -6.258 1.00 27.96 C ATOM 1133 OG SER E 162 56.917 33.513 -7.401 1.00 32.82 O ATOM 1134 N SER E 163 58.532 36.855 -5.031 1.00 22.07 N ATOM 1135 CA SER E 163 58.240 37.884 -4.038 1.00 20.96 C ATOM 1136 C SER E 163 56.743 37.918 -3.712 1.00 20.59 C ATOM 1137 O SER E 163 55.896 37.770 -4.590 1.00 20.35 O ATOM 1138 CB SER E 163 58.697 39.210 -4.589 1.00 20.81 C ATOM 1139 OG SER E 163 58.237 40.254 -3.734 1.00 19.67 O ATOM 1140 N THR E 164 56.390 38.093 -2.442 1.00 18.95 N ATOM 1141 CA THR E 164 55.004 38.226 -2.068 1.00 17.11 C ATOM 1142 C THR E 164 54.777 39.546 -1.339 1.00 16.73 C ATOM 1143 O THR E 164 53.739 39.743 -0.746 1.00 16.65 O ATOM 1144 CB THR E 164 54.553 37.100 -1.149 1.00 17.12 C ATOM 1145 OG1 THR E 164 55.305 37.109 0.067 1.00 16.03 O ATOM 1146 CG2 THR E 164 54.870 35.724 -1.780 1.00 17.06 C ATOM 1147 N VAL E 165 55.737 40.460 -1.448 1.00 16.42 N ATOM 1148 CA VAL E 165 55.563 41.793 -0.870 1.00 15.55 C ATOM 1149 C VAL E 165 54.487 42.546 -1.648 1.00 16.01 C ATOM 1150 O VAL E 165 54.524 42.606 -2.895 1.00 17.96 O ATOM 1151 CB VAL E 165 56.920 42.562 -0.902 1.00 14.91 C ATOM 1152 CG1 VAL E 165 56.724 44.027 -0.422 1.00 14.10 C ATOM 1153 CG2 VAL E 165 57.992 41.794 -0.104 1.00 16.66 C ATOM 1154 N GLY E 166 53.532 43.173 -0.953 1.00 15.80 N ATOM 1155 CA GLY E 166 52.523 43.927 -1.646 1.00 16.09 C ATOM 1156 C GLY E 166 52.834 45.421 -1.758 1.00 15.94 C ATOM 1157 O GLY E 166 53.894 45.884 -1.290 1.00 15.90 O ATOM 1158 N TYR E 167 51.887 46.139 -2.362 1.00 15.79 N ATOM 1159 CA TYR E 167 52.012 47.585 -2.594 1.00 15.63 C ATOM 1160 C TYR E 167 51.203 48.297 -1.509 1.00 14.93 C ATOM 1161 O TYR E 167 50.123 47.836 -1.124 1.00 14.35 O ATOM 1162 CB TYR E 167 51.409 47.918 -3.963 1.00 15.15 C ATOM 1163 CG TYR E 167 52.176 47.282 -5.118 1.00 17.12 C ATOM 1164 CD1 TYR E 167 53.224 47.957 -5.734 1.00 19.97 C ATOM 1165 CD2 TYR E 167 51.834 46.006 -5.591 1.00 21.28 C ATOM 1166 CE1 TYR E 167 53.941 47.370 -6.780 1.00 23.20 C ATOM 1167 CE2 TYR E 167 52.504 45.432 -6.671 1.00 21.30 C ATOM 1168 CZ TYR E 167 53.563 46.120 -7.252 1.00 24.83 C ATOM 1169 OH TYR E 167 54.270 45.529 -8.290 1.00 28.14 O ATOM 1170 N PRO E 168 51.644 49.467 -1.046 1.00 14.88 N ATOM 1171 CA PRO E 168 52.809 50.206 -1.574 1.00 14.02 C ATOM 1172 C PRO E 168 54.190 49.803 -1.029 1.00 14.24 C ATOM 1173 O PRO E 168 55.233 50.366 -1.462 1.00 13.01 O ATOM 1174 CB PRO E 168 52.443 51.664 -1.205 1.00 14.42 C ATOM 1175 CG PRO E 168 51.752 51.449 0.187 1.00 14.52 C ATOM 1176 CD PRO E 168 50.895 50.207 -0.012 1.00 14.73 C ATOM 1177 N GLY E 169 54.246 48.829 -0.102 1.00 13.46 N ATOM 1178 CA GLY E 169 55.545 48.394 0.412 1.00 13.22 C ATOM 1179 C GLY E 169 56.551 48.032 -0.685 1.00 15.02 C ATOM 1180 O GLY E 169 57.749 48.277 -0.543 1.00 14.78 O ATOM 1181 N LYS E 170 56.071 47.440 -1.789 1.00 15.00 N ATOM 1182 CA LYS E 170 56.945 46.921 -2.843 1.00 15.66 C ATOM 1183 C LYS E 170 57.649 48.025 -3.634 1.00 16.10 C ATOM 1184 O LYS E 170 58.654 47.744 -4.277 1.00 16.74 O ATOM 1185 CB LYS E 170 56.106 46.031 -3.808 1.00 16.18 C ATOM 1186 CG LYS E 170 56.973 45.069 -4.620 1.00 18.12 C ATOM 1187 CD LYS E 170 56.051 44.178 -5.514 1.00 21.49 C ATOM 1188 CE LYS E 170 56.907 43.204 -6.351 1.00 27.04 C ATOM 1189 NZ LYS E 170 56.061 42.171 -7.037 1.00 31.82 N ATOM 1190 N TYR E 171 57.147 49.269 -3.565 1.00 15.62 N ATOM 1191 CA TYR E 171 57.830 50.397 -4.257 1.00 15.28 C ATOM 1192 C TYR E 171 59.152 50.716 -3.560 1.00 16.00 C ATOM 1193 O TYR E 171 59.214 50.762 -2.302 1.00 15.56 O ATOM 1194 CB TYR E 171 56.916 51.617 -4.232 1.00 16.07 C ATOM 1195 CG TYR E 171 55.660 51.455 -5.047 1.00 16.01 C ATOM 1196 CD1 TYR E 171 55.736 51.038 -6.380 1.00 18.11 C ATOM 1197 CD2 TYR E 171 54.403 51.725 -4.497 1.00 16.49 C ATOM 1198 CE1 TYR E 171 54.600 50.883 -7.146 1.00 18.97 C ATOM 1199 CE2 TYR E 171 53.226 51.596 -5.266 1.00 17.85 C ATOM 1200 CZ TYR E 171 53.360 51.200 -6.601 1.00 19.09 C ATOM 1201 OH TYR E 171 52.245 51.038 -7.370 1.00 21.11 O ATOM 1202 N PRO E 172 60.232 50.923 -4.322 1.00 16.26 N ATOM 1203 CA PRO E 172 61.548 51.265 -3.733 1.00 15.71 C ATOM 1204 C PRO E 172 61.506 52.475 -2.799 1.00 14.74 C ATOM 1205 O PRO E 172 62.283 52.481 -1.840 1.00 14.23 O ATOM 1206 CB PRO E 172 62.397 51.620 -4.986 1.00 17.04 C ATOM 1207 CG PRO E 172 61.816 50.651 -6.039 1.00 18.71 C ATOM 1208 CD PRO E 172 60.296 50.795 -5.802 1.00 16.72 C ATOM 1209 N SER E 173 60.639 53.456 -3.065 1.00 13.50 N ATOM 1210 CA SER E 173 60.649 54.662 -2.214 1.00 14.04 C ATOM 1211 C SER E 173 60.099 54.411 -0.798 1.00 13.66 C ATOM 1212 O SER E 173 60.276 55.238 0.082 1.00 12.81 O ATOM 1213 CB SER E 173 59.894 55.810 -2.863 1.00 14.34 C ATOM 1214 OG SER E 173 58.528 55.515 -2.989 1.00 15.85 O ATOM 1215 N VAL E 174 59.408 53.284 -0.614 1.00 12.65 N ATOM 1216 CA VAL E 174 58.731 52.947 0.666 1.00 12.89 C ATOM 1217 C VAL E 174 59.544 51.884 1.437 1.00 13.77 C ATOM 1218 O VAL E 174 60.032 50.918 0.850 1.00 14.38 O ATOM 1219 CB VAL E 174 57.261 52.384 0.363 1.00 13.50 C ATOM 1220 CG1 VAL E 174 56.543 51.883 1.644 1.00 13.15 C ATOM 1221 CG2 VAL E 174 56.427 53.457 -0.357 1.00 12.29 C ATOM 1222 N ILE E 175 59.643 52.037 2.755 1.00 11.67 N ATOM 1223 CA ILE E 175 60.316 51.026 3.583 1.00 11.74 C ATOM 1224 C ILE E 175 59.298 49.915 3.863 1.00 12.30 C ATOM 1225 O ILE E 175 58.318 50.164 4.571 1.00 11.93 O ATOM 1226 CB ILE E 175 60.766 51.678 4.909 1.00 11.29 C ATOM 1227 CG1 ILE E 175 61.829 52.785 4.631 1.00 12.05 C ATOM 1228 CG2 ILE E 175 61.317 50.597 5.922 1.00 12.60 C ATOM 1229 CD1 ILE E 175 61.934 53.753 5.812 1.00 11.45 C ATOM 1230 N ALA E 176 59.550 48.721 3.309 1.00 11.11 N ATOM 1231 CA ALA E 176 58.633 47.583 3.520 1.00 11.82 C ATOM 1232 C ALA E 176 59.067 46.766 4.733 1.00 11.42 C ATOM 1233 O ALA E 176 60.206 46.348 4.844 1.00 11.41 O ATOM 1234 CB ALA E 176 58.533 46.667 2.273 1.00 12.45 C ATOM 1235 N VAL E 177 58.108 46.574 5.651 1.00 12.03 N ATOM 1236 CA VAL E 177 58.452 45.996 6.957 1.00 11.66 C ATOM 1237 C VAL E 177 57.794 44.638 7.166 1.00 10.61 C ATOM 1238 O VAL E 177 56.559 44.518 7.109 1.00 11.57 O ATOM 1239 CB VAL E 177 57.980 46.941 8.118 1.00 11.20 C ATOM 1240 CG1 VAL E 177 58.404 46.363 9.478 1.00 12.38 C ATOM 1241 CG2 VAL E 177 58.651 48.370 7.887 1.00 10.81 C ATOM 1242 N GLY E 178 58.631 43.628 7.434 1.00 11.29 N ATOM 1243 CA GLY E 178 58.133 42.288 7.779 1.00 11.89 C ATOM 1244 C GLY E 178 58.031 42.083 9.271 1.00 13.12 C ATOM 1245 O GLY E 178 58.512 42.909 10.072 1.00 11.79 O ATOM 1246 N ALA E 179 57.492 40.926 9.665 1.00 12.28 N ATOM 1247 CA ALA E 179 57.186 40.663 11.061 1.00 11.74 C ATOM 1248 C ALA E 179 57.983 39.532 11.640 1.00 11.61 C ATOM 1249 O ALA E 179 58.057 38.442 11.047 1.00 13.42 O ATOM 1250 CB ALA E 179 55.688 40.344 11.244 1.00 10.83 C ATOM 1251 N VAL E 180 58.545 39.776 12.817 1.00 11.33 N ATOM 1252 CA VAL E 180 59.143 38.688 13.615 1.00 11.69 C ATOM 1253 C VAL E 180 58.458 38.587 14.964 1.00 12.38 C ATOM 1254 O VAL E 180 57.694 39.480 15.393 1.00 11.67 O ATOM 1255 CB VAL E 180 60.645 38.884 13.880 1.00 12.01 C ATOM 1256 CG1 VAL E 180 61.419 38.789 12.615 1.00 11.27 C ATOM 1257 CG2 VAL E 180 60.929 40.248 14.640 1.00 12.82 C ATOM 1258 N ASP E 181 58.712 37.471 15.648 1.00 13.01 N ATOM 1259 CA ASP E 181 58.185 37.314 16.998 1.00 13.61 C ATOM 1260 C ASP E 181 59.242 37.680 18.038 1.00 13.81 C ATOM 1261 O ASP E 181 60.313 38.239 17.692 1.00 13.07 O ATOM 1262 CB ASP E 181 57.642 35.878 17.169 1.00 14.11 C ATOM 1263 CG ASP E 181 58.709 34.829 17.097 1.00 17.49 C ATOM 1264 OD1 ASP E 181 59.918 35.119 17.269 1.00 14.69 O ATOM 1265 OD2 ASP E 181 58.392 33.613 16.928 1.00 20.07 O ATOM 1266 N SER E 182 58.987 37.375 19.308 1.00 15.12 N ATOM 1267 CA SER E 182 59.895 37.810 20.391 1.00 17.18 C ATOM 1268 C SER E 182 61.222 37.077 20.405 1.00 18.29 C ATOM 1269 O SER E 182 62.166 37.459 21.124 1.00 18.90 O ATOM 1270 CB SER E 182 59.191 37.652 21.778 1.00 19.66 C ATOM 1271 OG SER E 182 58.918 36.262 22.024 1.00 19.55 O ATOM 1272 N SER E 183 61.303 35.994 19.636 1.00 17.47 N ATOM 1273 CA SER E 183 62.537 35.251 19.455 1.00 17.26 C ATOM 1274 C SER E 183 63.272 35.643 18.191 1.00 17.44 C ATOM 1275 O SER E 183 64.291 34.992 17.823 1.00 16.98 O ATOM 1276 CB SER E 183 62.215 33.736 19.407 1.00 17.89 C ATOM 1277 OG ASER E 183 61.626 33.316 20.641 0.67 19.09 O ATOM 1278 OG BSER E 183 61.569 33.436 18.188 0.33 17.49 O ATOM 1279 N ASN E 184 62.809 36.717 17.510 1.00 15.93 N ATOM 1280 CA ASN E 184 63.371 37.134 16.216 1.00 15.79 C ATOM 1281 C ASN E 184 63.154 36.158 15.056 1.00 15.89 C ATOM 1282 O ASN E 184 63.830 36.243 14.035 1.00 17.21 O ATOM 1283 CB ASN E 184 64.858 37.467 16.331 1.00 15.84 C ATOM 1284 CG ASN E 184 65.086 38.794 17.027 1.00 17.77 C ATOM 1285 OD1 ASN E 184 64.185 39.619 17.049 1.00 20.44 O ATOM 1286 ND2 ASN E 184 66.290 39.022 17.537 1.00 18.01 N ATOM 1287 N GLN E 185 62.212 35.234 15.226 1.00 17.25 N ATOM 1288 CA GLN E 185 61.834 34.322 14.146 1.00 18.14 C ATOM 1289 C GLN E 185 60.792 34.990 13.283 1.00 15.94 C ATOM 1290 O GLN E 185 59.810 35.570 13.777 1.00 15.47 O ATOM 1291 CB GLN E 185 61.211 33.031 14.732 1.00 19.27 C ATOM 1292 CG GLN E 185 62.214 32.022 15.196 1.00 29.47 C ATOM 1293 CD GLN E 185 62.980 31.393 14.019 1.00 38.34 C ATOM 1294 OE1 GLN E 185 62.364 30.900 13.034 1.00 41.53 O ATOM 1295 NE2 GLN E 185 64.318 31.407 14.113 1.00 41.04 N ATOM 1296 N ARG E 186 60.961 34.865 11.981 1.00 14.93 N ATOM 1297 CA ARG E 186 60.001 35.407 11.051 1.00 16.42 C ATOM 1298 C ARG E 186 58.628 34.778 11.323 1.00 15.64 C ATOM 1299 O ARG E 186 58.544 33.561 11.489 1.00 16.07 O ATOM 1300 CB ARG E 186 60.499 35.028 9.651 1.00 18.13 C ATOM 1301 CG ARG E 186 59.588 35.279 8.593 1.00 21.38 C ATOM 1302 CD ARG E 186 60.121 34.758 7.242 1.00 22.06 C ATOM 1303 NE ARG E 186 58.928 34.753 6.486 1.00 20.28 N ATOM 1304 CZ ARG E 186 58.116 33.701 6.338 1.00 20.13 C ATOM 1305 NH1 ARG E 186 58.434 32.494 6.798 1.00 18.11 N ATOM 1306 NH2 ARG E 186 56.994 33.871 5.674 1.00 17.52 N ATOM 1307 N ALA E 187 57.573 35.578 11.376 1.00 14.95 N ATOM 1308 CA ALA E 187 56.199 35.067 11.452 1.00 14.63 C ATOM 1309 C ALA E 187 55.877 34.294 10.173 1.00 15.78 C ATOM 1310 O ALA E 187 56.212 34.718 9.096 1.00 14.18 O ATOM 1311 CB ALA E 187 55.191 36.233 11.582 1.00 14.84 C ATOM 1312 N SER E 188 55.150 33.178 10.277 1.00 16.77 N ATOM 1313 CA SER E 188 54.932 32.389 9.047 1.00 17.53 C ATOM 1314 C SER E 188 54.129 33.136 7.965 1.00 17.25 C ATOM 1315 O SER E 188 54.315 32.880 6.793 1.00 19.07 O ATOM 1316 CB SER E 188 54.218 31.069 9.424 1.00 18.31 C ATOM 1317 OG SER E 188 52.941 31.445 9.927 1.00 22.77 O ATOM 1318 N PHE E 189 53.259 34.081 8.346 1.00 17.05 N ATOM 1319 CA PHE E 189 52.492 34.877 7.385 1.00 16.64 C ATOM 1320 C PHE E 189 53.315 36.018 6.755 1.00 15.88 C ATOM 1321 O PHE E 189 52.893 36.617 5.776 1.00 17.27 O ATOM 1322 CB PHE E 189 51.222 35.494 8.033 1.00 17.07 C ATOM 1323 CG PHE E 189 51.520 36.356 9.248 1.00 16.40 C ATOM 1324 CD1 PHE E 189 52.025 37.637 9.092 1.00 16.52 C ATOM 1325 CD2 PHE E 189 51.315 35.866 10.547 1.00 18.80 C ATOM 1326 CE1 PHE E 189 52.368 38.427 10.201 1.00 13.20 C ATOM 1327 CE2 PHE E 189 51.605 36.662 11.684 1.00 19.22 C ATOM 1328 CZ PHE E 189 52.126 37.946 11.513 1.00 16.60 C ATOM 1329 N SER E 190 54.470 36.367 7.324 1.00 16.07 N ATOM 1330 CA SER E 190 55.186 37.581 6.845 1.00 14.36 C ATOM 1331 C SER E 190 55.603 37.464 5.373 1.00 14.07 C ATOM 1332 O SER E 190 56.260 36.464 4.984 1.00 14.71 O ATOM 1333 CB SER E 190 56.416 37.847 7.755 1.00 14.85 C ATOM 1334 OG SER E 190 57.037 39.091 7.416 1.00 15.26 O ATOM 1335 N SER E 191 55.216 38.437 4.550 1.00 14.12 N ATOM 1336 CA SER E 191 55.634 38.471 3.119 1.00 15.07 C ATOM 1337 C SER E 191 57.140 38.436 2.962 1.00 15.64 C ATOM 1338 O SER E 191 57.903 38.826 3.869 1.00 15.84 O ATOM 1339 CB SER E 191 55.012 39.648 2.341 1.00 15.43 C ATOM 1340 OG SER E 191 53.629 39.390 2.072 1.00 15.44 O ATOM 1341 N VAL E 192 57.575 37.940 1.806 1.00 16.21 N ATOM 1342 CA VAL E 192 58.988 37.712 1.506 1.00 16.44 C ATOM 1343 C VAL E 192 59.341 38.270 0.134 1.00 16.73 C ATOM 1344 O VAL E 192 58.463 38.534 -0.713 1.00 16.35 O ATOM 1345 CB VAL E 192 59.395 36.197 1.578 1.00 16.55 C ATOM 1346 CG1 VAL E 192 59.310 35.685 3.019 1.00 16.74 C ATOM 1347 CG2 VAL E 192 58.528 35.348 0.578 1.00 16.39 C ATOM 1348 N GLY E 193 60.632 38.459 -0.094 1.00 16.56 N ATOM 1349 CA GLY E 193 61.052 39.026 -1.384 1.00 17.92 C ATOM 1350 C GLY E 193 62.199 40.016 -1.276 1.00 18.73 C ATOM 1351 O GLY E 193 62.548 40.469 -0.195 1.00 17.85 O ATOM 1352 N PRO E 194 62.839 40.338 -2.399 1.00 19.33 N ATOM 1353 CA PRO E 194 63.983 41.257 -2.353 1.00 19.47 C ATOM 1354 C PRO E 194 63.530 42.664 -1.923 1.00 19.12 C ATOM 1355 O PRO E 194 64.382 43.456 -1.514 1.00 19.48 O ATOM 1356 CB PRO E 194 64.499 41.260 -3.800 1.00 20.09 C ATOM 1357 CG PRO E 194 63.453 40.680 -4.625 1.00 21.50 C ATOM 1358 CD PRO E 194 62.586 39.807 -3.756 1.00 20.16 C ATOM 1359 N GLU E 195 62.239 42.952 -1.991 1.00 17.79 N ATOM 1360 CA GLU E 195 61.700 44.268 -1.532 1.00 17.63 C ATOM 1361 C GLU E 195 61.512 44.369 -0.025 1.00 16.23 C ATOM 1362 O GLU E 195 61.273 45.473 0.519 1.00 16.31 O ATOM 1363 CB GLU E 195 60.401 44.601 -2.243 1.00 18.15 C ATOM 1364 CG GLU E 195 60.527 44.505 -3.768 1.00 20.02 C ATOM 1365 CD GLU E 195 60.206 43.103 -4.303 1.00 24.22 C ATOM 1366 OE1 GLU E 195 60.049 42.138 -3.490 1.00 22.57 O ATOM 1367 OE2 GLU E 195 60.179 42.955 -5.561 1.00 26.70 O ATOM 1368 N LEU E 196 61.641 43.254 0.672 1.00 14.48 N ATOM 1369 CA LEU E 196 61.496 43.281 2.139 1.00 15.11 C ATOM 1370 C LEU E 196 62.709 44.064 2.647 1.00 15.44 C ATOM 1371 O LEU E 196 63.837 43.693 2.331 1.00 15.75 O ATOM 1372 CB LEU E 196 61.564 41.832 2.628 1.00 16.51 C ATOM 1373 CG LEU E 196 61.466 41.591 4.110 1.00 18.55 C ATOM 1374 CD1 LEU E 196 60.163 42.270 4.674 1.00 17.40 C ATOM 1375 CD2 LEU E 196 61.429 40.056 4.290 1.00 14.92 C ATOM 1376 N ASP E 197 62.498 45.105 3.477 1.00 12.31 N ATOM 1377 CA ASP E 197 63.625 45.935 3.866 1.00 12.64 C ATOM 1378 C ASP E 197 64.105 45.633 5.282 1.00 12.14 C ATOM 1379 O ASP E 197 65.265 45.303 5.490 1.00 13.21 O ATOM 1380 CB ASP E 197 63.203 47.390 3.713 1.00 11.91 C ATOM 1381 CG ASP E 197 64.365 48.357 3.820 1.00 14.89 C ATOM 1382 OD1 ASP E 197 65.541 47.908 3.792 1.00 15.93 O ATOM 1383 OD2 ASP E 197 64.159 49.599 3.949 1.00 17.85 O ATOM 1384 N VAL E 198 63.216 45.745 6.278 1.00 10.95 N ATOM 1385 CA VAL E 198 63.636 45.442 7.660 1.00 10.99 C ATOM 1386 C VAL E 198 62.496 44.694 8.331 1.00 10.39 C ATOM 1387 O VAL E 198 61.381 44.645 7.803 1.00 12.45 O ATOM 1388 CB VAL E 198 63.871 46.766 8.469 1.00 11.30 C ATOM 1389 CG1 VAL E 198 65.009 47.612 7.851 1.00 11.69 C ATOM 1390 CG2 VAL E 198 62.546 47.637 8.532 1.00 10.85 C ATOM 1391 N MET E 199 62.769 44.176 9.505 1.00 11.11 N ATOM 1392 CA MET E 199 61.738 43.477 10.274 1.00 10.85 C ATOM 1393 C MET E 199 61.478 44.217 11.602 1.00 11.38 C ATOM 1394 O MET E 199 62.367 44.894 12.133 1.00 11.20 O ATOM 1395 CB MET E 199 62.258 42.074 10.677 1.00 11.38 C ATOM 1396 CG MET E 199 62.729 41.146 9.507 1.00 12.47 C ATOM 1397 SD MET E 199 61.492 40.874 8.238 1.00 13.88 S ATOM 1398 CE MET E 199 60.677 39.377 8.911 1.00 14.01 C ATOM 1399 N ALA E 200 60.300 43.993 12.188 1.00 10.61 N ATOM 1400 CA ALA E 200 60.004 44.508 13.531 1.00 10.45 C ATOM 1401 C ALA E 200 58.976 43.541 14.140 1.00 10.92 C ATOM 1402 O ALA E 200 58.449 42.663 13.433 1.00 10.39 O ATOM 1403 CB ALA E 200 59.449 45.922 13.416 1.00 10.37 C ATOM 1404 N PRO E 201 58.741 43.644 15.431 1.00 11.56 N ATOM 1405 CA PRO E 201 57.832 42.715 16.133 1.00 10.84 C ATOM 1406 C PRO E 201 56.415 42.823 15.578 1.00 11.12 C ATOM 1407 O PRO E 201 55.876 43.920 15.437 1.00 10.83 O ATOM 1408 CB PRO E 201 57.872 43.225 17.573 1.00 11.42 C ATOM 1409 CG PRO E 201 59.342 43.812 17.692 1.00 10.27 C ATOM 1410 CD PRO E 201 59.407 44.579 16.360 1.00 10.42 C ATOM 1411 N GLY E 202 55.819 41.657 15.262 1.00 10.24 N ATOM 1412 CA GLY E 202 54.494 41.669 14.667 1.00 11.17 C ATOM 1413 C GLY E 202 53.663 40.482 15.112 1.00 12.61 C ATOM 1414 O GLY E 202 52.653 40.173 14.466 1.00 12.73 O ATOM 1415 N VAL E 203 54.091 39.851 16.198 1.00 12.01 N ATOM 1416 CA VAL E 203 53.326 38.733 16.787 1.00 12.68 C ATOM 1417 C VAL E 203 52.894 39.058 18.207 1.00 12.86 C ATOM 1418 O VAL E 203 53.711 39.421 19.030 1.00 12.40 O ATOM 1419 CB VAL E 203 54.170 37.426 16.731 1.00 13.50 C ATOM 1420 CG1 VAL E 203 53.403 36.224 17.396 1.00 14.17 C ATOM 1421 CG2 VAL E 203 54.532 37.103 15.258 1.00 12.62 C ATOM 1422 N SER E 204 51.584 38.927 18.476 1.00 11.95 N ATOM 1423 CA SER E 204 51.013 39.152 19.821 1.00 12.13 C ATOM 1424 C SER E 204 51.428 40.534 20.374 1.00 11.31 C ATOM 1425 O SER E 204 52.004 40.645 21.473 1.00 11.97 O ATOM 1426 CB SER E 204 51.469 38.035 20.746 1.00 13.35 C ATOM 1427 OG ASER E 204 51.026 36.778 20.208 0.67 12.23 O ATOM 1428 OG BSER E 204 50.891 38.231 22.015 0.33 14.85 O ATOM 1429 N ILE E 205 51.165 41.557 19.568 1.00 10.68 N ATOM 1430 CA ILE E 205 51.548 42.935 19.923 1.00 10.07 C ATOM 1431 C ILE E 205 50.367 43.595 20.645 1.00 10.44 C ATOM 1432 O ILE E 205 49.314 43.842 20.055 1.00 10.45 O ATOM 1433 CB ILE E 205 51.853 43.705 18.623 1.00 9.20 C ATOM 1434 CG1 ILE E 205 52.991 43.017 17.832 1.00 10.15 C ATOM 1435 CG2 ILE E 205 52.187 45.201 18.906 1.00 10.47 C ATOM 1436 CD1 ILE E 205 54.297 42.808 18.681 1.00 11.68 C ATOM 1437 N GLN E 206 50.542 43.907 21.917 1.00 9.83 N ATOM 1438 CA GLN E 206 49.505 44.615 22.707 1.00 10.79 C ATOM 1439 C GLN E 206 49.515 46.092 22.350 1.00 10.83 C ATOM 1440 O GLN E 206 50.593 46.715 22.262 1.00 10.47 O ATOM 1441 CB GLN E 206 49.800 44.491 24.218 1.00 11.29 C ATOM 1442 CG GLN E 206 49.515 43.099 24.759 1.00 13.97 C ATOM 1443 CD GLN E 206 48.003 42.840 24.877 1.00 14.30 C ATOM 1444 OE1 GLN E 206 47.195 43.768 24.745 1.00 14.74 O ATOM 1445 NE2 GLN E 206 47.634 41.568 25.190 1.00 17.05 N ATOM 1446 N SER E 207 48.317 46.635 22.120 1.00 9.81 N ATOM 1447 CA SER E 207 48.195 48.071 21.867 1.00 9.94 C ATOM 1448 C SER E 207 46.754 48.510 22.187 1.00 9.52 C ATOM 1449 O SER E 207 45.906 47.721 22.635 1.00 10.79 O ATOM 1450 CB SER E 207 48.605 48.406 20.403 1.00 10.25 C ATOM 1451 OG SER E 207 48.606 49.818 20.216 1.00 9.74 O ATOM 1452 N THR E 208 46.487 49.781 21.917 1.00 10.23 N ATOM 1453 CA THR E 208 45.175 50.412 22.169 1.00 10.36 C ATOM 1454 C THR E 208 44.123 49.945 21.163 1.00 11.33 C ATOM 1455 O THR E 208 44.400 49.760 19.990 1.00 12.42 O ATOM 1456 CB THR E 208 45.341 51.949 22.003 1.00 10.40 C ATOM 1457 OG1 THR E 208 46.106 52.221 20.819 1.00 11.06 O ATOM 1458 CG2 THR E 208 46.183 52.478 23.166 1.00 10.15 C ATOM 1459 N LEU E 209 42.910 49.779 21.666 1.00 11.84 N ATOM 1460 CA LEU E 209 41.745 49.462 20.802 1.00 12.22 C ATOM 1461 C LEU E 209 40.586 50.397 21.162 1.00 12.66 C ATOM 1462 O LEU E 209 40.522 50.907 22.274 1.00 11.71 O ATOM 1463 CB LEU E 209 41.319 47.994 21.024 1.00 11.95 C ATOM 1464 CG LEU E 209 42.324 46.974 20.477 1.00 12.18 C ATOM 1465 CD1 LEU E 209 41.982 45.556 20.994 1.00 13.77 C ATOM 1466 CD2 LEU E 209 42.363 47.008 18.946 1.00 10.65 C ATOM 1467 N PRO E 210 39.667 50.636 20.246 1.00 12.83 N ATOM 1468 CA PRO E 210 38.592 51.608 20.521 1.00 13.16 C ATOM 1469 C PRO E 210 37.724 51.259 21.767 1.00 13.66 C ATOM 1470 O PRO E 210 37.576 50.093 22.180 1.00 13.52 O ATOM 1471 CB PRO E 210 37.747 51.579 19.242 1.00 13.63 C ATOM 1472 CG PRO E 210 38.766 51.083 18.140 1.00 13.06 C ATOM 1473 CD PRO E 210 39.570 50.043 18.899 1.00 13.22 C ATOM 1474 N GLY E 211 37.181 52.321 22.353 1.00 14.78 N ATOM 1475 CA GLY E 211 36.346 52.211 23.556 1.00 14.91 C ATOM 1476 C GLY E 211 37.202 51.884 24.764 1.00 14.57 C ATOM 1477 O GLY E 211 36.799 51.076 25.621 1.00 14.95 O ATOM 1478 N ASN E 212 38.413 52.461 24.797 1.00 13.92 N ATOM 1479 CA ASN E 212 39.298 52.357 25.963 1.00 14.66 C ATOM 1480 C ASN E 212 39.612 50.919 26.286 1.00 13.75 C ATOM 1481 O ASN E 212 39.431 50.431 27.427 1.00 15.19 O ATOM 1482 CB ASN E 212 38.652 53.020 27.190 1.00 16.02 C ATOM 1483 CG ASN E 212 39.610 53.120 28.371 1.00 17.23 C ATOM 1484 OD1 ASN E 212 40.826 53.102 28.199 1.00 17.68 O ATOM 1485 ND2 ASN E 212 39.046 53.132 29.581 1.00 19.52 N ATOM 1486 N LYS E 213 40.024 50.191 25.266 1.00 12.67 N ATOM 1487 CA LYS E 213 40.414 48.806 25.457 1.00 12.15 C ATOM 1488 C LYS E 213 41.860 48.642 24.992 1.00 11.27 C ATOM 1489 O LYS E 213 42.480 49.607 24.482 1.00 10.94 O ATOM 1490 CB LYS E 213 39.520 47.869 24.587 1.00 13.50 C ATOM 1491 CG LYS E 213 37.985 47.917 24.917 1.00 16.32 C ATOM 1492 CD LYS E 213 37.729 47.452 26.352 1.00 20.65 C ATOM 1493 CE LYS E 213 36.189 47.344 26.681 1.00 21.79 C ATOM 1494 NZ ALYS E 213 36.081 46.555 28.001 0.67 22.24 N ATOM 1495 NZ BLYS E 213 35.479 48.621 26.424 0.33 15.00 N ATOM 1496 N TYR E 214 42.383 47.437 25.189 1.00 11.33 N ATOM 1497 CA TYR E 214 43.716 47.035 24.717 1.00 10.70 C ATOM 1498 C TYR E 214 43.619 45.605 24.221 1.00 11.90 C ATOM 1499 O TYR E 214 42.721 44.834 24.649 1.00 12.90 O ATOM 1500 CB TYR E 214 44.747 47.054 25.891 1.00 11.03 C ATOM 1501 CG TYR E 214 44.830 48.420 26.530 1.00 10.51 C ATOM 1502 CD1 TYR E 214 45.694 49.395 26.021 1.00 11.77 C ATOM 1503 CD2 TYR E 214 43.977 48.781 27.613 1.00 12.73 C ATOM 1504 CE1 TYR E 214 45.746 50.678 26.584 1.00 11.64 C ATOM 1505 CE2 TYR E 214 44.007 50.065 28.181 1.00 15.38 C ATOM 1506 CZ TYR E 214 44.905 51.019 27.654 1.00 10.74 C ATOM 1507 OH TYR E 214 44.950 52.298 28.201 1.00 11.22 O ATOM 1508 N GLY E 215 44.524 45.213 23.353 1.00 11.95 N ATOM 1509 CA GLY E 215 44.549 43.824 22.965 1.00 11.20 C ATOM 1510 C GLY E 215 45.725 43.494 22.070 1.00 11.12 C ATOM 1511 O GLY E 215 46.354 44.392 21.502 1.00 11.16 O ATOM 1512 N ALA E 216 45.983 42.189 21.950 1.00 10.33 N ATOM 1513 CA ALA E 216 47.102 41.662 21.175 1.00 11.59 C ATOM 1514 C ALA E 216 46.688 41.331 19.721 1.00 12.45 C ATOM 1515 O ALA E 216 45.801 40.482 19.498 1.00 13.32 O ATOM 1516 CB ALA E 216 47.660 40.373 21.888 1.00 11.83 C ATOM 1517 N TYR E 217 47.307 42.022 18.750 1.00 12.64 N ATOM 1518 CA TYR E 217 47.043 41.756 17.328 1.00 11.95 C ATOM 1519 C TYR E 217 48.355 41.246 16.730 1.00 12.54 C ATOM 1520 O TYR E 217 49.439 41.348 17.356 1.00 12.55 O ATOM 1521 CB TYR E 217 46.629 43.030 16.581 1.00 11.80 C ATOM 1522 CG TYR E 217 45.167 43.422 16.680 1.00 12.33 C ATOM 1523 CD1 TYR E 217 44.343 42.900 17.665 1.00 13.80 C ATOM 1524 CD2 TYR E 217 44.624 44.304 15.751 1.00 15.70 C ATOM 1525 CE1 TYR E 217 42.962 43.268 17.741 1.00 14.45 C ATOM 1526 CE2 TYR E 217 43.240 44.679 15.803 1.00 14.07 C ATOM 1527 CZ TYR E 217 42.440 44.137 16.803 1.00 15.04 C ATOM 1528 OH TYR E 217 41.098 44.489 16.870 1.00 17.33 O ATOM 1529 N ASN E 218 48.219 40.640 15.537 1.00 12.34 N ATOM 1530 CA ASN E 218 49.313 40.030 14.761 1.00 12.33 C ATOM 1531 C ASN E 218 49.298 40.604 13.371 1.00 11.29 C ATOM 1532 O ASN E 218 48.222 40.941 12.861 1.00 12.93 O ATOM 1533 CB ASN E 218 49.088 38.496 14.639 1.00 12.49 C ATOM 1534 CG ASN E 218 48.944 37.837 16.010 1.00 15.66 C ATOM 1535 OD1 ASN E 218 49.900 37.643 16.704 1.00 17.24 O ATOM 1536 ND2 ASN E 218 47.699 37.556 16.414 1.00 24.43 N ATOM 1537 N GLY E 219 50.452 40.701 12.727 1.00 11.99 N ATOM 1538 CA GLY E 219 50.455 41.170 11.361 1.00 11.58 C ATOM 1539 C GLY E 219 51.691 41.972 11.002 1.00 11.35 C ATOM 1540 O GLY E 219 52.330 42.564 11.869 1.00 10.71 O ATOM 1541 N THR E 220 51.991 42.035 9.711 1.00 10.82 N ATOM 1542 CA THR E 220 52.961 43.056 9.308 1.00 11.80 C ATOM 1543 C THR E 220 52.393 44.459 9.579 1.00 10.83 C ATOM 1544 O THR E 220 53.179 45.422 9.674 1.00 11.62 O ATOM 1545 CB THR E 220 53.428 42.931 7.818 1.00 12.22 C ATOM 1546 OG1 THR E 220 52.297 42.871 6.931 1.00 12.30 O ATOM 1547 CG2 THR E 220 54.290 41.633 7.617 1.00 12.25 C ATOM 1548 N SER E 221 51.065 44.588 9.709 1.00 11.15 N ATOM 1549 CA SER E 221 50.484 45.875 10.195 1.00 10.27 C ATOM 1550 C SER E 221 51.023 46.329 11.555 1.00 10.07 C ATOM 1551 O SER E 221 51.039 47.526 11.831 1.00 10.19 O ATOM 1552 CB SER E 221 48.988 45.738 10.432 1.00 8.81 C ATOM 1553 OG SER E 221 48.293 45.817 9.191 1.00 10.12 O ATOM 1554 N MET E 222 51.351 45.370 12.400 1.00 10.22 N ATOM 1555 CA MET E 222 51.849 45.629 13.746 1.00 10.70 C ATOM 1556 C MET E 222 53.326 45.930 13.705 1.00 11.18 C ATOM 1557 O MET E 222 53.857 46.628 14.580 1.00 10.90 O ATOM 1558 CB MET E 222 51.565 44.392 14.664 1.00 11.73 C ATOM 1559 CG MET E 222 50.100 44.328 15.192 1.00 10.64 C ATOM 1560 SD MET E 222 48.811 44.153 13.877 1.00 11.88 S ATOM 1561 CE MET E 222 48.083 45.772 13.810 1.00 10.41 C ATOM 1562 N ALA E 223 54.020 45.354 12.739 1.00 10.93 N ATOM 1563 CA ALA E 223 55.461 45.575 12.634 1.00 11.16 C ATOM 1564 C ALA E 223 55.757 46.978 12.107 1.00 10.46 C ATOM 1565 O ALA E 223 56.618 47.678 12.644 1.00 9.97 O ATOM 1566 CB ALA E 223 56.093 44.507 11.688 1.00 10.45 C ATOM 1567 N SER E 224 55.047 47.379 11.047 1.00 10.50 N ATOM 1568 CA SER E 224 55.259 48.709 10.433 1.00 9.70 C ATOM 1569 C SER E 224 55.298 49.885 11.439 1.00 10.24 C ATOM 1570 O SER E 224 56.226 50.685 11.360 1.00 10.08 O ATOM 1571 CB SER E 224 54.195 48.955 9.341 1.00 10.76 C ATOM 1572 OG SER E 224 54.397 50.157 8.616 1.00 11.79 O ATOM 1573 N PRO E 225 54.334 50.026 12.349 1.00 9.71 N ATOM 1574 CA PRO E 225 54.357 51.183 13.274 1.00 8.31 C ATOM 1575 C PRO E 225 55.538 51.145 14.259 1.00 10.89 C ATOM 1576 O PRO E 225 55.884 52.217 14.764 1.00 10.78 O ATOM 1577 CB PRO E 225 53.002 51.084 14.037 1.00 10.20 C ATOM 1578 CG PRO E 225 52.600 49.599 13.885 1.00 8.29 C ATOM 1579 CD PRO E 225 53.062 49.276 12.469 1.00 8.99 C ATOM 1580 N HIS E 226 56.161 49.983 14.490 1.00 9.88 N ATOM 1581 CA HIS E 226 57.393 50.014 15.306 1.00 9.25 C ATOM 1582 C HIS E 226 58.445 50.847 14.544 1.00 10.02 C ATOM 1583 O HIS E 226 59.201 51.611 15.154 1.00 9.94 O ATOM 1584 CB HIS E 226 57.939 48.595 15.531 1.00 9.00 C ATOM 1585 CG HIS E 226 57.172 47.812 16.570 1.00 10.64 C ATOM 1586 ND1 HIS E 226 56.061 47.039 16.263 1.00 9.15 N ATOM 1587 CD2 HIS E 226 57.367 47.682 17.901 1.00 11.14 C ATOM 1588 CE1 HIS E 226 55.612 46.465 17.375 1.00 9.88 C ATOM 1589 NE2 HIS E 226 56.384 46.835 18.377 1.00 10.07 N ATOM 1590 N VAL E 227 58.488 50.641 13.210 1.00 10.49 N ATOM 1591 CA VAL E 227 59.475 51.357 12.358 1.00 10.32 C ATOM 1592 C VAL E 227 59.067 52.839 12.143 1.00 10.12 C ATOM 1593 O VAL E 227 59.951 53.718 12.207 1.00 10.18 O ATOM 1594 CB VAL E 227 59.629 50.605 11.037 1.00 9.61 C ATOM 1595 CG1 VAL E 227 60.686 51.298 10.105 1.00 9.55 C ATOM 1596 CG2 VAL E 227 60.115 49.156 11.320 1.00 9.93 C ATOM 1597 N ALA E 228 57.768 53.127 11.971 1.00 9.80 N ATOM 1598 CA ALA E 228 57.360 54.517 11.849 1.00 9.71 C ATOM 1599 C ALA E 228 57.669 55.233 13.171 1.00 10.49 C ATOM 1600 O ALA E 228 58.147 56.361 13.176 1.00 10.07 O ATOM 1601 CB ALA E 228 55.892 54.575 11.570 1.00 9.67 C ATOM 1602 N GLY E 229 57.338 54.582 14.290 1.00 9.43 N ATOM 1603 CA GLY E 229 57.666 55.143 15.611 1.00 10.01 C ATOM 1604 C GLY E 229 59.181 55.328 15.765 1.00 10.26 C ATOM 1605 O GLY E 229 59.668 56.371 16.307 1.00 9.64 O ATOM 1606 N ALA E 230 59.962 54.364 15.291 1.00 8.89 N ATOM 1607 CA ALA E 230 61.420 54.484 15.429 1.00 10.39 C ATOM 1608 C ALA E 230 61.871 55.711 14.626 1.00 9.98 C ATOM 1609 O ALA E 230 62.770 56.460 15.034 1.00 9.88 O ATOM 1610 CB ALA E 230 62.114 53.256 14.877 1.00 9.10 C ATOM 1611 N ALA E 231 61.316 55.869 13.449 1.00 9.36 N ATOM 1612 CA ALA E 231 61.663 57.048 12.638 1.00 9.89 C ATOM 1613 C ALA E 231 61.370 58.366 13.379 1.00 10.76 C ATOM 1614 O ALA E 231 62.192 59.318 13.316 1.00 10.88 O ATOM 1615 CB ALA E 231 60.853 56.999 11.296 1.00 9.64 C ATOM 1616 N ALA E 232 60.233 58.423 14.088 1.00 11.24 N ATOM 1617 CA ALA E 232 59.916 59.613 14.883 1.00 9.39 C ATOM 1618 C ALA E 232 60.929 59.780 16.014 1.00 10.70 C ATOM 1619 O ALA E 232 61.308 60.908 16.325 1.00 11.34 O ATOM 1620 CB ALA E 232 58.463 59.514 15.400 1.00 10.33 C ATOM 1621 N LEU E 233 61.341 58.694 16.702 1.00 10.47 N ATOM 1622 CA LEU E 233 62.364 58.847 17.757 1.00 10.29 C ATOM 1623 C LEU E 233 63.644 59.405 17.169 1.00 10.61 C ATOM 1624 O LEU E 233 64.260 60.292 17.757 1.00 11.51 O ATOM 1625 CB LEU E 233 62.749 57.486 18.377 1.00 9.62 C ATOM 1626 CG LEU E 233 61.618 56.881 19.272 1.00 11.57 C ATOM 1627 CD1 LEU E 233 62.064 55.448 19.751 1.00 9.77 C ATOM 1628 CD2 LEU E 233 61.305 57.844 20.455 1.00 9.56 C ATOM 1629 N ILE E 234 64.066 58.829 16.040 1.00 10.63 N ATOM 1630 CA ILE E 234 65.283 59.302 15.384 1.00 11.15 C ATOM 1631 C ILE E 234 65.240 60.809 15.037 1.00 11.24 C ATOM 1632 O ILE E 234 66.194 61.546 15.311 1.00 10.99 O ATOM 1633 CB ILE E 234 65.609 58.452 14.159 1.00 9.99 C ATOM 1634 CG1 ILE E 234 65.970 57.043 14.633 1.00 9.50 C ATOM 1635 CG2 ILE E 234 66.817 59.091 13.363 1.00 11.12 C ATOM 1636 CD1 ILE E 234 65.793 55.987 13.492 1.00 11.42 C ATOM 1637 N LEU E 235 64.122 61.236 14.488 1.00 10.27 N ATOM 1638 CA LEU E 235 63.952 62.629 14.096 1.00 11.92 C ATOM 1639 C LEU E 235 63.888 63.531 15.318 1.00 12.46 C ATOM 1640 O LEU E 235 64.383 64.688 15.254 1.00 13.62 O ATOM 1641 CB LEU E 235 62.692 62.794 13.225 1.00 10.79 C ATOM 1642 CG LEU E 235 62.880 62.274 11.803 1.00 11.63 C ATOM 1643 CD1 LEU E 235 61.468 62.234 11.140 1.00 12.40 C ATOM 1644 CD2 LEU E 235 63.820 63.289 11.009 1.00 12.58 C ATOM 1645 N SER E 236 63.326 63.038 16.427 1.00 12.34 N ATOM 1646 CA SER E 236 63.326 63.872 17.646 1.00 12.35 C ATOM 1647 C SER E 236 64.720 64.063 18.213 1.00 12.29 C ATOM 1648 O SER E 236 65.009 65.135 18.833 1.00 14.88 O ATOM 1649 CB SER E 236 62.337 63.349 18.735 1.00 11.71 C ATOM 1650 OG SER E 236 62.782 62.152 19.367 1.00 11.80 O ATOM 1651 N LYS E 237 65.608 63.097 17.990 1.00 11.72 N ATOM 1652 CA LYS E 237 66.989 63.262 18.435 1.00 12.32 C ATOM 1653 C LYS E 237 67.830 64.018 17.370 1.00 13.16 C ATOM 1654 O LYS E 237 68.786 64.718 17.754 1.00 14.41 O ATOM 1655 CB LYS E 237 67.653 61.909 18.722 1.00 11.35 C ATOM 1656 CG LYS E 237 69.066 62.034 19.306 1.00 10.40 C ATOM 1657 CD LYS E 237 69.639 60.721 19.675 1.00 12.30 C ATOM 1658 CE LYS E 237 71.092 60.915 20.225 1.00 15.39 C ATOM 1659 NZ LYS E 237 71.752 59.568 20.457 1.00 17.56 N ATOM 1660 N HIS E 238 67.497 63.881 16.086 1.00 12.78 N ATOM 1661 CA HIS E 238 68.232 64.524 14.973 1.00 12.58 C ATOM 1662 C HIS E 238 67.234 65.234 14.065 1.00 12.70 C ATOM 1663 O HIS E 238 66.899 64.718 12.996 1.00 13.96 O ATOM 1664 CB HIS E 238 69.004 63.447 14.159 1.00 12.10 C ATOM 1665 CG HIS E 238 69.988 62.690 14.975 1.00 14.22 C ATOM 1666 ND1 HIS E 238 71.235 63.197 15.294 1.00 13.12 N ATOM 1667 CD2 HIS E 238 69.912 61.462 15.556 1.00 12.18 C ATOM 1668 CE1 HIS E 238 71.894 62.303 16.012 1.00 12.98 C ATOM 1669 NE2 HIS E 238 71.106 61.251 16.200 1.00 12.55 N ATOM 1670 N PRO E 239 66.672 66.350 14.513 1.00 14.28 N ATOM 1671 CA PRO E 239 65.570 66.999 13.779 1.00 15.35 C ATOM 1672 C PRO E 239 65.973 67.505 12.390 1.00 16.34 C ATOM 1673 O PRO E 239 65.109 67.732 11.593 1.00 18.11 O ATOM 1674 CB PRO E 239 65.142 68.187 14.683 1.00 17.37 C ATOM 1675 CG PRO E 239 65.876 68.045 15.951 1.00 17.81 C ATOM 1676 CD PRO E 239 66.999 67.022 15.803 1.00 14.80 C ATOM 1677 N ASN E 240 67.247 67.610 12.089 1.00 15.92 N ATOM 1678 CA ASN E 240 67.619 68.013 10.715 1.00 16.80 C ATOM 1679 C AASN E 240 67.939 66.895 9.786 0.50 16.55 C ATOM 1680 C BASN E 240 68.266 66.882 9.902 0.50 16.97 C ATOM 1681 O AASN E 240 68.251 67.158 8.609 0.50 15.83 O ATOM 1682 O BASN E 240 68.982 67.091 8.903 0.50 16.74 O ATOM 1683 CB AASN E 240 68.910 68.862 10.864 0.50 16.02 C ATOM 1684 CB BASN E 240 68.337 69.359 10.631 0.50 17.88 C ATOM 1685 CG AASN E 240 68.577 70.296 11.093 0.50 15.75 C ATOM 1686 CG BASN E 240 69.543 69.330 11.415 0.50 16.59 C ATOM 1687 OD1AASN E 240 67.490 70.690 10.770 0.50 14.44 O ATOM 1688 OD1BASN E 240 69.814 68.294 11.999 0.50 20.31 O ATOM 1689 ND2AASN E 240 69.472 71.065 11.664 0.50 11.75 N ATOM 1690 ND2BASN E 240 70.298 70.429 11.473 0.50 17.82 N ATOM 1691 N TRP E 241 67.946 65.651 10.301 1.00 15.49 N ATOM 1692 CA TRP E 241 68.208 64.499 9.432 1.00 15.66 C ATOM 1693 C TRP E 241 67.053 64.421 8.431 1.00 14.81 C ATOM 1694 O TRP E 241 65.879 64.664 8.768 1.00 15.36 O ATOM 1695 CB TRP E 241 68.234 63.186 10.205 1.00 14.97 C ATOM 1696 CG TRP E 241 69.579 62.918 10.824 1.00 15.93 C ATOM 1697 CD1 TRP E 241 70.629 63.830 10.955 1.00 16.38 C ATOM 1698 CD2 TRP E 241 70.004 61.728 11.470 1.00 13.77 C ATOM 1699 NE1 TRP E 241 71.688 63.237 11.596 1.00 14.40 N ATOM 1700 CE2 TRP E 241 71.337 61.949 11.933 1.00 13.55 C ATOM 1701 CE3 TRP E 241 69.405 60.474 11.719 1.00 13.53 C ATOM 1702 CZ2 TRP E 241 72.057 60.987 12.611 1.00 13.70 C ATOM 1703 CZ3 TRP E 241 70.163 59.497 12.404 1.00 12.23 C ATOM 1704 CH2 TRP E 241 71.451 59.784 12.868 1.00 15.44 C ATOM 1705 N THR E 242 67.402 64.127 7.191 1.00 14.10 N ATOM 1706 CA THR E 242 66.406 63.999 6.142 1.00 13.54 C ATOM 1707 C THR E 242 65.779 62.638 6.244 1.00 12.88 C ATOM 1708 O THR E 242 66.322 61.762 6.915 1.00 12.37 O ATOM 1709 CB THR E 242 67.109 64.014 4.751 1.00 14.04 C ATOM 1710 OG1 THR E 242 68.100 62.969 4.720 1.00 16.00 O ATOM 1711 CG2 THR E 242 67.900 65.368 4.569 1.00 15.48 C ATOM 1712 N ASN E 243 64.698 62.452 5.506 1.00 12.39 N ATOM 1713 CA ASN E 243 64.113 61.076 5.397 1.00 12.90 C ATOM 1714 C ASN E 243 65.146 60.087 4.866 1.00 12.74 C ATOM 1715 O ASN E 243 65.244 58.949 5.366 1.00 12.31 O ATOM 1716 CB ASN E 243 62.830 61.051 4.556 1.00 12.30 C ATOM 1717 CG ASN E 243 62.991 61.658 3.165 1.00 14.22 C ATOM 1718 OD1 ASN E 243 63.937 62.411 2.858 1.00 13.02 O ATOM 1719 ND2 ASN E 243 62.029 61.353 2.305 1.00 13.28 N ATOM 1720 N THR E 244 65.956 60.524 3.895 1.00 12.40 N ATOM 1721 CA THR E 244 67.036 59.667 3.383 1.00 13.19 C ATOM 1722 C THR E 244 67.941 59.134 4.488 1.00 14.39 C ATOM 1723 O THR E 244 68.265 57.930 4.550 1.00 14.37 O ATOM 1724 CB THR E 244 67.941 60.523 2.435 1.00 15.11 C ATOM 1725 OG1 THR E 244 67.113 61.163 1.464 1.00 15.75 O ATOM 1726 CG2 THR E 244 68.864 59.606 1.673 1.00 16.35 C ATOM 1727 N GLN E 245 68.354 60.041 5.370 1.00 13.20 N ATOM 1728 CA GLN E 245 69.227 59.702 6.457 1.00 13.82 C ATOM 1729 C GLN E 245 68.515 58.810 7.513 1.00 11.91 C ATOM 1730 O GLN E 245 69.132 57.915 8.111 1.00 13.53 O ATOM 1731 CB GLN E 245 69.735 60.985 7.126 1.00 14.24 C ATOM 1732 CG GLN E 245 70.454 60.723 8.425 1.00 20.58 C ATOM 1733 CD GLN E 245 71.784 59.898 8.311 1.00 28.78 C ATOM 1734 OE1 GLN E 245 72.276 59.381 9.322 1.00 29.31 O ATOM 1735 NE2 GLN E 245 72.327 59.767 7.100 1.00 26.24 N ATOM 1736 N VAL E 246 67.263 59.122 7.791 1.00 12.66 N ATOM 1737 CA VAL E 246 66.518 58.278 8.763 1.00 11.74 C ATOM 1738 C VAL E 246 66.393 56.857 8.240 1.00 12.16 C ATOM 1739 O VAL E 246 66.635 55.879 8.980 1.00 12.36 O ATOM 1740 CB VAL E 246 65.094 58.909 9.051 1.00 10.25 C ATOM 1741 CG1 VAL E 246 64.274 57.976 9.969 1.00 11.75 C ATOM 1742 CG2 VAL E 246 65.264 60.281 9.772 1.00 12.15 C ATOM 1743 N ARG E 247 65.985 56.743 6.982 1.00 12.28 N ATOM 1744 CA ARG E 247 65.890 55.441 6.348 1.00 11.58 C ATOM 1745 C ARG E 247 67.217 54.704 6.394 1.00 12.43 C ATOM 1746 O ARG E 247 67.262 53.520 6.808 1.00 11.91 O ATOM 1747 CB ARG E 247 65.428 55.603 4.898 1.00 12.37 C ATOM 1748 CG ARG E 247 65.400 54.245 4.164 1.00 10.78 C ATOM 1749 CD ARG E 247 64.580 54.320 2.915 1.00 11.71 C ATOM 1750 NE ARG E 247 64.564 52.989 2.285 1.00 14.26 N ATOM 1751 CZ ARG E 247 63.758 52.648 1.263 1.00 16.50 C ATOM 1752 NH1 ARG E 247 62.942 53.540 0.706 1.00 14.71 N ATOM 1753 NH2 ARG E 247 63.834 51.397 0.772 1.00 15.46 N ATOM 1754 N SER E 248 68.296 55.355 5.935 1.00 12.04 N ATOM 1755 CA SER E 248 69.592 54.649 6.030 1.00 12.80 C ATOM 1756 C SER E 248 69.956 54.304 7.448 1.00 12.74 C ATOM 1757 O SER E 248 70.523 53.264 7.655 1.00 12.77 O ATOM 1758 CB SER E 248 70.787 55.408 5.415 1.00 14.16 C ATOM 1759 OG ASER E 248 70.501 55.935 4.155 0.50 10.93 O ATOM 1760 OG BSER E 248 70.925 56.698 5.859 0.50 13.63 O ATOM 1761 N SER E 249 69.639 55.167 8.421 1.00 12.26 N ATOM 1762 CA SER E 249 70.044 54.853 9.776 1.00 12.67 C ATOM 1763 C SER E 249 69.390 53.565 10.254 1.00 11.92 C ATOM 1764 O SER E 249 70.040 52.772 10.966 1.00 12.67 O ATOM 1765 CB SER E 249 69.775 56.013 10.759 1.00 12.18 C ATOM 1766 OG ASER E 249 70.315 57.232 10.282 0.33 14.31 O ATOM 1767 OG BSER E 249 68.425 56.161 11.065 0.67 12.36 O ATOM 1768 N LEU E 250 68.120 53.385 9.907 1.00 12.10 N ATOM 1769 CA LEU E 250 67.426 52.158 10.345 1.00 11.74 C ATOM 1770 C LEU E 250 67.942 50.938 9.586 1.00 11.72 C ATOM 1771 O LEU E 250 68.199 49.869 10.160 1.00 12.81 O ATOM 1772 CB LEU E 250 65.947 52.338 10.034 1.00 12.00 C ATOM 1773 CG LEU E 250 65.238 53.287 11.008 1.00 12.89 C ATOM 1774 CD1 LEU E 250 63.938 53.838 10.398 1.00 15.31 C ATOM 1775 CD2 LEU E 250 65.009 52.551 12.354 1.00 13.69 C ATOM 1776 N GLU E 251 68.173 51.102 8.297 1.00 12.29 N ATOM 1777 CA GLU E 251 68.693 49.974 7.503 1.00 12.35 C ATOM 1778 C GLU E 251 70.093 49.558 7.903 1.00 12.87 C ATOM 1779 O GLU E 251 70.412 48.376 7.871 1.00 13.33 O ATOM 1780 CB GLU E 251 68.698 50.322 6.012 1.00 12.75 C ATOM 1781 CG GLU E 251 67.264 50.446 5.469 1.00 12.67 C ATOM 1782 CD GLU E 251 67.218 51.104 4.103 1.00 16.49 C ATOM 1783 OE1 GLU E 251 68.218 51.748 3.662 1.00 15.99 O ATOM 1784 OE2 GLU E 251 66.159 50.959 3.439 1.00 15.40 O ATOM 1785 N ASN E 252 70.943 50.530 8.270 1.00 11.84 N ATOM 1786 CA ASN E 252 72.351 50.276 8.441 1.00 12.10 C ATOM 1787 C ASN E 252 72.671 49.770 9.830 1.00 12.82 C ATOM 1788 O ASN E 252 73.840 49.496 10.118 1.00 12.80 O ATOM 1789 CB ASN E 252 73.120 51.596 8.185 1.00 11.86 C ATOM 1790 CG ASN E 252 73.105 52.023 6.704 1.00 11.86 C ATOM 1791 OD1 ASN E 252 73.621 53.133 6.375 1.00 16.18 O ATOM 1792 ND2 ASN E 252 72.466 51.243 5.858 1.00 10.26 N ATOM 1793 N THR E 253 71.655 49.727 10.727 1.00 11.60 N ATOM 1794 CA THR E 253 71.914 49.337 12.117 1.00 12.10 C ATOM 1795 C THR E 253 71.049 48.174 12.599 1.00 12.06 C ATOM 1796 O THR E 253 70.994 47.946 13.797 1.00 13.03 O ATOM 1797 CB THR E 253 71.702 50.504 13.092 1.00 12.48 C ATOM 1798 OG1 THR E 253 70.359 51.017 12.921 1.00 11.99 O ATOM 1799 CG2 THR E 253 72.599 51.715 12.662 1.00 12.32 C ATOM 1800 N THR E 254 70.369 47.502 11.683 1.00 11.98 N ATOM 1801 CA THR E 254 69.585 46.337 12.058 1.00 11.84 C ATOM 1802 C THR E 254 70.474 45.269 12.682 1.00 11.96 C ATOM 1803 O THR E 254 71.690 45.208 12.455 1.00 12.21 O ATOM 1804 CB THR E 254 68.971 45.679 10.835 1.00 10.76 C ATOM 1805 OG1 THR E 254 70.018 45.505 9.860 1.00 12.99 O ATOM 1806 CG2 THR E 254 67.856 46.528 10.174 1.00 10.62 C ATOM 1807 N THR E 255 69.853 44.433 13.490 1.00 11.55 N ATOM 1808 CA THR E 255 70.471 43.151 13.890 1.00 12.12 C ATOM 1809 C THR E 255 70.171 42.163 12.785 1.00 14.02 C ATOM 1810 O THR E 255 69.020 41.783 12.567 1.00 12.59 O ATOM 1811 CB THR E 255 69.853 42.732 15.215 1.00 11.10 C ATOM 1812 OG1 THR E 255 70.319 43.641 16.223 1.00 13.00 O ATOM 1813 CG2 THR E 255 70.429 41.347 15.683 1.00 13.90 C ATOM 1814 N LYS E 256 71.203 41.693 12.069 1.00 14.09 N ATOM 1815 CA LYS E 256 70.915 40.799 10.925 1.00 15.41 C ATOM 1816 C LYS E 256 70.422 39.464 11.462 1.00 15.55 C ATOM 1817 O LYS E 256 70.878 39.005 12.531 1.00 16.04 O ATOM 1818 CB LYS E 256 72.198 40.612 10.068 1.00 17.01 C ATOM 1819 CG LYS E 256 72.624 41.932 9.285 1.00 15.44 C ATOM 1820 CD LYS E 256 72.138 41.951 7.816 1.00 17.66 C ATOM 1821 CE LYS E 256 72.369 43.376 7.231 1.00 17.30 C ATOM 1822 NZ LYS E 256 72.695 43.457 5.743 1.00 15.07 N ATOM 1823 N LEU E 257 69.454 38.898 10.742 1.00 16.47 N ATOM 1824 CA LEU E 257 68.775 37.683 11.159 1.00 18.81 C ATOM 1825 C LEU E 257 69.142 36.663 10.061 1.00 21.77 C ATOM 1826 O LEU E 257 70.349 36.517 9.759 1.00 26.02 O ATOM 1827 CB LEU E 257 67.269 37.935 11.354 1.00 16.96 C ATOM 1828 CG LEU E 257 67.021 38.923 12.527 1.00 16.64 C ATOM 1829 CD1 LEU E 257 65.471 39.206 12.659 1.00 14.27 C ATOM 1830 CD2 LEU E 257 67.669 38.427 13.833 1.00 19.41 C ATOM 1831 N GLY E 258 68.194 36.036 9.416 1.00 23.07 N ATOM 1832 CA GLY E 258 68.545 35.134 8.313 1.00 23.68 C ATOM 1833 C GLY E 258 68.770 35.731 6.931 1.00 23.47 C ATOM 1834 O GLY E 258 69.071 36.930 6.745 1.00 23.71 O ATOM 1835 N ASP E 259 68.576 34.882 5.914 1.00 22.79 N ATOM 1836 CA ASP E 259 68.650 35.333 4.545 1.00 21.97 C ATOM 1837 C ASP E 259 67.749 36.539 4.283 1.00 20.90 C ATOM 1838 O ASP E 259 66.609 36.559 4.780 1.00 19.58 O ATOM 1839 CB ASP E 259 68.250 34.195 3.604 1.00 23.08 C ATOM 1840 CG ASP E 259 68.526 34.541 2.180 1.00 27.99 C ATOM 1841 OD1 ASP E 259 69.659 34.255 1.708 1.00 38.70 O ATOM 1842 OD2 ASP E 259 67.742 35.154 1.458 1.00 26.87 O ATOM 1843 N SER E 260 68.230 37.498 3.483 1.00 19.73 N ATOM 1844 CA SER E 260 67.506 38.758 3.243 1.00 19.30 C ATOM 1845 C SER E 260 66.190 38.580 2.486 1.00 19.43 C ATOM 1846 O SER E 260 65.282 39.390 2.599 1.00 17.45 O ATOM 1847 CB SER E 260 68.400 39.779 2.541 1.00 20.29 C ATOM 1848 OG SER E 260 68.738 39.333 1.246 1.00 24.04 O ATOM 1849 N PHE E 261 66.050 37.445 1.781 1.00 19.15 N ATOM 1850 CA PHE E 261 64.801 37.139 1.134 1.00 18.67 C ATOM 1851 C PHE E 261 63.692 37.010 2.148 1.00 17.22 C ATOM 1852 O PHE E 261 62.572 37.437 1.884 1.00 17.37 O ATOM 1853 CB PHE E 261 64.934 35.815 0.314 1.00 19.10 C ATOM 1854 CG PHE E 261 63.748 35.519 -0.546 1.00 18.84 C ATOM 1855 CD1 PHE E 261 63.614 36.091 -1.826 1.00 20.00 C ATOM 1856 CD2 PHE E 261 62.755 34.636 -0.073 1.00 19.54 C ATOM 1857 CE1 PHE E 261 62.510 35.799 -2.642 1.00 19.94 C ATOM 1858 CE2 PHE E 261 61.633 34.339 -0.884 1.00 22.13 C ATOM 1859 CZ PHE E 261 61.506 34.913 -2.155 1.00 19.15 C ATOM 1860 N TYR E 262 64.023 36.453 3.312 1.00 16.37 N ATOM 1861 CA TYR E 262 63.037 36.204 4.353 1.00 16.96 C ATOM 1862 C TYR E 262 63.048 37.238 5.465 1.00 16.06 C ATOM 1863 O TYR E 262 62.031 37.420 6.138 1.00 15.45 O ATOM 1864 CB TYR E 262 63.286 34.826 4.983 1.00 17.20 C ATOM 1865 CG TYR E 262 63.136 33.721 3.954 1.00 21.00 C ATOM 1866 CD1 TYR E 262 61.876 33.234 3.616 1.00 23.19 C ATOM 1867 CD2 TYR E 262 64.266 33.166 3.327 1.00 24.61 C ATOM 1868 CE1 TYR E 262 61.722 32.207 2.641 1.00 25.27 C ATOM 1869 CE2 TYR E 262 64.123 32.145 2.351 1.00 27.04 C ATOM 1870 CZ TYR E 262 62.865 31.680 2.036 1.00 27.90 C ATOM 1871 OH TYR E 262 62.713 30.678 1.089 1.00 25.46 O ATOM 1872 N TYR E 263 64.196 37.887 5.664 1.00 15.21 N ATOM 1873 CA TYR E 263 64.356 38.782 6.831 1.00 14.81 C ATOM 1874 C TYR E 263 64.755 40.194 6.467 1.00 14.75 C ATOM 1875 O TYR E 263 65.022 40.998 7.378 1.00 15.01 O ATOM 1876 CB TYR E 263 65.404 38.208 7.796 1.00 14.10 C ATOM 1877 CG TYR E 263 64.902 37.012 8.577 1.00 15.11 C ATOM 1878 CD1 TYR E 263 64.286 37.181 9.836 1.00 15.64 C ATOM 1879 CD2 TYR E 263 65.042 35.718 8.071 1.00 17.19 C ATOM 1880 CE1 TYR E 263 63.840 36.096 10.593 1.00 15.36 C ATOM 1881 CE2 TYR E 263 64.579 34.610 8.801 1.00 18.52 C ATOM 1882 CZ TYR E 263 63.988 34.798 10.073 1.00 19.25 C ATOM 1883 OH TYR E 263 63.470 33.727 10.808 1.00 18.19 O ATOM 1884 N GLY E 264 64.893 40.492 5.176 1.00 14.91 N ATOM 1885 CA GLY E 264 65.498 41.772 4.766 1.00 14.88 C ATOM 1886 C GLY E 264 66.821 41.979 5.483 1.00 15.85 C ATOM 1887 O GLY E 264 67.603 41.019 5.679 1.00 14.47 O ATOM 1888 N LYS E 265 67.068 43.216 5.908 1.00 13.85 N ATOM 1889 CA LYS E 265 68.287 43.529 6.679 1.00 14.63 C ATOM 1890 C LYS E 265 68.274 43.084 8.167 1.00 13.42 C ATOM 1891 O LYS E 265 69.290 43.190 8.863 1.00 14.31 O ATOM 1892 CB LYS E 265 68.568 45.036 6.547 1.00 14.08 C ATOM 1893 CG LYS E 265 68.739 45.392 5.013 1.00 16.64 C ATOM 1894 CD LYS E 265 68.838 46.891 4.805 1.00 18.47 C ATOM 1895 CE LYS E 265 68.941 47.292 3.286 1.00 20.60 C ATOM 1896 NZ LYS E 265 67.761 46.773 2.385 1.00 20.09 N ATOM 1897 N GLY E 266 67.147 42.559 8.649 1.00 13.84 N ATOM 1898 CA GLY E 266 67.060 42.124 10.019 1.00 11.98 C ATOM 1899 C GLY E 266 66.161 43.028 10.877 1.00 11.70 C ATOM 1900 O GLY E 266 65.380 43.858 10.348 1.00 11.63 O ATOM 1901 N LEU E 267 66.338 42.883 12.182 1.00 12.13 N ATOM 1902 CA LEU E 267 65.482 43.548 13.167 1.00 11.26 C ATOM 1903 C LEU E 267 65.984 44.972 13.365 1.00 10.30 C ATOM 1904 O LEU E 267 67.154 45.162 13.606 1.00 12.04 O ATOM 1905 CB LEU E 267 65.574 42.808 14.518 1.00 11.83 C ATOM 1906 CG LEU E 267 64.869 43.542 15.670 1.00 10.22 C ATOM 1907 CD1 LEU E 267 63.304 43.478 15.483 1.00 10.46 C ATOM 1908 CD2 LEU E 267 65.257 42.752 16.912 1.00 12.93 C ATOM 1909 N ILE E 268 65.082 45.963 13.298 1.00 10.15 N ATOM 1910 CA ILE E 268 65.553 47.330 13.615 1.00 10.68 C ATOM 1911 C ILE E 268 65.997 47.482 15.043 1.00 11.22 C ATOM 1912 O ILE E 268 65.529 46.785 15.968 1.00 11.99 O ATOM 1913 CB ILE E 268 64.465 48.380 13.303 1.00 10.71 C ATOM 1914 CG1 ILE E 268 63.170 48.175 14.109 1.00 11.39 C ATOM 1915 CG2 ILE E 268 64.132 48.411 11.776 1.00 9.91 C ATOM 1916 CD1 ILE E 268 62.445 49.565 14.387 1.00 10.33 C ATOM 1917 N ASN E 269 66.924 48.431 15.209 1.00 10.50 N ATOM 1918 CA ASN E 269 67.515 48.693 16.483 1.00 10.22 C ATOM 1919 C ASN E 269 67.614 50.212 16.533 1.00 10.46 C ATOM 1920 O ASN E 269 68.521 50.807 15.941 1.00 11.23 O ATOM 1921 CB ASN E 269 68.900 48.049 16.575 1.00 10.42 C ATOM 1922 CG ASN E 269 69.683 48.533 17.827 1.00 12.06 C ATOM 1923 OD1 ASN E 269 69.269 49.483 18.549 1.00 12.19 O ATOM 1924 ND2 ASN E 269 70.794 47.835 18.131 1.00 12.03 N ATOM 1925 N VAL E 270 66.633 50.850 17.169 1.00 10.50 N ATOM 1926 CA VAL E 270 66.536 52.332 17.082 1.00 10.40 C ATOM 1927 C VAL E 270 67.658 52.995 17.944 1.00 11.08 C ATOM 1928 O VAL E 270 68.095 54.109 17.623 1.00 10.74 O ATOM 1929 CB VAL E 270 65.103 52.837 17.464 1.00 12.06 C ATOM 1930 CG1 VAL E 270 64.780 52.560 18.911 1.00 12.47 C ATOM 1931 CG2 VAL E 270 64.945 54.320 17.110 1.00 12.72 C ATOM 1932 N GLN E 271 68.138 52.311 18.995 1.00 9.95 N ATOM 1933 CA GLN E 271 69.308 52.814 19.764 1.00 11.27 C ATOM 1934 C GLN E 271 70.504 53.020 18.811 1.00 12.61 C ATOM 1935 O GLN E 271 71.100 54.127 18.752 1.00 12.36 O ATOM 1936 CB GLN E 271 69.648 51.873 20.923 1.00 11.58 C ATOM 1937 CG GLN E 271 70.914 52.339 21.697 1.00 13.68 C ATOM 1938 CD GLN E 271 71.241 51.370 22.808 1.00 14.53 C ATOM 1939 OE1 GLN E 271 71.048 50.139 22.661 1.00 18.54 O ATOM 1940 NE2 GLN E 271 71.721 51.902 23.941 1.00 15.97 N ATOM 1941 N ALA E 272 70.836 51.977 18.072 1.00 12.08 N ATOM 1942 CA ALA E 272 71.969 52.036 17.143 1.00 12.71 C ATOM 1943 C ALA E 272 71.681 53.020 16.002 1.00 12.33 C ATOM 1944 O ALA E 272 72.560 53.771 15.594 1.00 13.13 O ATOM 1945 CB ALA E 272 72.280 50.662 16.590 1.00 12.22 C ATOM 1946 N ALA E 273 70.429 53.051 15.511 1.00 10.76 N ATOM 1947 CA ALA E 273 70.060 53.943 14.409 1.00 9.95 C ATOM 1948 C ALA E 273 70.266 55.416 14.783 1.00 11.86 C ATOM 1949 O ALA E 273 70.595 56.282 13.926 1.00 12.80 O ATOM 1950 CB ALA E 273 68.575 53.734 14.017 1.00 9.63 C ATOM 1951 N ALA E 274 70.051 55.728 16.056 1.00 11.79 N ATOM 1952 CA ALA E 274 70.022 57.153 16.441 1.00 12.98 C ATOM 1953 C ALA E 274 71.389 57.644 16.903 1.00 13.84 C ATOM 1954 O ALA E 274 71.500 58.786 17.350 1.00 14.07 O ATOM 1955 CB ALA E 274 68.925 57.402 17.531 1.00 12.84 C ATOM 1956 N GLN E 275 72.427 56.808 16.766 1.00 13.64 N ATOM 1957 CA GLN E 275 73.811 57.235 17.008 1.00 15.24 C ATOM 1958 C GLN E 275 74.321 57.926 15.742 1.00 15.45 C ATOM 1959 O GLN E 275 73.702 57.805 14.686 1.00 15.96 O ATOM 1960 CB GLN E 275 74.694 56.019 17.325 1.00 14.68 C ATOM 1961 CG GLN E 275 74.380 55.422 18.723 1.00 18.01 C ATOM 1962 CD GLN E 275 74.561 56.468 19.852 1.00 26.88 C ATOM 1963 OE1 GLN E 275 73.612 57.176 20.275 1.00 32.57 O ATOM 1964 NE2 GLN E 275 75.788 56.590 20.316 1.00 30.91 N ATOM 1965 N AHIS E 276 75.429 58.652 15.800 0.50 16.03 N ATOM 1966 N BHIS E 276 75.464 58.626 15.902 0.50 16.21 N ATOM 1967 CA AHIS E 276 75.899 59.217 14.540 0.50 15.21 C ATOM 1968 CA BHIS E 276 76.183 59.327 14.823 0.50 16.17 C ATOM 1969 C AHIS E 276 76.506 58.115 13.668 0.50 16.58 C ATOM 1970 C BHIS E 276 76.690 58.336 13.772 0.50 17.03 C ATOM 1971 O AHIS E 276 76.191 57.997 12.491 0.50 17.37 O ATOM 1972 O BHIS E 276 76.520 58.559 12.568 0.50 17.79 O ATOM 1973 CB AHIS E 276 76.886 60.335 14.792 0.50 15.16 C ATOM 1974 CB BHIS E 276 77.426 60.079 15.379 0.50 15.46 C ATOM 1975 CG AHIS E 276 76.222 61.621 15.133 0.50 12.98 C ATOM 1976 CG BHIS E 276 77.104 61.169 16.356 0.50 15.87 C ATOM 1977 ND1AHIS E 276 76.254 62.161 16.400 0.50 12.32 N ATOM 1978 ND1BHIS E 276 76.142 62.126 16.107 0.50 16.43 N ATOM 1979 CD2AHIS E 276 75.507 62.478 14.370 0.50 14.01 C ATOM 1980 CD2BHIS E 276 77.617 61.458 17.579 0.50 17.51 C ATOM 1981 CE1AHIS E 276 75.592 63.305 16.398 0.50 11.40 C ATOM 1982 CE1BHIS E 276 76.077 62.960 17.130 0.50 18.19 C ATOM 1983 NE2AHIS E 276 75.133 63.516 15.176 0.50 12.18 N ATOM 1984 NE2BHIS E 276 76.948 62.568 18.044 0.50 17.13 N ATOM 1985 N HIS E 277 77.326 57.279 14.268 1.00 16.48 N ATOM 1986 CA HIS E 277 77.985 56.248 13.477 1.00 19.27 C ATOM 1987 C HIS E 277 77.200 54.957 13.519 1.00 17.55 C ATOM 1988 O HIS E 277 76.776 54.512 14.572 1.00 18.30 O ATOM 1989 CB HIS E 277 79.442 56.129 13.924 1.00 22.08 C ATOM 1990 CG HIS E 277 80.201 57.400 13.633 1.00 30.55 C ATOM 1991 ND1 HIS E 277 80.784 58.170 14.622 1.00 37.94 N ATOM 1992 CD2 HIS E 277 80.319 58.115 12.482 1.00 36.60 C ATOM 1993 CE1 HIS E 277 81.291 59.265 14.080 1.00 38.19 C ATOM 1994 NE2 HIS E 277 81.005 59.267 12.788 1.00 38.22 N ATOM 1995 N HIS E 278 76.970 54.402 12.347 1.00 16.35 N ATOM 1996 CA HIS E 278 76.066 53.272 12.227 1.00 15.52 C ATOM 1997 C HIS E 278 76.763 51.987 11.872 1.00 14.98 C ATOM 1998 O HIS E 278 77.591 51.961 10.957 1.00 16.20 O ATOM 1999 CB HIS E 278 75.055 53.587 11.124 1.00 14.33 C ATOM 2000 CG HIS E 278 74.226 54.799 11.436 1.00 15.39 C ATOM 2001 ND1 HIS E 278 73.927 55.771 10.504 1.00 16.47 N ATOM 2002 CD2 HIS E 278 73.633 55.183 12.594 1.00 16.25 C ATOM 2003 CE1 HIS E 278 73.211 56.726 11.083 1.00 18.96 C ATOM 2004 NE2 HIS E 278 72.997 56.383 12.348 1.00 16.98 N ATOM 2005 N HIS E 279 76.437 50.933 12.579 1.00 14.79 N ATOM 2006 CA HIS E 279 76.769 49.577 12.103 1.00 14.25 C ATOM 2007 C HIS E 279 75.779 48.602 12.652 1.00 14.31 C ATOM 2008 O HIS E 279 74.988 48.940 13.533 1.00 13.18 O ATOM 2009 CB HIS E 279 78.172 49.165 12.550 1.00 16.54 C ATOM 2010 CG HIS E 279 78.390 49.302 14.020 1.00 21.56 C ATOM 2011 ND1 HIS E 279 78.784 50.488 14.607 1.00 29.08 N ATOM 2012 CD2 HIS E 279 78.239 48.409 15.027 1.00 28.51 C ATOM 2013 CE1 HIS E 279 78.880 50.310 15.918 1.00 30.76 C ATOM 2014 NE2 HIS E 279 78.576 49.053 16.194 1.00 29.16 N ATOM 2015 N HIS E 280 75.813 47.398 12.103 1.00 12.54 N ATOM 2016 CA HIS E 280 74.907 46.323 12.524 1.00 14.01 C ATOM 2017 C HIS E 280 75.385 45.700 13.839 1.00 14.83 C ATOM 2018 O HIS E 280 76.610 45.579 14.118 1.00 14.53 O ATOM 2019 CB HIS E 280 74.847 45.251 11.439 1.00 13.19 C ATOM 2020 CG HIS E 280 74.262 45.738 10.138 1.00 14.96 C ATOM 2021 ND1 HIS E 280 72.907 45.950 9.989 1.00 12.32 N ATOM 2022 CD2 HIS E 280 74.830 46.039 8.939 1.00 13.38 C ATOM 2023 CE1 HIS E 280 72.658 46.399 8.763 1.00 12.99 C ATOM 2024 NE2 HIS E 280 73.807 46.437 8.095 1.00 12.35 N ATOM 2025 N HIS E 281 74.412 45.302 14.661 1.00 16.50 N ATOM 2026 CA HIS E 281 74.782 44.524 15.847 1.00 19.49 C ATOM 2027 C HIS E 281 74.266 43.137 15.709 1.00 19.55 C ATOM 2028 O HIS E 281 74.400 42.389 16.710 1.00 22.79 O ATOM 2029 CB HIS E 281 74.222 45.163 17.114 1.00 19.89 C ATOM 2030 CG HIS E 281 74.755 46.521 17.374 1.00 22.45 C ATOM 2031 ND1 HIS E 281 75.554 46.795 18.459 1.00 28.12 N ATOM 2032 CD2 HIS E 281 74.583 47.696 16.720 1.00 24.54 C ATOM 2033 CE1 HIS E 281 75.871 48.075 18.450 1.00 30.40 C ATOM 2034 NE2 HIS E 281 75.313 48.639 17.394 1.00 27.90 N ATOM 2035 OXT HIS E 281 73.765 42.722 14.658 1.00 19.12 O TER 2036 HIS E 281 ATOM 2037 N MET I 20 45.456 20.803 7.806 1.00 44.58 N ATOM 2038 CA MET I 20 44.486 21.947 7.867 1.00 43.87 C ATOM 2039 C MET I 20 44.541 22.840 6.599 1.00 41.26 C ATOM 2040 O MET I 20 45.585 23.412 6.256 1.00 42.33 O ATOM 2041 CB MET I 20 44.694 22.767 9.155 1.00 44.92 C ATOM 2042 CG MET I 20 43.486 23.607 9.588 1.00 47.60 C ATOM 2043 SD AMET I 20 43.734 24.460 11.170 0.50 50.19 S ATOM 2044 SD BMET I 20 42.003 22.636 9.991 0.50 50.59 S ATOM 2045 CE AMET I 20 45.221 25.484 10.780 0.50 49.45 C ATOM 2046 CE BMET I 20 41.506 22.085 8.340 0.50 49.47 C ATOM 2047 N LYS I 21 43.417 22.927 5.901 1.00 38.58 N ATOM 2048 CA LYS I 21 43.345 23.713 4.662 1.00 34.52 C ATOM 2049 C LYS I 21 43.248 25.187 5.019 1.00 31.58 C ATOM 2050 O LYS I 21 42.334 25.561 5.758 1.00 30.38 O ATOM 2051 CB LYS I 21 42.127 23.296 3.817 1.00 35.65 C ATOM 2052 CG LYS I 21 42.190 23.858 2.396 1.00 33.00 C ATOM 2053 CD LYS I 21 41.215 23.201 1.472 1.00 32.24 C ATOM 2054 CE LYS I 21 41.480 23.636 0.034 1.00 32.30 C ATOM 2055 NZ LYS I 21 40.568 22.866 -0.848 1.00 39.29 N ATOM 2056 N THR I 22 44.169 26.004 4.494 1.00 27.85 N ATOM 2057 CA THR I 22 44.128 27.470 4.697 1.00 26.17 C ATOM 2058 C THR I 22 44.117 28.335 3.426 1.00 23.90 C ATOM 2059 O THR I 22 44.162 29.584 3.508 1.00 21.72 O ATOM 2060 CB THR I 22 45.310 27.947 5.556 1.00 26.47 C ATOM 2061 OG1 THR I 22 46.538 27.633 4.889 1.00 27.99 O ATOM 2062 CG2 THR I 22 45.371 27.196 6.894 1.00 28.56 C ATOM 2063 N GLU I 23 44.091 27.696 2.250 1.00 21.69 N ATOM 2064 CA GLU I 23 43.985 28.440 0.997 1.00 21.11 C ATOM 2065 C GLU I 23 43.072 27.638 0.075 1.00 18.94 C ATOM 2066 O GLU I 23 43.083 26.388 0.125 1.00 18.24 O ATOM 2067 CB GLU I 23 45.345 28.587 0.292 1.00 24.01 C ATOM 2068 CG GLU I 23 46.461 29.009 1.243 1.00 31.65 C ATOM 2069 CD GLU I 23 47.552 29.842 0.584 1.00 40.00 C ATOM 2070 OE1 GLU I 23 48.066 30.763 1.276 1.00 43.89 O ATOM 2071 OE2 GLU I 23 47.914 29.563 -0.594 1.00 41.43 O ATOM 2072 N TRP I 24 42.369 28.354 -0.802 1.00 16.60 N ATOM 2073 CA TRP I 24 41.379 27.724 -1.685 1.00 16.84 C ATOM 2074 C TRP I 24 41.578 28.188 -3.134 1.00 17.13 C ATOM 2075 O TRP I 24 40.705 28.817 -3.741 1.00 16.45 O ATOM 2076 CB TRP I 24 39.943 28.049 -1.216 1.00 16.09 C ATOM 2077 CG TRP I 24 39.562 27.406 0.103 1.00 16.10 C ATOM 2078 CD1 TRP I 24 38.862 26.244 0.284 1.00 18.45 C ATOM 2079 CD2 TRP I 24 39.847 27.902 1.411 1.00 15.17 C ATOM 2080 NE1 TRP I 24 38.709 25.977 1.633 1.00 17.64 N ATOM 2081 CE2 TRP I 24 39.303 26.979 2.349 1.00 16.98 C ATOM 2082 CE3 TRP I 24 40.479 29.057 1.895 1.00 12.94 C ATOM 2083 CZ2 TRP I 24 39.413 27.141 3.739 1.00 17.60 C ATOM 2084 CZ3 TRP I 24 40.595 29.232 3.302 1.00 16.17 C ATOM 2085 CH2 TRP I 24 40.053 28.280 4.203 1.00 17.31 C ATOM 2086 N PRO I 25 42.689 27.811 -3.754 1.00 17.69 N ATOM 2087 CA PRO I 25 42.918 28.279 -5.141 1.00 18.05 C ATOM 2088 C PRO I 25 41.847 27.756 -6.141 1.00 18.09 C ATOM 2089 O PRO I 25 41.606 28.445 -7.146 1.00 18.86 O ATOM 2090 CB PRO I 25 44.307 27.733 -5.487 1.00 18.87 C ATOM 2091 CG PRO I 25 44.462 26.517 -4.583 1.00 18.99 C ATOM 2092 CD PRO I 25 43.773 26.924 -3.240 1.00 18.75 C ATOM 2093 N GLU I 26 41.197 26.649 -5.811 1.00 18.20 N ATOM 2094 CA GLU I 26 40.201 26.033 -6.676 1.00 19.59 C ATOM 2095 C GLU I 26 38.925 26.901 -6.721 1.00 18.86 C ATOM 2096 O GLU I 26 38.077 26.719 -7.604 1.00 20.30 O ATOM 2097 CB GLU I 26 39.925 24.586 -6.223 1.00 20.52 C ATOM 2098 CG GLU I 26 39.140 24.455 -4.931 1.00 24.22 C ATOM 2099 CD GLU I 26 39.953 24.566 -3.612 1.00 28.34 C ATOM 2100 OE1 GLU I 26 41.173 24.797 -3.611 1.00 25.85 O ATOM 2101 OE2 GLU I 26 39.332 24.372 -2.550 1.00 32.59 O ATOM 2102 N LEU I 27 38.799 27.854 -5.785 1.00 16.43 N ATOM 2103 CA LEU I 27 37.623 28.769 -5.796 1.00 15.20 C ATOM 2104 C LEU I 27 37.749 30.000 -6.716 1.00 15.60 C ATOM 2105 O LEU I 27 36.759 30.704 -6.968 1.00 15.57 O ATOM 2106 CB LEU I 27 37.265 29.192 -4.369 1.00 14.63 C ATOM 2107 CG LEU I 27 36.738 28.055 -3.484 1.00 16.86 C ATOM 2108 CD1 LEU I 27 36.517 28.614 -2.055 1.00 16.29 C ATOM 2109 CD2 LEU I 27 35.425 27.407 -4.016 1.00 18.35 C ATOM 2110 N VAL I 28 38.940 30.283 -7.252 1.00 16.03 N ATOM 2111 CA VAL I 28 39.054 31.432 -8.134 1.00 15.73 C ATOM 2112 C VAL I 28 38.157 31.215 -9.373 1.00 15.16 C ATOM 2113 O VAL I 28 38.157 30.132 -9.947 1.00 16.71 O ATOM 2114 CB VAL I 28 40.503 31.655 -8.574 1.00 16.08 C ATOM 2115 CG1 VAL I 28 40.556 32.733 -9.621 1.00 16.71 C ATOM 2116 CG2 VAL I 28 41.368 32.016 -7.345 1.00 16.58 C ATOM 2117 N GLY I 29 37.382 32.231 -9.747 1.00 15.71 N ATOM 2118 CA GLY I 29 36.479 32.128 -10.881 1.00 16.79 C ATOM 2119 C GLY I 29 35.119 31.541 -10.531 1.00 17.65 C ATOM 2120 O GLY I 29 34.239 31.577 -11.399 1.00 17.60 O ATOM 2121 N LYS I 30 34.943 31.014 -9.314 1.00 17.20 N ATOM 2122 CA LYS I 30 33.582 30.594 -8.859 1.00 15.82 C ATOM 2123 C LYS I 30 32.804 31.769 -8.299 1.00 14.36 C ATOM 2124 O LYS I 30 33.366 32.825 -8.023 1.00 13.22 O ATOM 2125 CB LYS I 30 33.637 29.529 -7.759 1.00 15.46 C ATOM 2126 CG LYS I 30 34.442 28.293 -8.156 1.00 22.59 C ATOM 2127 CD LYS I 30 33.931 27.686 -9.411 1.00 28.63 C ATOM 2128 CE LYS I 30 34.684 26.360 -9.687 1.00 35.06 C ATOM 2129 NZ LYS I 30 34.064 25.285 -8.860 1.00 39.29 N ATOM 2130 N SER I 31 31.506 31.569 -8.102 1.00 12.79 N ATOM 2131 CA SER I 31 30.661 32.610 -7.496 1.00 13.03 C ATOM 2132 C SER I 31 31.068 32.815 -6.044 1.00 13.29 C ATOM 2133 O SER I 31 31.549 31.892 -5.355 1.00 12.36 O ATOM 2134 CB SER I 31 29.185 32.216 -7.509 1.00 12.01 C ATOM 2135 OG SER I 31 28.982 31.020 -6.728 1.00 13.59 O ATOM 2136 N VAL I 32 30.817 34.030 -5.569 1.00 12.56 N ATOM 2137 CA VAL I 32 31.014 34.293 -4.126 1.00 12.78 C ATOM 2138 C VAL I 32 30.172 33.334 -3.238 1.00 12.83 C ATOM 2139 O VAL I 32 30.598 32.914 -2.153 1.00 13.08 O ATOM 2140 CB VAL I 32 30.764 35.790 -3.796 1.00 13.77 C ATOM 2141 CG1 VAL I 32 29.256 36.144 -3.879 1.00 13.40 C ATOM 2142 CG2 VAL I 32 31.336 36.120 -2.373 1.00 11.27 C ATOM 2143 N GLU I 33 28.980 32.967 -3.717 1.00 12.23 N ATOM 2144 CA GLU I 33 28.118 32.042 -2.964 1.00 12.58 C ATOM 2145 C GLU I 33 28.759 30.679 -2.790 1.00 12.90 C ATOM 2146 O GLU I 33 28.759 30.134 -1.675 1.00 12.31 O ATOM 2147 CB GLU I 33 26.740 31.890 -3.635 1.00 11.56 C ATOM 2148 CG GLU I 33 25.912 33.193 -3.605 1.00 13.08 C ATOM 2149 CD GLU I 33 26.177 34.200 -4.731 1.00 14.76 C ATOM 2150 OE1 GLU I 33 27.038 33.970 -5.623 1.00 13.45 O ATOM 2151 OE2 GLU I 33 25.446 35.223 -4.756 1.00 16.78 O ATOM 2152 N GLU I 34 29.259 30.121 -3.876 1.00 12.78 N ATOM 2153 CA GLU I 34 29.872 28.791 -3.775 1.00 13.14 C ATOM 2154 C GLU I 34 31.104 28.878 -2.889 1.00 13.95 C ATOM 2155 O GLU I 34 31.350 27.968 -2.072 1.00 13.41 O ATOM 2156 CB GLU I 34 30.258 28.276 -5.169 1.00 13.41 C ATOM 2157 CG GLU I 34 30.868 26.875 -5.045 1.00 16.89 C ATOM 2158 CD GLU I 34 31.123 26.202 -6.383 1.00 24.13 C ATOM 2159 OE1 GLU I 34 30.536 26.596 -7.431 1.00 22.41 O ATOM 2160 OE2 GLU I 34 31.900 25.215 -6.347 1.00 26.79 O ATOM 2161 N ALA I 35 31.883 29.965 -3.065 1.00 13.08 N ATOM 2162 CA ALA I 35 33.075 30.138 -2.199 1.00 14.18 C ATOM 2163 C ALA I 35 32.722 30.144 -0.703 1.00 13.90 C ATOM 2164 O ALA I 35 33.369 29.459 0.101 1.00 14.40 O ATOM 2165 CB ALA I 35 33.846 31.415 -2.583 1.00 13.82 C ATOM 2166 N LYS I 36 31.687 30.893 -0.320 1.00 13.14 N ATOM 2167 CA LYS I 36 31.305 30.926 1.104 1.00 12.75 C ATOM 2168 C LYS I 36 30.916 29.508 1.549 1.00 13.54 C ATOM 2169 O LYS I 36 31.256 29.071 2.647 1.00 13.92 O ATOM 2170 CB LYS I 36 30.092 31.817 1.355 1.00 13.75 C ATOM 2171 CG LYS I 36 30.470 33.316 1.234 1.00 18.19 C ATOM 2172 CD LYS I 36 29.173 34.175 1.366 1.00 23.07 C ATOM 2173 CE LYS I 36 29.490 35.666 1.458 1.00 31.70 C ATOM 2174 NZ LYS I 36 28.244 36.550 1.606 1.00 32.37 N ATOM 2175 N LYS I 37 30.158 28.812 0.705 1.00 12.79 N ATOM 2176 CA LYS I 37 29.659 27.491 1.132 1.00 12.61 C ATOM 2177 C LYS I 37 30.845 26.572 1.357 1.00 14.05 C ATOM 2178 O LYS I 37 30.906 25.866 2.379 1.00 13.89 O ATOM 2179 CB LYS I 37 28.796 26.865 0.042 1.00 13.81 C ATOM 2180 CG LYS I 37 28.321 25.478 0.477 1.00 14.93 C ATOM 2181 CD LYS I 37 27.297 24.968 -0.544 1.00 18.32 C ATOM 2182 CE LYS I 37 26.968 23.529 -0.143 1.00 26.23 C ATOM 2183 NZ LYS I 37 25.659 23.097 -0.776 1.00 31.07 N ATOM 2184 N VAL I 38 31.779 26.583 0.410 1.00 13.35 N ATOM 2185 CA VAL I 38 32.945 25.685 0.504 1.00 14.27 C ATOM 2186 C VAL I 38 33.834 26.002 1.685 1.00 13.93 C ATOM 2187 O VAL I 38 34.203 25.110 2.468 1.00 14.62 O ATOM 2188 CB VAL I 38 33.714 25.665 -0.826 1.00 14.11 C ATOM 2189 CG1 VAL I 38 35.124 24.956 -0.666 1.00 17.37 C ATOM 2190 CG2 VAL I 38 32.865 24.939 -1.914 1.00 13.48 C ATOM 2191 N ILE I 39 34.117 27.282 1.877 1.00 13.70 N ATOM 2192 CA ILE I 39 34.968 27.664 2.986 1.00 14.36 C ATOM 2193 C ILE I 39 34.336 27.305 4.341 1.00 13.81 C ATOM 2194 O ILE I 39 35.039 26.817 5.257 1.00 15.19 O ATOM 2195 CB ILE I 39 35.282 29.174 2.887 1.00 14.99 C ATOM 2196 CG1 ILE I 39 36.327 29.397 1.763 1.00 17.32 C ATOM 2197 CG2 ILE I 39 35.894 29.644 4.249 1.00 15.18 C ATOM 2198 CD1 ILE I 39 36.207 30.831 1.155 1.00 18.49 C ATOM 2199 N LEU I 40 33.021 27.497 4.469 1.00 13.99 N ATOM 2200 CA LEU I 40 32.342 27.148 5.728 1.00 12.95 C ATOM 2201 C LEU I 40 32.305 25.631 5.984 1.00 13.57 C ATOM 2202 O LEU I 40 32.224 25.214 7.143 1.00 13.84 O ATOM 2203 CB LEU I 40 30.961 27.804 5.834 1.00 12.78 C ATOM 2204 CG LEU I 40 31.052 29.353 5.976 1.00 13.36 C ATOM 2205 CD1 LEU I 40 29.651 29.936 5.830 1.00 17.30 C ATOM 2206 CD2 LEU I 40 31.587 29.730 7.377 1.00 13.66 C ATOM 2207 N GLN I 41 32.392 24.808 4.925 1.00 13.84 N ATOM 2208 CA GLN I 41 32.501 23.358 5.142 1.00 13.35 C ATOM 2209 C GLN I 41 33.859 23.019 5.713 1.00 14.73 C ATOM 2210 O GLN I 41 33.990 22.163 6.604 1.00 14.59 O ATOM 2211 CB GLN I 41 32.344 22.608 3.839 1.00 13.48 C ATOM 2212 CG GLN I 41 30.917 22.717 3.321 1.00 12.59 C ATOM 2213 CD GLN I 41 30.668 21.862 2.076 1.00 19.67 C ATOM 2214 OE1 GLN I 41 29.490 21.531 1.758 1.00 18.01 O ATOM 2215 NE2 GLN I 41 31.737 21.555 1.331 1.00 18.83 N ATOM 2216 N ASP I 42 34.871 23.716 5.228 1.00 13.48 N ATOM 2217 CA ASP I 42 36.237 23.397 5.661 1.00 14.68 C ATOM 2218 C ASP I 42 36.588 24.060 6.971 1.00 15.40 C ATOM 2219 O ASP I 42 37.458 23.558 7.740 1.00 16.75 O ATOM 2220 CB ASP I 42 37.235 23.870 4.605 1.00 14.60 C ATOM 2221 CG ASP I 42 37.194 23.059 3.346 1.00 18.96 C ATOM 2222 OD1 ASP I 42 36.625 21.921 3.382 1.00 21.83 O ATOM 2223 OD2 ASP I 42 37.617 23.516 2.255 1.00 17.07 O ATOM 2224 N LYS I 43 35.972 25.206 7.221 1.00 13.65 N ATOM 2225 CA LYS I 43 36.315 26.049 8.370 1.00 15.64 C ATOM 2226 C LYS I 43 35.046 26.683 8.895 1.00 15.70 C ATOM 2227 O LYS I 43 34.736 27.854 8.602 1.00 15.89 O ATOM 2228 CB LYS I 43 37.356 27.111 7.908 1.00 15.69 C ATOM 2229 CG LYS I 43 37.903 28.030 9.018 1.00 16.65 C ATOM 2230 CD LYS I 43 38.919 29.045 8.361 1.00 17.43 C ATOM 2231 CE LYS I 43 39.320 30.190 9.319 1.00 20.64 C ATOM 2232 NZ LYS I 43 40.247 29.626 10.395 1.00 22.10 N ATOM 2233 N PRO I 44 34.219 25.898 9.582 1.00 15.47 N ATOM 2234 CA PRO I 44 32.893 26.361 9.997 1.00 15.42 C ATOM 2235 C PRO I 44 32.830 27.626 10.822 1.00 16.27 C ATOM 2236 O PRO I 44 31.777 28.285 10.785 1.00 17.32 O ATOM 2237 CB PRO I 44 32.327 25.167 10.830 1.00 15.66 C ATOM 2238 CG PRO I 44 33.088 23.967 10.279 1.00 15.96 C ATOM 2239 CD PRO I 44 34.457 24.477 9.898 1.00 15.62 C ATOM 2240 N ALA I 45 33.895 27.933 11.552 1.00 17.20 N ATOM 2241 CA ALA I 45 33.908 29.119 12.379 1.00 18.77 C ATOM 2242 C ALA I 45 34.462 30.335 11.636 1.00 18.68 C ATOM 2243 O ALA I 45 34.663 31.384 12.249 1.00 19.02 O ATOM 2244 CB ALA I 45 34.717 28.848 13.643 1.00 19.48 C ATOM 2245 N ALA I 46 34.724 30.192 10.333 1.00 17.51 N ATOM 2246 CA ALA I 46 35.339 31.306 9.548 1.00 17.15 C ATOM 2247 C ALA I 46 34.504 32.583 9.591 1.00 17.97 C ATOM 2248 O ALA I 46 33.267 32.545 9.510 1.00 17.68 O ATOM 2249 CB ALA I 46 35.563 30.876 8.115 1.00 15.83 C ATOM 2250 N GLN I 47 35.196 33.719 9.730 1.00 16.51 N ATOM 2251 CA GLN I 47 34.565 35.032 9.661 1.00 17.31 C ATOM 2252 C GLN I 47 34.838 35.510 8.264 1.00 17.05 C ATOM 2253 O GLN I 47 35.976 35.909 7.916 1.00 17.65 O ATOM 2254 CB GLN I 47 35.183 35.971 10.715 1.00 18.20 C ATOM 2255 CG AGLN I 47 35.027 35.433 12.157 0.67 21.08 C ATOM 2256 CG BGLN I 47 34.493 35.943 12.077 0.33 19.49 C ATOM 2257 CD AGLN I 47 33.561 35.208 12.555 0.67 29.28 C ATOM 2258 CD BGLN I 47 35.461 36.040 13.250 0.33 21.86 C ATOM 2259 OE1AGLN I 47 32.777 36.168 12.656 0.67 32.42 O ATOM 2260 OE1BGLN I 47 35.270 35.382 14.274 0.33 22.11 O ATOM 2261 NE2AGLN I 47 33.190 33.949 12.774 0.67 31.39 N ATOM 2262 NE2BGLN I 47 36.500 36.862 13.106 0.33 22.55 N ATOM 2263 N ILE I 48 33.821 35.406 7.412 1.00 16.37 N ATOM 2264 CA ILE I 48 34.047 35.672 6.007 1.00 16.48 C ATOM 2265 C ILE I 48 33.674 37.090 5.699 1.00 17.67 C ATOM 2266 O ILE I 48 32.582 37.521 6.067 1.00 18.44 O ATOM 2267 CB ILE I 48 33.201 34.679 5.124 1.00 17.17 C ATOM 2268 CG1 ILE I 48 33.724 33.263 5.355 1.00 17.45 C ATOM 2269 CG2 ILE I 48 33.254 35.095 3.609 1.00 16.64 C ATOM 2270 CD1 ILE I 48 32.902 32.210 4.584 1.00 19.33 C ATOM 2271 N ILE I 49 34.572 37.815 5.030 1.00 16.37 N ATOM 2272 CA ILE I 49 34.225 39.192 4.634 1.00 16.77 C ATOM 2273 C ILE I 49 34.445 39.341 3.138 1.00 15.51 C ATOM 2274 O ILE I 49 35.507 39.000 2.626 1.00 15.60 O ATOM 2275 CB ILE I 49 35.059 40.230 5.483 1.00 17.56 C ATOM 2276 CG1AILE I 49 34.511 41.642 5.201 0.67 19.34 C ATOM 2277 CG1BILE I 49 34.611 40.252 6.956 0.33 15.66 C ATOM 2278 CG2AILE I 49 36.471 40.154 5.163 0.67 18.51 C ATOM 2279 CG2BILE I 49 35.060 41.621 4.851 0.33 17.49 C ATOM 2280 CD1AILE I 49 34.548 42.579 6.408 0.67 23.89 C ATOM 2281 CD1BILE I 49 35.322 39.305 7.815 0.33 19.17 C ATOM 2282 N VAL I 50 33.442 39.874 2.456 1.00 15.12 N ATOM 2283 CA VAL I 50 33.514 40.053 1.024 1.00 15.35 C ATOM 2284 C VAL I 50 33.917 41.489 0.710 1.00 16.54 C ATOM 2285 O VAL I 50 33.289 42.438 1.188 1.00 15.92 O ATOM 2286 CB VAL I 50 32.172 39.700 0.356 1.00 15.39 C ATOM 2287 CG1 VAL I 50 32.232 39.896 -1.147 1.00 15.27 C ATOM 2288 CG2 VAL I 50 31.751 38.230 0.734 1.00 17.14 C ATOM 2289 N LEU I 51 34.979 41.622 -0.081 1.00 15.97 N ATOM 2290 CA LEU I 51 35.522 42.932 -0.459 1.00 16.21 C ATOM 2291 C LEU I 51 35.736 43.004 -1.963 1.00 16.53 C ATOM 2292 O LEU I 51 35.980 41.988 -2.626 1.00 14.53 O ATOM 2293 CB LEU I 51 36.890 43.097 0.241 1.00 16.73 C ATOM 2294 CG LEU I 51 36.835 43.021 1.782 1.00 18.43 C ATOM 2295 CD1 LEU I 51 38.296 42.965 2.345 1.00 17.63 C ATOM 2296 CD2 LEU I 51 36.012 44.205 2.405 1.00 19.71 C ATOM 2297 N PRO I 52 35.726 44.206 -2.548 1.00 17.22 N ATOM 2298 CA PRO I 52 36.024 44.311 -3.980 1.00 17.88 C ATOM 2299 C PRO I 52 37.493 44.019 -4.262 1.00 18.54 C ATOM 2300 O PRO I 52 38.391 44.521 -3.550 1.00 18.33 O ATOM 2301 CB PRO I 52 35.686 45.782 -4.318 1.00 18.89 C ATOM 2302 CG PRO I 52 35.026 46.322 -3.093 1.00 19.00 C ATOM 2303 CD PRO I 52 35.534 45.512 -1.893 1.00 18.37 C ATOM 2304 N VAL I 53 37.762 43.266 -5.321 1.00 18.17 N ATOM 2305 CA VAL I 53 39.155 43.069 -5.724 1.00 19.06 C ATOM 2306 C VAL I 53 39.678 44.454 -6.173 1.00 18.58 C ATOM 2307 O VAL I 53 38.889 45.333 -6.577 1.00 19.89 O ATOM 2308 CB VAL I 53 39.284 42.024 -6.850 1.00 19.04 C ATOM 2309 CG1 VAL I 53 38.660 42.529 -8.163 1.00 19.49 C ATOM 2310 CG2 VAL I 53 40.744 41.520 -7.048 1.00 21.24 C ATOM 2311 N GLY I 54 40.974 44.668 -5.997 1.00 21.20 N ATOM 2312 CA GLY I 54 41.579 45.920 -6.405 1.00 20.42 C ATOM 2313 C GLY I 54 41.400 47.011 -5.355 1.00 22.40 C ATOM 2314 O GLY I 54 41.549 48.207 -5.661 1.00 24.25 O ATOM 2315 N THR I 55 41.055 46.635 -4.131 1.00 19.16 N ATOM 2316 CA THR I 55 41.073 47.618 -3.025 1.00 18.35 C ATOM 2317 C THR I 55 42.331 47.364 -2.190 1.00 16.89 C ATOM 2318 O THR I 55 43.002 46.352 -2.327 1.00 17.94 O ATOM 2319 CB THR I 55 39.858 47.503 -2.109 1.00 18.83 C ATOM 2320 OG1 THR I 55 39.702 46.143 -1.685 1.00 20.32 O ATOM 2321 CG2 THR I 55 38.559 47.867 -2.848 1.00 18.92 C ATOM 2322 N ILE I 56 42.641 48.326 -1.331 1.00 15.88 N ATOM 2323 CA ILE I 56 43.767 48.219 -0.419 1.00 15.92 C ATOM 2324 C ILE I 56 43.124 47.867 0.922 1.00 15.20 C ATOM 2325 O ILE I 56 42.038 48.389 1.255 1.00 15.99 O ATOM 2326 CB ILE I 56 44.486 49.610 -0.381 1.00 16.36 C ATOM 2327 CG1 ILE I 56 45.267 49.798 -1.706 1.00 19.28 C ATOM 2328 CG2 ILE I 56 45.361 49.743 0.918 1.00 15.74 C ATOM 2329 CD1AILE I 56 46.052 51.087 -1.867 0.50 17.40 C ATOM 2330 CD1BILE I 56 46.571 49.154 -1.818 0.50 15.54 C ATOM 2331 N VAL I 57 43.814 47.044 1.720 1.00 14.01 N ATOM 2332 CA VAL I 57 43.218 46.536 2.948 1.00 14.25 C ATOM 2333 C VAL I 57 44.198 46.527 4.083 1.00 13.68 C ATOM 2334 O VAL I 57 45.412 46.555 3.846 1.00 13.86 O ATOM 2335 CB VAL I 57 42.658 45.066 2.794 1.00 15.57 C ATOM 2336 CG1 VAL I 57 41.491 45.013 1.688 1.00 15.79 C ATOM 2337 CG2 VAL I 57 43.777 44.039 2.451 1.00 14.21 C ATOM 2338 N THR I 58 43.677 46.456 5.305 1.00 13.32 N ATOM 2339 CA THR I 58 44.547 46.344 6.496 1.00 12.95 C ATOM 2340 C THR I 58 45.396 45.113 6.456 1.00 14.24 C ATOM 2341 O THR I 58 44.993 44.029 5.927 1.00 13.77 O ATOM 2342 CB THR I 58 43.696 46.290 7.786 1.00 14.32 C ATOM 2343 OG1 THR I 58 42.787 45.164 7.705 1.00 14.67 O ATOM 2344 CG2 THR I 58 42.835 47.597 7.947 1.00 13.93 C ATOM 2345 N MET I 59 46.592 45.221 7.046 1.00 12.11 N ATOM 2346 CA MET I 59 47.539 44.119 7.036 1.00 13.76 C ATOM 2347 C MET I 59 47.718 43.405 8.399 1.00 13.70 C ATOM 2348 O MET I 59 48.829 42.949 8.765 1.00 13.54 O ATOM 2349 CB MET I 59 48.909 44.580 6.443 1.00 13.28 C ATOM 2350 CG MET I 59 48.794 44.869 4.950 1.00 14.44 C ATOM 2351 SD MET I 59 48.670 43.304 4.059 1.00 17.90 S ATOM 2352 CE MET I 59 47.448 43.838 2.805 1.00 19.55 C ATOM 2353 N GLU I 60 46.633 43.280 9.163 1.00 13.28 N ATOM 2354 CA GLU I 60 46.700 42.426 10.321 1.00 12.74 C ATOM 2355 C GLU I 60 46.382 40.978 9.880 1.00 13.36 C ATOM 2356 O GLU I 60 45.758 40.739 8.807 1.00 13.46 O ATOM 2357 CB GLU I 60 45.811 42.927 11.466 1.00 13.07 C ATOM 2358 CG GLU I 60 44.324 42.497 11.457 1.00 15.12 C ATOM 2359 CD GLU I 60 43.431 43.185 10.430 1.00 12.01 C ATOM 2360 OE1 GLU I 60 43.851 43.380 9.274 1.00 14.88 O ATOM 2361 OE2 GLU I 60 42.266 43.506 10.738 1.00 16.47 O ATOM 2362 N TYR I 61 46.832 40.033 10.697 1.00 13.24 N ATOM 2363 CA TYR I 61 46.645 38.602 10.420 1.00 16.09 C ATOM 2364 C TYR I 61 45.669 38.040 11.455 1.00 16.35 C ATOM 2365 O TYR I 61 45.955 38.030 12.668 1.00 16.68 O ATOM 2366 CB TYR I 61 47.995 37.895 10.465 1.00 16.33 C ATOM 2367 CG TYR I 61 47.900 36.448 9.993 1.00 21.64 C ATOM 2368 CD1 TYR I 61 47.826 36.170 8.628 1.00 23.94 C ATOM 2369 CD2 TYR I 61 47.918 35.401 10.889 1.00 26.22 C ATOM 2370 CE1 TYR I 61 47.746 34.865 8.152 1.00 26.71 C ATOM 2371 CE2 TYR I 61 47.839 34.034 10.407 1.00 28.88 C ATOM 2372 CZ TYR I 61 47.748 33.816 9.040 1.00 29.92 C ATOM 2373 OH TYR I 61 47.675 32.538 8.497 1.00 36.00 O ATOM 2374 N ALA I 62 44.484 37.646 10.987 1.00 15.91 N ATOM 2375 CA ALA I 62 43.426 37.184 11.873 1.00 18.46 C ATOM 2376 C ALA I 62 43.139 35.751 11.409 1.00 19.89 C ATOM 2377 O ALA I 62 42.554 35.555 10.312 1.00 18.53 O ATOM 2378 CB ALA I 62 42.204 38.059 11.703 1.00 18.44 C ATOM 2379 N ILE I 63 43.543 34.771 12.218 1.00 20.56 N ATOM 2380 CA ILE I 63 43.498 33.364 11.826 1.00 22.44 C ATOM 2381 C ILE I 63 42.029 32.893 11.562 1.00 20.32 C ATOM 2382 O ILE I 63 41.801 31.968 10.824 1.00 21.99 O ATOM 2383 CB ILE I 63 44.185 32.521 12.987 1.00 23.38 C ATOM 2384 CG1 ILE I 63 44.496 31.087 12.548 1.00 29.90 C ATOM 2385 CG2 ILE I 63 43.387 32.626 14.249 1.00 26.03 C ATOM 2386 CD1 ILE I 63 45.568 30.432 13.455 1.00 32.51 C ATOM 2387 N ASP I 64 41.067 33.595 12.118 1.00 20.59 N ATOM 2388 CA ASP I 64 39.669 33.213 12.033 1.00 21.13 C ATOM 2389 C ASP I 64 39.022 33.788 10.743 1.00 19.81 C ATOM 2390 O ASP I 64 37.902 33.419 10.379 1.00 19.81 O ATOM 2391 CB ASP I 64 39.001 33.788 13.266 1.00 23.10 C ATOM 2392 CG AASP I 64 39.392 35.295 13.476 0.50 24.83 C ATOM 2393 CG BASP I 64 39.403 33.047 14.553 0.50 24.47 C ATOM 2394 OD1AASP I 64 40.542 35.647 13.961 0.67 24.35 O ATOM 2395 OD1BASP I 64 39.463 31.799 14.524 0.33 24.77 O ATOM 2396 OD2AASP I 64 38.614 36.199 13.112 0.50 28.74 O ATOM 2397 OD2BASP I 64 39.707 33.618 15.629 0.50 27.02 O ATOM 2398 N ARG I 65 39.712 34.709 10.071 1.00 16.93 N ATOM 2399 CA ARG I 65 39.096 35.465 8.970 1.00 15.87 C ATOM 2400 C ARG I 65 39.451 34.839 7.624 1.00 14.97 C ATOM 2401 O ARG I 65 40.572 34.351 7.421 1.00 15.52 O ATOM 2402 CB ARG I 65 39.655 36.911 8.967 1.00 14.43 C ATOM 2403 CG ARG I 65 39.046 37.790 7.832 1.00 14.58 C ATOM 2404 CD ARG I 65 39.434 39.285 8.057 1.00 14.61 C ATOM 2405 NE ARG I 65 40.924 39.399 7.996 1.00 12.40 N ATOM 2406 CZ ARG I 65 41.563 40.519 8.419 1.00 14.81 C ATOM 2407 NH1 ARG I 65 40.819 41.553 8.833 1.00 15.83 N ATOM 2408 NH2 ARG I 65 42.908 40.609 8.365 1.00 14.61 N ATOM 2409 N VAL I 66 38.485 34.887 6.687 1.00 15.70 N ATOM 2410 CA VAL I 66 38.765 34.628 5.295 1.00 14.64 C ATOM 2411 C VAL I 66 38.157 35.750 4.473 1.00 15.47 C ATOM 2412 O VAL I 66 36.931 35.896 4.411 1.00 15.44 O ATOM 2413 CB VAL I 66 38.212 33.232 4.794 1.00 15.00 C ATOM 2414 CG1 VAL I 66 38.560 33.082 3.305 1.00 14.84 C ATOM 2415 CG2 VAL I 66 38.812 32.097 5.664 1.00 14.37 C ATOM 2416 N ARG I 67 39.004 36.593 3.886 1.00 13.88 N ATOM 2417 CA ARG I 67 38.489 37.608 2.979 1.00 12.52 C ATOM 2418 C ARG I 67 38.231 36.966 1.605 1.00 14.16 C ATOM 2419 O ARG I 67 39.051 36.167 1.092 1.00 15.30 O ATOM 2420 CB ARG I 67 39.535 38.712 2.805 1.00 14.16 C ATOM 2421 CG ARG I 67 39.646 39.556 4.082 1.00 14.49 C ATOM 2422 CD ARG I 67 40.779 40.564 3.932 1.00 17.28 C ATOM 2423 NE ARG I 67 40.656 41.633 4.912 1.00 18.03 N ATOM 2424 CZ ARG I 67 41.720 42.388 5.327 1.00 20.21 C ATOM 2425 NH1 ARG I 67 42.930 42.141 4.908 1.00 21.08 N ATOM 2426 NH2 ARG I 67 41.523 43.384 6.162 1.00 21.05 N ATOM 2427 N LEU I 68 37.102 37.353 0.997 1.00 13.63 N ATOM 2428 CA LEU I 68 36.844 36.933 -0.392 1.00 13.51 C ATOM 2429 C LEU I 68 36.821 38.180 -1.246 1.00 13.45 C ATOM 2430 O LEU I 68 35.973 39.050 -1.039 1.00 13.81 O ATOM 2431 CB LEU I 68 35.458 36.263 -0.492 1.00 12.53 C ATOM 2432 CG LEU I 68 35.328 34.953 0.295 1.00 15.64 C ATOM 2433 CD1 LEU I 68 33.899 34.362 0.136 1.00 16.04 C ATOM 2434 CD2 LEU I 68 36.454 33.987 -0.232 1.00 14.67 C ATOM 2435 N PHE I 69 37.756 38.261 -2.175 1.00 12.89 N ATOM 2436 CA PHE I 69 37.863 39.389 -3.081 1.00 14.31 C ATOM 2437 C PHE I 69 37.126 39.059 -4.368 1.00 14.52 C ATOM 2438 O PHE I 69 37.504 38.120 -5.079 1.00 15.45 O ATOM 2439 CB PHE I 69 39.347 39.700 -3.370 1.00 14.03 C ATOM 2440 CG PHE I 69 40.050 40.329 -2.185 1.00 15.00 C ATOM 2441 CD1 PHE I 69 39.903 41.694 -1.913 1.00 16.71 C ATOM 2442 CD2 PHE I 69 40.795 39.554 -1.321 1.00 17.33 C ATOM 2443 CE1 PHE I 69 40.551 42.305 -0.765 1.00 16.13 C ATOM 2444 CE2 PHE I 69 41.415 40.146 -0.147 1.00 16.49 C ATOM 2445 CZ PHE I 69 41.283 41.486 0.113 1.00 14.61 C ATOM 2446 N VAL I 70 36.128 39.892 -4.660 1.00 14.79 N ATOM 2447 CA VAL I 70 35.266 39.647 -5.803 1.00 16.33 C ATOM 2448 C VAL I 70 35.400 40.690 -6.883 1.00 17.16 C ATOM 2449 O VAL I 70 35.637 41.870 -6.604 1.00 16.93 O ATOM 2450 CB VAL I 70 33.806 39.546 -5.399 1.00 15.72 C ATOM 2451 CG1 VAL I 70 33.575 38.258 -4.516 1.00 15.66 C ATOM 2452 CG2 VAL I 70 33.326 40.796 -4.685 1.00 15.89 C ATOM 2453 N ASP I 71 35.228 40.240 -8.116 1.00 17.36 N ATOM 2454 CA ASP I 71 35.170 41.164 -9.246 1.00 17.67 C ATOM 2455 C ASP I 71 33.774 41.791 -9.332 1.00 17.18 C ATOM 2456 O ASP I 71 32.952 41.598 -8.420 1.00 17.10 O ATOM 2457 CB ASP I 71 35.672 40.470 -10.505 1.00 16.81 C ATOM 2458 CG ASP I 71 34.726 39.352 -11.007 1.00 19.95 C ATOM 2459 OD1 ASP I 71 33.532 39.324 -10.612 1.00 17.99 O ATOM 2460 OD2 ASP I 71 35.137 38.502 -11.819 1.00 23.69 O ATOM 2461 N ARG I 72 33.524 42.632 -10.364 1.00 17.80 N ATOM 2462 CA ARG I 72 32.282 43.397 -10.409 1.00 19.96 C ATOM 2463 C ARG I 72 31.087 42.462 -10.718 1.00 19.27 C ATOM 2464 O ARG I 72 29.943 42.892 -10.572 1.00 19.81 O ATOM 2465 CB ARG I 72 32.370 44.537 -11.452 1.00 22.03 C ATOM 2466 CG ARG I 72 32.431 43.971 -12.840 1.00 29.39 C ATOM 2467 CD ARG I 72 32.724 44.952 -14.023 1.00 40.27 C ATOM 2468 NE ARG I 72 32.946 44.131 -15.217 1.00 46.17 N ATOM 2469 CZ ARG I 72 31.969 43.684 -16.023 1.00 48.75 C ATOM 2470 NH1 ARG I 72 30.693 44.026 -15.797 1.00 48.17 N ATOM 2471 NH2 ARG I 72 32.274 42.908 -17.067 1.00 48.32 N ATOM 2472 N LEU I 73 31.375 41.212 -11.093 1.00 18.47 N ATOM 2473 CA LEU I 73 30.299 40.206 -11.398 1.00 17.78 C ATOM 2474 C LEU I 73 29.990 39.368 -10.167 1.00 17.17 C ATOM 2475 O LEU I 73 29.108 38.518 -10.236 1.00 17.02 O ATOM 2476 CB LEU I 73 30.727 39.272 -12.553 1.00 18.47 C ATOM 2477 CG LEU I 73 31.076 39.961 -13.917 1.00 18.82 C ATOM 2478 CD1 LEU I 73 31.423 38.986 -15.019 1.00 21.69 C ATOM 2479 CD2 LEU I 73 29.906 40.938 -14.281 1.00 22.16 C ATOM 2480 N ASP I 74 30.688 39.630 -9.041 1.00 15.67 N ATOM 2481 CA ASP I 74 30.593 38.836 -7.792 1.00 16.16 C ATOM 2482 C ASP I 74 31.180 37.424 -7.928 1.00 15.47 C ATOM 2483 O ASP I 74 30.725 36.505 -7.241 1.00 14.40 O ATOM 2484 CB ASP I 74 29.139 38.748 -7.244 1.00 16.12 C ATOM 2485 CG ASP I 74 28.973 39.381 -5.883 1.00 18.93 C ATOM 2486 OD1 ASP I 74 29.936 40.038 -5.372 1.00 21.84 O ATOM 2487 OD2 ASP I 74 27.885 39.352 -5.250 1.00 17.15 O ATOM 2488 N ASN I 75 32.192 37.259 -8.769 1.00 14.96 N ATOM 2489 CA ASN I 75 32.946 36.006 -8.788 1.00 15.20 C ATOM 2490 C ASN I 75 34.272 36.223 -8.064 1.00 15.00 C ATOM 2491 O ASN I 75 34.757 37.361 -8.007 1.00 13.67 O ATOM 2492 CB ASN I 75 33.204 35.580 -10.216 1.00 15.37 C ATOM 2493 CG ASN I 75 31.901 35.279 -10.949 1.00 15.80 C ATOM 2494 OD1 ASN I 75 30.992 34.725 -10.340 1.00 14.77 O ATOM 2495 ND2 ASN I 75 31.784 35.715 -12.223 1.00 15.94 N ATOM 2496 N ILE I 76 34.830 35.144 -7.533 1.00 13.24 N ATOM 2497 CA ILE I 76 36.117 35.271 -6.803 1.00 13.61 C ATOM 2498 C ILE I 76 37.242 35.607 -7.761 1.00 14.20 C ATOM 2499 O ILE I 76 37.438 34.920 -8.790 1.00 14.64 O ATOM 2500 CB ILE I 76 36.410 33.906 -6.084 1.00 12.85 C ATOM 2501 CG1 ILE I 76 35.260 33.604 -5.094 1.00 9.46 C ATOM 2502 CG2 ILE I 76 37.811 33.928 -5.396 1.00 12.62 C ATOM 2503 CD1 ILE I 76 35.044 34.635 -3.931 1.00 13.67 C ATOM 2504 N ALA I 77 38.029 36.640 -7.405 1.00 14.11 N ATOM 2505 CA ALA I 77 39.049 37.156 -8.340 1.00 17.08 C ATOM 2506 C ALA I 77 40.453 36.993 -7.800 1.00 19.35 C ATOM 2507 O ALA I 77 41.400 37.409 -8.478 1.00 21.40 O ATOM 2508 CB ALA I 77 38.824 38.628 -8.606 1.00 16.96 C ATOM 2509 N GLN I 78 40.586 36.408 -6.610 1.00 18.34 N ATOM 2510 CA GLN I 78 41.914 36.233 -5.934 1.00 19.87 C ATOM 2511 C GLN I 78 41.796 34.939 -5.089 1.00 18.71 C ATOM 2512 O GLN I 78 40.711 34.630 -4.589 1.00 18.18 O ATOM 2513 CB GLN I 78 42.130 37.461 -5.023 1.00 20.97 C ATOM 2514 CG GLN I 78 43.490 37.644 -4.393 1.00 27.57 C ATOM 2515 CD GLN I 78 43.605 39.026 -3.744 1.00 31.16 C ATOM 2516 OE1 GLN I 78 43.341 40.031 -4.409 1.00 30.26 O ATOM 2517 NE2 GLN I 78 43.949 39.076 -2.447 1.00 29.40 N ATOM 2518 N VAL I 79 42.905 34.227 -4.879 1.00 16.83 N ATOM 2519 CA VAL I 79 42.858 32.947 -4.149 1.00 16.78 C ATOM 2520 C VAL I 79 42.458 33.272 -2.719 1.00 16.09 C ATOM 2521 O VAL I 79 43.179 34.071 -2.024 1.00 16.64 O ATOM 2522 CB VAL I 79 44.250 32.283 -4.104 1.00 17.14 C ATOM 2523 CG1 VAL I 79 44.256 31.108 -3.181 1.00 16.20 C ATOM 2524 CG2 VAL I 79 44.678 31.789 -5.494 1.00 18.74 C ATOM 2525 N PRO I 80 41.351 32.722 -2.224 1.00 14.10 N ATOM 2526 CA PRO I 80 41.011 32.968 -0.815 1.00 13.93 C ATOM 2527 C PRO I 80 41.999 32.269 0.113 1.00 14.52 C ATOM 2528 O PRO I 80 42.448 31.156 -0.150 1.00 14.36 O ATOM 2529 CB PRO I 80 39.633 32.287 -0.661 1.00 12.88 C ATOM 2530 CG PRO I 80 39.064 32.283 -2.080 1.00 13.69 C ATOM 2531 CD PRO I 80 40.290 31.933 -2.915 1.00 13.64 C ATOM 2532 N ARG I 81 42.370 32.958 1.180 1.00 15.04 N ATOM 2533 CA ARG I 81 43.208 32.327 2.213 1.00 15.86 C ATOM 2534 C ARG I 81 42.822 32.825 3.581 1.00 16.40 C ATOM 2535 O ARG I 81 42.191 33.874 3.722 1.00 15.60 O ATOM 2536 CB ARG I 81 44.683 32.636 1.944 1.00 17.65 C ATOM 2537 CG ARG I 81 45.042 34.094 2.122 1.00 20.98 C ATOM 2538 CD ARG I 81 46.586 34.323 2.408 1.00 25.62 C ATOM 2539 NE ARG I 81 46.821 35.764 2.328 1.00 30.93 N ATOM 2540 CZ ARG I 81 46.659 36.665 3.320 1.00 34.56 C ATOM 2541 NH1 ARG I 81 46.349 36.310 4.584 1.00 36.22 N ATOM 2542 NH2 ARG I 81 46.865 37.940 3.045 1.00 31.29 N ATOM 2543 N VAL I 82 43.202 32.078 4.611 1.00 15.73 N ATOM 2544 CA VAL I 82 42.971 32.551 5.977 1.00 14.95 C ATOM 2545 C VAL I 82 43.884 33.767 6.263 1.00 16.12 C ATOM 2546 O VAL I 82 45.003 33.850 5.732 1.00 16.01 O ATOM 2547 CB VAL I 82 43.210 31.383 6.992 1.00 16.34 C ATOM 2548 CG1AVAL I 82 43.517 31.889 8.391 0.50 14.66 C ATOM 2549 CG1BVAL I 82 42.441 30.122 6.528 0.50 12.99 C ATOM 2550 CG2AVAL I 82 42.039 30.343 6.961 0.50 13.73 C ATOM 2551 CG2BVAL I 82 44.647 31.071 7.213 0.50 13.73 C ATOM 2552 N GLY I 83 43.409 34.667 7.102 1.00 14.39 N ATOM 2553 CA GLY I 83 44.269 35.755 7.560 1.00 15.48 C ATOM 2554 C GLY I 83 43.557 37.069 7.571 1.00 16.32 C ATOM 2555 O GLY I 83 44.112 38.023 8.160 1.00 16.54 O ATOM 2556 OXT GLY I 83 42.428 37.223 7.026 1.00 15.13 O TER 2557 GLY I 83 HETATM 2558 CA CA E1001 50.462 54.694 28.583 1.00 14.10 CA HETATM 2559 NA NA E1002 59.904 49.228 -0.704 1.00 16.35 NA HETATM 2560 C1 CIT E2001 74.110 68.146 9.133 1.00 18.53 C HETATM 2561 O1 CIT E2001 75.184 67.561 9.011 1.00 16.83 O HETATM 2562 O2 CIT E2001 73.566 68.746 8.177 1.00 21.94 O HETATM 2563 C2 CIT E2001 73.400 68.075 10.458 1.00 14.82 C HETATM 2564 C3 CIT E2001 74.107 67.313 11.605 1.00 20.53 C HETATM 2565 O7 CIT E2001 75.592 67.560 12.039 1.00 15.15 O HETATM 2566 C4 CIT E2001 72.903 67.131 12.614 1.00 15.54 C HETATM 2567 C5 CIT E2001 72.984 65.905 13.537 1.00 18.58 C HETATM 2568 O3 CIT E2001 74.062 65.324 13.713 1.00 18.65 O HETATM 2569 O4 CIT E2001 71.971 65.478 14.122 1.00 14.81 O HETATM 2570 C6 CIT E2001 74.441 66.070 11.083 1.00 24.11 C HETATM 2571 O5 CIT E2001 75.705 65.757 11.176 1.00 14.55 O HETATM 2572 O6 CIT E2001 73.434 65.500 10.602 1.00 16.62 O HETATM 2573 C1 CIT E2002 74.263 62.639 6.940 1.00 42.12 C HETATM 2574 O1 CIT E2002 74.902 61.940 6.102 1.00 40.97 O HETATM 2575 O2 CIT E2002 73.715 63.734 6.552 1.00 37.68 O HETATM 2576 C2 CIT E2002 74.137 62.124 8.391 1.00 38.46 C HETATM 2577 C3 CIT E2002 75.286 62.474 9.358 1.00 35.24 C HETATM 2578 O7 CIT E2002 75.237 61.737 10.640 1.00 32.07 O HETATM 2579 C4 CIT E2002 76.648 62.687 8.655 1.00 34.68 C HETATM 2580 C5 CIT E2002 77.669 63.412 9.537 1.00 37.15 C HETATM 2581 O3 CIT E2002 77.866 63.106 10.739 1.00 34.11 O HETATM 2582 O4 CIT E2002 78.346 64.362 9.072 1.00 39.96 O HETATM 2583 C6 CIT E2002 75.015 63.750 9.971 1.00 34.69 C HETATM 2584 O5 CIT E2002 74.833 63.651 11.226 1.00 23.85 O HETATM 2585 O6 CIT E2002 75.045 64.789 9.239 1.00 25.32 O HETATM 2586 C1 CIT E2003 32.797 50.296 29.281 1.00 38.75 C HETATM 2587 O1 CIT E2003 32.813 50.678 30.475 1.00 33.82 O HETATM 2588 O2 CIT E2003 33.280 49.175 28.938 1.00 38.62 O HETATM 2589 C2 CIT E2003 32.189 51.197 28.247 1.00 37.93 C HETATM 2590 C3 CIT E2003 33.324 51.984 27.590 1.00 41.48 C HETATM 2591 O7 CIT E2003 34.168 51.056 26.821 1.00 37.98 O HETATM 2592 C4 CIT E2003 32.611 52.922 26.608 1.00 40.09 C HETATM 2593 C5 CIT E2003 33.540 53.966 26.052 1.00 43.80 C HETATM 2594 O3 CIT E2003 34.794 53.844 26.204 1.00 42.76 O HETATM 2595 O4 CIT E2003 33.044 54.950 25.426 1.00 45.43 O HETATM 2596 C6 CIT E2003 34.210 52.770 28.601 1.00 42.29 C HETATM 2597 O5 CIT E2003 35.293 52.267 29.092 1.00 39.82 O HETATM 2598 O6 CIT E2003 33.892 53.964 28.916 1.00 42.13 O HETATM 2599 OXT 15P E5001 56.922 65.649 27.707 1.00 50.25 O HETATM 2600 C1 15P E5001 58.002 65.531 26.775 1.00 47.28 C HETATM 2601 C2 15P E5001 59.305 65.290 27.535 1.00 45.18 C HETATM 2602 O1 15P E5001 59.138 64.301 28.571 1.00 41.10 O HETATM 2603 C3 15P E5001 60.242 64.218 29.504 1.00 33.48 C HETATM 2604 C4 15P E5001 61.267 63.221 28.972 1.00 26.92 C HETATM 2605 O2 15P E5001 60.637 61.928 28.742 1.00 20.93 O HETATM 2606 C5 15P E5001 61.653 60.975 28.365 1.00 16.76 C HETATM 2607 C6 15P E5001 61.071 59.557 28.485 1.00 18.29 C HETATM 2608 O3 15P E5001 60.820 59.296 29.867 1.00 19.41 O HETATM 2609 C7 15P E5001 60.750 57.878 30.011 1.00 16.03 C HETATM 2610 O1 15P E5002 61.754 69.206 3.912 1.00 47.30 O HETATM 2611 C3 15P E5002 62.270 68.517 5.061 1.00 44.22 C HETATM 2612 C4 15P E5002 61.141 68.151 6.041 1.00 41.01 C HETATM 2613 O2 15P E5002 60.146 67.403 5.344 1.00 34.48 O HETATM 2614 C5 15P E5002 58.955 67.245 6.084 1.00 35.30 C HETATM 2615 C6 15P E5002 57.921 66.671 5.148 1.00 33.36 C HETATM 2616 O3 15P E5002 57.222 67.753 4.561 1.00 31.59 O HETATM 2617 C7 15P E5002 56.460 67.349 3.442 1.00 35.62 C HETATM 2618 C8 15P E5002 55.969 68.614 2.773 1.00 36.36 C HETATM 2619 O4 15P E5002 57.028 69.154 2.007 1.00 36.87 O HETATM 2620 C9 15P E5002 56.579 70.215 1.166 1.00 43.01 C HETATM 2621 C10 15P E5002 57.616 70.482 0.094 1.00 46.24 C HETATM 2622 O5 15P E5002 58.895 70.466 0.725 1.00 50.92 O HETATM 2623 C11 15P E5002 59.960 70.160 -0.186 1.00 51.60 C HETATM 2624 C12 15P E5002 61.262 70.570 0.494 1.00 54.05 C HETATM 2625 O6 15P E5002 61.527 69.686 1.590 1.00 54.73 O HETATM 2626 OXT 15P E5003 36.989 66.066 19.086 1.00 57.09 O HETATM 2627 C1 15P E5003 37.661 65.014 19.754 1.00 56.46 C HETATM 2628 C2 15P E5003 39.141 65.116 19.406 1.00 54.46 C HETATM 2629 O1 15P E5003 39.302 65.142 17.981 1.00 52.33 O HETATM 2630 C3 15P E5003 40.674 65.233 17.604 1.00 48.49 C HETATM 2631 C4 15P E5003 41.074 66.674 17.798 1.00 48.42 C HETATM 2632 O2 15P E5003 42.287 66.968 17.149 1.00 50.04 O HETATM 2633 C5 15P E5003 42.502 68.384 17.221 1.00 51.89 C HETATM 2634 C6 15P E5003 42.476 69.046 15.833 1.00 54.39 C HETATM 2635 O3 15P E5003 41.642 68.349 14.886 1.00 53.84 O HETATM 2636 C7 15P E5003 41.547 69.010 13.617 1.00 53.16 C HETATM 2637 C8 15P E5003 40.162 68.816 13.000 1.00 53.85 C HETATM 2638 O4 15P E5003 40.296 68.012 11.825 1.00 55.45 O HETATM 2639 C9 15P E5003 39.055 67.480 11.334 1.00 56.06 C HETATM 2640 O2 15P E5004 73.593 48.343 24.865 1.00 55.91 O HETATM 2641 C5 15P E5004 72.887 48.564 26.091 1.00 55.32 C HETATM 2642 C6 15P E5004 72.936 50.061 26.392 1.00 52.93 C HETATM 2643 O3 15P E5004 71.691 50.490 26.943 1.00 51.75 O HETATM 2644 C7 15P E5004 71.846 51.605 27.823 1.00 49.99 C HETATM 2645 C8 15P E5004 70.959 52.772 27.392 1.00 45.96 C HETATM 2646 O4 15P E5004 71.834 53.716 26.765 1.00 47.87 O HETATM 2647 C9 15P E5004 71.166 54.849 26.188 1.00 45.83 C HETATM 2648 C10 15P E5004 71.457 54.816 24.690 1.00 42.82 C HETATM 2649 O5 15P E5004 72.844 55.021 24.485 1.00 46.88 O HETATM 2650 C11 15P E5004 73.281 54.881 23.123 1.00 47.37 C HETATM 2651 C12 15P E5004 74.715 54.351 23.115 1.00 47.06 C HETATM 2652 O HOH E5005 52.918 42.822 23.107 1.00 10.63 O HETATM 2653 O HOH E5006 50.157 47.738 15.895 1.00 11.04 O HETATM 2654 O HOH E5007 52.461 48.225 20.765 1.00 9.68 O HETATM 2655 O HOH E5008 54.869 44.089 21.637 1.00 11.03 O HETATM 2656 O HOH E5009 49.814 63.632 19.357 1.00 16.58 O HETATM 2657 O HOH E5010 61.379 63.950 22.173 1.00 11.65 O HETATM 2658 O HOH E5011 48.578 52.604 8.953 1.00 10.72 O HETATM 2659 O HOH E5012 66.774 45.826 18.297 1.00 11.97 O HETATM 2660 O HOH E5013 67.905 49.805 12.960 1.00 13.00 O HETATM 2661 O HOH E5014 60.935 63.112 7.520 1.00 16.22 O HETATM 2662 O HOH E5015 52.492 50.498 22.323 1.00 10.78 O HETATM 2663 O HOH E5016 49.434 59.717 21.443 1.00 12.64 O HETATM 2664 O HOH E5017 53.449 60.788 26.098 1.00 12.70 O HETATM 2665 O HOH E5018 66.675 49.668 25.159 1.00 16.43 O HETATM 2666 O HOH E5019 58.841 45.158 27.642 1.00 15.06 O HETATM 2667 O HOH E5020 71.522 46.166 15.743 1.00 13.40 O HETATM 2668 O HOH E5021 54.924 46.718 20.812 1.00 9.97 O HETATM 2669 O HOH E5022 51.594 61.488 21.552 1.00 13.95 O HETATM 2670 O HOH E5023 68.729 43.850 18.371 1.00 17.09 O HETATM 2671 O HOH E5024 61.051 53.458 28.151 1.00 12.94 O HETATM 2672 O HOH E5025 54.675 66.262 19.393 1.00 16.11 O HETATM 2673 O HOH E5026 42.894 52.821 29.890 1.00 15.93 O HETATM 2674 O HOH E5027 44.020 56.290 10.679 1.00 11.94 O HETATM 2675 O HOH E5028 56.322 46.687 31.372 1.00 15.27 O HETATM 2676 O HOH E5029 70.978 51.704 3.625 1.00 14.99 O HETATM 2677 O HOH E5030 60.416 55.863 2.824 1.00 15.32 O HETATM 2678 O HOH E5031 67.748 63.784 1.180 1.00 14.43 O HETATM 2679 O HOH E5032 69.908 67.237 14.125 1.00 16.60 O HETATM 2680 O HOH E5033 52.202 47.508 1.643 1.00 14.53 O HETATM 2681 O HOH E5034 54.025 42.497 25.663 1.00 18.50 O HETATM 2682 O HOH E5035 62.288 57.449 4.146 1.00 15.04 O HETATM 2683 O HOH E5036 61.333 48.120 0.912 1.00 15.19 O HETATM 2684 O HOH E5037 42.931 50.930 31.677 1.00 20.43 O HETATM 2685 O HOH E5038 64.734 60.266 0.439 1.00 19.55 O HETATM 2686 O HOH E5039 62.863 56.440 0.440 1.00 20.08 O HETATM 2687 O HOH E5040 71.146 56.448 20.356 1.00 16.08 O HETATM 2688 O HOH E5041 36.578 44.063 26.755 1.00 16.94 O HETATM 2689 O HOH E5042 74.676 55.483 7.883 1.00 19.55 O HETATM 2690 O HOH E5043 40.324 43.857 24.144 1.00 18.67 O HETATM 2691 O HOH E5044 70.605 41.868 4.573 1.00 21.31 O HETATM 2692 O HOH E5045 36.776 52.938 10.523 1.00 20.23 O HETATM 2693 O HOH E5046 66.304 54.049 32.416 1.00 18.70 O HETATM 2694 O HOH E5047 56.254 61.060 26.020 1.00 19.25 O HETATM 2695 O HOH E5048 56.170 48.846 33.101 1.00 16.66 O HETATM 2696 O HOH E5049 75.183 52.364 15.321 1.00 19.35 O HETATM 2697 O HOH E5050 68.676 39.566 8.006 1.00 17.73 O HETATM 2698 O HOH E5051 51.511 44.858 1.233 1.00 19.62 O HETATM 2699 O HOH E5052 49.617 67.226 -1.592 1.00 22.50 O HETATM 2700 O HOH E5053 68.370 55.986 2.259 1.00 19.99 O HETATM 2701 O HOH E5054 71.728 53.872 2.377 1.00 20.31 O HETATM 2702 O HOH E5055 63.282 65.037 5.186 1.00 13.52 O HETATM 2703 O HOH E5056 70.537 62.956 3.459 1.00 22.84 O HETATM 2704 O HOH E5057 59.393 53.939 -5.708 1.00 17.78 O HETATM 2705 O HOH E5058 55.482 61.603 -7.944 1.00 23.58 O HETATM 2706 O HOH E5059 73.414 39.536 13.395 1.00 21.85 O HETATM 2707 O HOH E5060 72.366 48.906 20.389 1.00 21.52 O HETATM 2708 O HOH E5061 38.380 55.085 23.770 1.00 21.08 O HETATM 2709 O HOH E5062 36.327 55.041 17.554 1.00 17.51 O HETATM 2710 O HOH E5063 63.960 58.203 1.998 1.00 19.17 O HETATM 2711 O HOH E5064 72.229 64.920 4.194 1.00 25.37 O HETATM 2712 O HOH E5065 68.075 53.406 1.538 1.00 19.36 O HETATM 2713 O HOH E5066 37.571 57.361 27.010 1.00 23.98 O HETATM 2714 O HOH E5067 53.078 47.307 34.573 1.00 24.32 O HETATM 2715 O HOH E5068 63.709 62.263 -1.176 1.00 26.80 O HETATM 2716 O HOH E5069 60.798 59.664 -4.540 1.00 22.17 O HETATM 2717 O HOH E5070 78.341 53.839 16.992 1.00 47.94 O HETATM 2718 O HOH E5071 48.243 58.349 33.873 1.00 27.31 O HETATM 2719 O HOH E5072 67.751 41.335 19.076 1.00 21.59 O HETATM 2720 O HOH E5073 59.188 37.784 6.034 1.00 16.93 O HETATM 2721 O HOH E5074 46.686 52.895 36.584 1.00 28.25 O HETATM 2722 O HOH E5075 50.756 62.064 -6.407 1.00 26.80 O HETATM 2723 O HOH E5076 61.103 63.558 25.348 1.00 20.09 O HETATM 2724 O HOH E5077 65.484 41.735 1.037 1.00 25.90 O HETATM 2725 O HOH E5078 74.013 42.057 12.354 1.00 20.27 O HETATM 2726 O HOH E5079 58.421 33.170 -1.803 1.00 23.38 O HETATM 2727 O HOH E5080 45.893 50.535 32.479 1.00 26.62 O HETATM 2728 O HOH E5081 55.062 43.873 28.896 1.00 30.27 O HETATM 2729 O HOH E5082 70.440 63.916 7.116 1.00 19.02 O HETATM 2730 O HOH E5083 66.234 43.179 21.280 1.00 27.30 O HETATM 2731 O HOH E5084 61.428 42.446 24.571 1.00 26.39 O HETATM 2732 O HOH E5085 72.153 65.630 8.147 1.00 29.09 O HETATM 2733 O HOH E5086 47.860 60.719 29.908 1.00 25.73 O HETATM 2734 O HOH E5087 56.107 36.989 20.194 1.00 24.55 O HETATM 2735 O HOH E5088 69.425 48.959 24.739 1.00 25.03 O HETATM 2736 O HOH E5089 66.351 57.003 1.062 1.00 24.27 O HETATM 2737 O HOH E5090 51.719 45.104 27.331 0.50 14.78 O HETATM 2738 O HOH E5091 57.337 68.665 9.105 1.00 22.57 O HETATM 2739 O HOH E5092 63.761 56.425 31.005 1.00 19.51 O HETATM 2740 O HOH E5093 64.126 48.148 0.496 1.00 20.55 O HETATM 2741 O HOH E5094 47.316 54.951 -12.126 1.00 21.39 O HETATM 2742 O HOH E5095 67.272 50.542 27.636 1.00 24.40 O HETATM 2743 O HOH E5096 65.125 47.542 25.456 1.00 20.40 O HETATM 2744 O HOH E5097 40.392 54.369 -6.860 1.00 24.59 O HETATM 2745 O HOH E5098 35.717 44.268 24.117 1.00 27.63 O HETATM 2746 O HOH E5099 56.336 57.663 -9.725 1.00 25.52 O HETATM 2747 O HOH E5100 62.881 65.944 21.314 1.00 23.42 O HETATM 2748 O HOH E5101 44.783 68.419 11.230 1.00 22.56 O HETATM 2749 O HOH E5102 71.934 58.046 3.370 1.00 29.45 O HETATM 2750 O HOH E5103 45.167 54.192 -8.696 1.00 24.63 O HETATM 2751 O HOH E5104 48.542 36.708 20.674 1.00 35.82 O HETATM 2752 O HOH E5105 49.209 60.271 -7.732 1.00 21.15 O HETATM 2753 O HOH E5106 51.643 64.126 23.320 1.00 34.58 O HETATM 2754 O HOH E5107 45.035 45.600 -4.961 1.00 38.09 O HETATM 2755 O HOH E5108 59.251 68.860 3.151 1.00 17.57 O HETATM 2756 O HOH E5109 71.828 60.345 4.402 1.00 36.10 O HETATM 2757 O HOH E5110 43.040 62.552 21.464 1.00 32.30 O HETATM 2758 O HOH E5111 66.358 49.817 1.027 1.00 29.53 O HETATM 2759 O HOH E5112 64.482 64.041 0.816 1.00 28.60 O HETATM 2760 O HOH E5113 33.182 49.686 5.344 1.00 21.21 O HETATM 2761 O HOH E5114 38.668 60.314 -1.032 1.00 24.40 O HETATM 2762 O HOH E5115 57.706 55.308 31.209 1.00 16.39 O HETATM 2763 O HOH E5116 54.080 56.565 -11.202 1.00 22.87 O HETATM 2764 O HOH E5117 74.054 54.503 3.852 1.00 16.96 O HETATM 2765 O HOH E5118 65.142 45.765 0.449 1.00 30.56 O HETATM 2766 O HOH E5119 78.360 68.287 12.476 1.00 27.04 O HETATM 2767 O HOH E5120 35.238 55.304 21.586 1.00 31.13 O HETATM 2768 O HOH E5121 40.606 50.950 -5.824 1.00 25.44 O HETATM 2769 O HOH E5122 33.091 47.233 30.446 1.00 24.48 O HETATM 2770 O HOH E5123 58.698 45.613 30.591 1.00 21.38 O HETATM 2771 O HOH E5124 38.176 44.616 22.713 1.00 33.53 O HETATM 2772 O HOH E5125 38.040 65.140 7.047 1.00 25.33 O HETATM 2773 O HOH E5126 74.116 51.087 19.967 1.00 28.85 O HETATM 2774 O HOH E5127 75.713 51.068 17.550 1.00 29.69 O HETATM 2775 O HOH E5128 49.611 33.928 4.510 1.00 21.01 O HETATM 2776 O HOH E5129 35.255 61.851 4.117 1.00 29.62 O HETATM 2777 O HOH E5130 43.836 65.058 -0.226 1.00 32.14 O HETATM 2778 O HOH E5131 67.834 52.620 28.972 1.00 21.01 O HETATM 2779 O HOH E5132 32.424 52.177 5.447 1.00 29.48 O HETATM 2780 O HOH E5133 49.692 66.291 20.091 1.00 30.79 O HETATM 2781 O HOH E5134 38.593 43.072 6.358 1.00 29.22 O HETATM 2782 O HOH E5135 45.108 60.957 28.370 1.00 32.85 O HETATM 2783 O HOH E5136 35.998 57.716 18.792 1.00 26.40 O HETATM 2784 O HOH E5137 37.325 47.865 20.843 1.00 35.10 O HETATM 2785 O HOH E5138 60.956 48.026 -2.524 1.00 18.11 O HETATM 2786 O HOH E5139 44.974 69.930 3.667 1.00 28.75 O HETATM 2787 O HOH E5140 33.259 58.271 10.450 1.00 30.94 O HETATM 2788 O HOH E5141 52.564 50.295 -9.921 1.00 26.52 O HETATM 2789 O HOH E5142 66.774 32.425 6.542 1.00 39.13 O HETATM 2790 O HOH E5143 69.731 68.780 6.946 1.00 29.46 O HETATM 2791 O HOH E5144 35.453 64.918 6.896 1.00 29.12 O HETATM 2792 O HOH E5145 35.510 50.667 2.936 1.00 24.99 O HETATM 2793 O HOH E5146 76.606 58.936 18.381 1.00 37.72 O HETATM 2794 O HOH E5147 61.651 67.126 16.670 1.00 40.83 O HETATM 2795 O HOH E5148 40.726 44.987 12.643 1.00 28.35 O HETATM 2796 O HOH E5149 35.385 46.464 30.679 1.00 32.94 O HETATM 2797 O HOH E5150 50.032 42.568 0.685 1.00 23.20 O HETATM 2798 O HOH E5151 61.656 48.154 28.587 1.00 20.47 O HETATM 2799 O HOH E5152 46.188 37.692 19.081 1.00 34.04 O HETATM 2800 O HOH E5153 49.466 41.734 -1.688 1.00 34.34 O HETATM 2801 O HOH E5154 32.720 55.065 1.725 1.00 28.38 O HETATM 2802 O HOH E5155 56.085 60.310 -10.218 1.00 30.89 O HETATM 2803 O HOH E5156 36.428 62.446 23.557 1.00 32.41 O HETATM 2804 O HOH E5157 30.906 48.304 6.817 1.00 41.08 O HETATM 2805 O HOH E5158 48.865 40.487 2.418 1.00 23.61 O HETATM 2806 O HOH E5159 52.050 39.278 24.115 1.00 30.76 O HETATM 2807 O HOH E5160 54.667 54.414 -12.567 1.00 31.88 O HETATM 2808 O HOH E5161 67.197 43.782 2.260 1.00 34.46 O HETATM 2809 O HOH E5162 70.035 42.965 2.277 1.00 35.75 O HETATM 2810 O HOH E5163 38.923 43.934 18.356 1.00 34.30 O HETATM 2811 O HOH E5164 62.504 67.637 -0.069 1.00 34.71 O HETATM 2812 O HOH E5165 61.257 65.549 9.188 1.00 22.52 O HETATM 2813 O HOH E5166 51.155 69.488 -1.432 1.00 35.36 O HETATM 2814 O HOH E5167 61.592 40.367 23.227 1.00 29.62 O HETATM 2815 O HOH E5168 58.044 40.586 -8.456 1.00 41.11 O HETATM 2816 O HOH E5169 51.888 61.762 28.296 1.00 33.19 O HETATM 2817 O HOH E5170 56.353 28.468 -0.472 1.00 35.31 O HETATM 2818 O HOH E5171 59.766 58.559 -9.035 1.00 31.87 O HETATM 2819 O HOH E5172 63.592 65.749 7.800 1.00 29.24 O HETATM 2820 O HOH E5173 54.229 60.998 -12.082 1.00 29.76 O HETATM 2821 O HOH E5174 50.934 68.098 18.604 1.00 40.67 O HETATM 2822 O HOH E5175 60.933 46.963 30.827 1.00 28.76 O HETATM 2823 O HOH E5176 57.624 68.353 12.661 1.00 30.11 O HETATM 2824 O HOH E5177 51.412 31.978 5.400 1.00 28.87 O HETATM 2825 O HOH E5178 60.507 40.999 -7.117 1.00 34.30 O HETATM 2826 O HOH E5179 49.573 39.255 24.905 1.00 42.08 O HETATM 2827 O HOH E5180 59.661 42.530 27.200 1.00 40.29 O HETATM 2828 O HOH E5181 33.647 52.706 2.893 1.00 25.83 O HETATM 2829 O HOH E5182 63.817 43.104 24.801 1.00 40.57 O HETATM 2830 O HOH E5183 51.518 40.527 -2.458 1.00 38.35 O HETATM 2831 O HOH E5184 33.849 47.534 0.740 1.00 33.57 O HETATM 2832 O HOH E5185 54.775 40.010 26.343 1.00 44.30 O HETATM 2833 O HOH E5186 71.031 37.428 2.856 1.00 30.36 O HETATM 2834 O HOH E5187 36.738 50.104 28.673 1.00 22.65 O HETATM 2835 O HOH E5188 56.534 30.370 6.142 1.00 32.52 O HETATM 2836 O HOH E5189 51.647 66.129 22.148 1.00 42.72 O HETATM 2837 O HOH E5190 55.855 32.943 17.534 1.00 34.39 O HETATM 2838 O HOH E5191 35.331 63.210 17.138 1.00 36.99 O HETATM 2839 O HOH E5192 80.487 52.721 12.975 1.00 47.19 O HETATM 2840 O HOH E5193 46.521 60.791 -8.114 1.00 36.72 O HETATM 2841 O HOH E5194 62.109 66.856 11.794 1.00 31.43 O HETATM 2842 O HOH E5195 47.483 40.120 -1.456 1.00 37.98 O HETATM 2843 O HOH E5196 50.376 69.997 10.316 1.00 37.11 O HETATM 2844 O HOH E5197 53.057 58.282 -12.852 1.00 37.59 O HETATM 2845 O HOH E5198 49.767 60.757 -10.469 1.00 29.81 O HETATM 2846 O HOH E5199 74.239 57.125 4.206 1.00 25.99 O HETATM 2847 O HOH E5200 55.204 34.227 19.981 1.00 43.08 O HETATM 2848 O HOH E5201 57.478 38.063 25.227 1.00 37.92 O HETATM 2849 O HOH E5202 47.497 69.787 9.811 1.00 37.33 O HETATM 2850 O HOH E5203 58.837 47.452 -7.096 1.00 34.93 O HETATM 2851 O HOH E5204 50.328 58.578 -12.074 1.00 31.43 O HETATM 2852 O HOH E5205 63.293 65.734 26.544 1.00 43.77 O HETATM 2853 O HOH E5206 48.485 52.266 -13.326 1.00 33.92 O HETATM 2854 O HOH E5207 72.556 42.369 18.797 1.00 33.95 O HETATM 2855 O HOH E5208 63.481 31.477 9.457 1.00 33.57 O HETATM 2856 O HOH E5209 53.884 51.994 -11.793 1.00 36.70 O HETATM 2857 O HOH E5210 61.072 67.600 13.986 1.00 39.52 O HETATM 2858 O HOH E5211 35.206 50.226 16.739 1.00 39.03 O HETATM 2859 O HOH E5212 51.808 33.174 -1.003 1.00 38.24 O HETATM 2860 O HOH E5213 66.528 33.931 13.395 1.00 40.98 O HETATM 2861 O HOH E5214 34.349 57.063 24.265 1.00 32.67 O HETATM 2862 O HOH E5215 48.370 70.070 14.229 1.00 38.06 O HETATM 2863 O HOH E5216 64.132 47.561 28.006 1.00 30.54 O HETATM 2864 O HOH E5217 44.797 61.990 25.884 1.00 46.50 O HETATM 2865 O HOH E5218 35.960 49.307 -0.340 1.00 40.09 O HETATM 2866 O HOH E5219 54.348 69.046 15.875 0.50 23.40 O HETATM 2867 O HOH E5220 55.292 40.898 -4.835 1.00 36.13 O HETATM 2868 O HOH E5221 47.876 48.648 36.674 1.00 37.37 O HETATM 2869 O HOH E5222 54.825 32.004 12.889 1.00 30.28 O HETATM 2870 O HOH E5223 53.671 42.941 -8.996 1.00 39.21 O HETATM 2871 O HOH E5224 70.776 39.457 5.851 1.00 36.45 O HETATM 2872 O HOH E5225 67.057 40.036 -0.842 1.00 40.55 O HETATM 2873 O HOH E5226 46.048 59.100 32.775 1.00 47.49 O HETATM 2874 O HOH E5227 59.753 31.306 17.537 1.00 32.61 O HETATM 2875 O HOH E5228 58.469 49.677 -8.614 1.00 40.22 O HETATM 2876 O HOH E5229 74.322 61.651 3.713 1.00 39.23 O HETATM 2877 O HOH E5230 52.394 34.532 20.782 1.00 36.85 O HETATM 2878 O HOH E5231 63.873 66.317 23.996 1.00 39.02 O HETATM 2879 O HOH E5232 60.669 31.301 8.329 1.00 35.03 O HETATM 2880 O HOH E5233 61.339 53.909 -8.106 1.00 33.41 O HETATM 2881 O HOH E5234 64.581 66.824 3.571 1.00 32.11 O HETATM 2882 O HOH E5235 71.599 40.477 0.965 1.00 46.67 O HETATM 2883 O HOH E5236 45.686 58.366 35.522 1.00 37.46 O HETATM 2884 O HOH E5237 71.260 44.325 19.583 1.00 36.94 O HETATM 2885 O HOH E5238 64.041 67.566 18.925 1.00 42.30 O HETATM 2886 O HOH E5239 47.314 67.988 20.180 1.00 49.07 O HETATM 2887 O HOH E5240 38.697 41.098 16.653 1.00 48.18 O HETATM 2888 O HOH E5241 45.633 69.700 13.915 1.00 32.76 O HETATM 2889 O HOH E5242 52.869 63.198 -8.360 1.00 35.29 O HETATM 2890 O HOH E5243 47.198 63.947 26.449 1.00 40.99 O HETATM 2891 O HOH E5244 41.610 68.141 8.367 1.00 40.95 O HETATM 2892 O HOH E5245 58.125 70.383 7.046 1.00 36.85 O HETATM 2893 O HOH E5246 50.368 46.791 34.507 1.00 44.21 O HETATM 2894 O HOH E5247 51.178 69.389 -4.554 1.00 41.42 O HETATM 2895 O HOH E5248 72.992 37.234 9.033 1.00 47.22 O HETATM 2896 O HOH E5249 44.729 70.794 7.406 1.00 38.23 O HETATM 2897 O HOH E5250 52.024 31.482 1.526 1.00 41.54 O HETATM 2898 O HOH E5251 62.830 44.989 31.002 1.00 30.20 O HETATM 2899 O HOH E5252 60.367 30.234 -0.100 1.00 37.62 O HETATM 2900 O HOH E5253 34.404 53.022 18.031 1.00 39.99 O HETATM 2901 O HOH E5254 63.375 47.659 -3.353 1.00 36.98 O HETATM 2902 O HOH E5255 46.291 69.382 17.972 1.00 35.98 O HETATM 2903 O HOH E5256 55.468 68.593 -2.575 1.00 35.86 O HETATM 2904 O HOH E5257 45.435 67.598 0.450 1.00 42.94 O HETATM 2905 O HOH E5258 30.137 59.868 8.005 1.00 34.61 O HETATM 2906 O HOH E5259 52.969 47.043 37.365 1.00 38.55 O HETATM 2907 O HOH E5260 52.040 62.288 -11.129 1.00 37.27 O HETATM 2908 O HOH E5261 46.676 68.591 -1.659 1.00 39.19 O HETATM 2909 O HOH E5262 43.949 58.932 -7.716 1.00 37.82 O HETATM 2910 O HOH E5263 54.432 45.251 33.114 1.00 37.52 O HETATM 2911 O HOH E5264 43.594 51.382 -9.147 1.00 46.29 O HETATM 2912 O HOH E5265 48.097 57.428 -13.457 1.00 30.33 O HETATM 2913 O HOH E5266 49.600 62.673 28.742 1.00 39.17 O HETATM 2914 O HOH E5267 50.038 72.692 1.904 1.00 39.80 O HETATM 2915 O HOH E5268 43.026 60.284 -5.793 1.00 37.29 O HETATM 2916 O HOH E5269 49.717 34.946 17.769 1.00 48.25 O HETATM 2917 O HOH E5270 57.558 32.901 14.034 1.00 41.58 O HETATM 2918 O HOH E5271 72.859 46.086 20.799 1.00 42.83 O HETATM 2919 O HOH E5272 68.342 36.872 17.223 1.00 36.03 O HETATM 2920 O HOH E5273 46.702 62.941 -6.486 1.00 40.92 O HETATM 2921 O HOH E5274 52.261 41.316 -5.008 1.00 48.46 O HETATM 2922 O HOH E5275 50.360 35.013 14.899 1.00 40.77 O HETATM 2923 O HOH E5276 36.374 55.594 25.108 1.00 39.44 O HETATM 2924 O HOH E5277 64.848 32.257 -2.840 1.00 45.89 O HETATM 2925 O HOH E5278 50.859 31.510 8.319 1.00 33.35 O HETATM 2926 O HOH E5279 52.713 43.564 27.396 0.50 23.66 O HETATM 2927 O HOH E5280 48.020 33.793 14.215 1.00 46.29 O HETATM 2928 O HOH E5281 64.749 68.220 8.624 1.00 35.40 O HETATM 2929 O HOH E5282 33.685 57.560 19.376 1.00 36.93 O HETATM 2930 O HOH E5283 42.725 60.545 24.011 0.67 14.46 O HETATM 2931 O HOH E5284 31.915 54.866 -0.908 1.00 35.46 O HETATM 2932 O HOH E5285 35.561 48.711 -6.443 1.00 44.19 O HETATM 2933 O HOH E5286 43.585 56.324 -8.119 1.00 43.23 O HETATM 2934 O HOH E5287 58.717 42.873 31.551 1.00 41.90 O HETATM 2935 O HOH E5288 63.481 54.215 29.278 1.00 14.01 O HETATM 2936 O HOH E5289 76.638 42.471 18.344 1.00 34.29 O HETATM 2937 O HOH E5290 56.540 46.441 -8.974 1.00 41.88 O HETATM 2938 O HOH E5291 74.346 57.789 6.594 1.00 33.13 O HETATM 2939 O HOH E5292 59.421 37.840 -7.598 1.00 45.81 O HETATM 2940 O HOH E5293 60.491 44.766 -7.283 1.00 35.22 O HETATM 2941 O HOH E5294 58.795 29.538 -7.286 1.00 48.60 O HETATM 2942 O HOH E5295 78.178 57.416 17.123 1.00 27.88 O HETATM 2943 O HOH E5296 67.167 45.130 25.022 1.00 41.99 O HETATM 2944 O HOH E5297 66.699 32.065 -0.350 1.00 46.62 O HETATM 2945 O HOH E5298 56.476 66.948 23.582 1.00 37.18 O HETATM 2946 O HOH E5299 65.758 32.653 15.952 1.00 51.20 O HETATM 2947 O HOH E5300 53.828 54.327 -15.407 1.00 40.96 O HETATM 2948 O HOH E5301 43.253 63.108 23.916 1.00 39.21 O HETATM 2949 O HOH E5302 73.861 39.848 16.179 1.00 24.66 O HETATM 2950 O HOH E5303 35.110 56.785 -4.018 1.00 40.09 O HETATM 2951 O HOH E5304 75.177 58.856 9.811 1.00 41.85 O HETATM 2952 O HOH E5305 48.890 48.391 31.692 1.00 22.86 O HETATM 2953 O HOH E5306 33.029 46.018 28.222 1.00 41.34 O HETATM 2954 O HOH E5307 41.232 51.669 -8.473 1.00 41.05 O HETATM 2955 O HOH E5308 65.469 52.596 30.080 1.00 33.48 O HETATM 2956 O HOH E5309 31.450 62.609 1.826 1.00 42.16 O HETATM 2957 O HOH E5310 36.931 60.288 -2.929 1.00 45.76 O HETATM 2958 O HOH E5311 64.701 28.898 0.913 1.00 39.40 O HETATM 2959 O HOH E5312 60.820 51.223 -9.451 1.00 39.81 O HETATM 2960 O HOH E5313 49.477 70.073 17.152 1.00 45.44 O HETATM 2961 O HOH E5314 43.238 69.940 9.290 1.00 40.66 O HETATM 2962 O HOH E5315 55.624 69.726 15.130 0.50 24.43 O HETATM 2963 O HOH E5316 44.809 66.915 20.510 1.00 49.25 O HETATM 2964 O HOH E5317 73.941 58.930 21.980 1.00 43.09 O HETATM 2965 O HOH E5318 57.717 61.374 28.231 1.00 20.19 O HETATM 2966 O HOH E5319 36.699 45.203 16.890 1.00 39.93 O HETATM 2967 O HOH E5320 45.219 54.997 -11.410 1.00 43.62 O HETATM 2968 O HOH E5321 65.931 48.938 29.369 0.50 28.10 O HETATM 2969 O HOH E5322 74.651 52.590 25.662 1.00 45.52 O HETATM 2970 O HOH E5323 77.963 67.836 9.079 1.00 43.46 O HETATM 2971 O HOH E5324 38.988 68.073 16.062 1.00 42.96 O HETATM 2972 O AHOH E5325 64.792 50.022 30.347 0.50 21.13 O HETATM 2973 O HOH E5326 43.907 48.838 -8.786 1.00 50.22 O HETATM 2974 O HOH E5327 53.397 71.437 2.085 1.00 47.87 O HETATM 2975 O HOH E5328 50.931 64.489 25.776 1.00 44.56 O HETATM 2976 O HOH E5329 41.564 61.034 25.228 0.33 16.00 O HETATM 2977 O HOH E5330 58.873 70.684 4.434 1.00 43.05 O HETATM 2978 O HOH E5331 32.594 49.212 -3.184 1.00 42.99 O HETATM 2979 O HOH E5332 69.816 34.474 12.494 1.00 38.93 O HETATM 2980 O HOH E5333 51.292 37.659 -3.490 1.00 59.09 O HETATM 2981 O HOH E5334 49.901 71.808 -0.783 1.00 40.05 O HETATM 2982 O HOH E5335 61.882 37.325 -6.367 1.00 47.53 O HETATM 2983 O HOH E5336 30.457 52.548 9.358 1.00 47.19 O HETATM 2984 O HOH E5337 39.047 61.901 -5.057 1.00 41.44 O HETATM 2985 O HOH E5338 59.996 31.427 10.790 1.00 36.07 O HETATM 2986 O HOH E5339 36.387 48.330 17.849 1.00 46.94 O HETATM 2987 O HOH E5340 68.423 36.142 -1.004 1.00 44.58 O HETATM 2988 O HOH E5341 35.073 49.046 23.680 1.00 46.27 O HETATM 2989 O HOH E5342 38.094 55.381 -6.353 1.00 48.04 O HETATM 2990 O HOH E5343 56.530 50.302 -10.733 1.00 47.65 O HETATM 2991 O HOH E5344 44.217 65.322 -3.220 1.00 45.31 O HETATM 2992 O HOH E5345 70.303 42.586 22.342 1.00 39.31 O HETATM 2993 O HOH E5346 54.281 33.577 14.563 1.00 43.91 O HETATM 2994 O HOH E5347 34.103 53.487 20.990 1.00 52.87 O HETATM 2995 O HOH E5348 35.087 44.468 29.082 1.00 50.15 O HETATM 2996 O HOH E5349 46.930 44.573 27.994 1.00 60.05 O HETATM 2997 O HOH E5350 48.865 45.341 28.223 1.00 56.21 O HETATM 2998 O HOH E5351 78.351 60.148 20.065 1.00 65.98 O HETATM 2999 O HOH E5352 53.425 35.987 -5.553 1.00 50.22 O HETATM 3000 O HOH E5353 74.752 62.644 14.016 0.50 18.43 O HETATM 3001 O HOH E5354 56.197 63.378 29.854 1.00 53.05 O HETATM 3002 O HOH E5355 58.779 33.923 20.410 1.00 49.12 O HETATM 3003 O HOH E5356 63.820 71.447 16.583 1.00 44.61 O HETATM 3004 O HOH E5357 47.219 46.999 29.231 1.00 49.55 O HETATM 3005 O HOH E5358 62.302 66.971 28.073 1.00 37.70 O HETATM 3006 O HOH E5359 58.345 55.409 -11.619 1.00 41.28 O HETATM 3007 O HOH E5360 48.546 42.003 28.949 1.00 45.01 O HETATM 3008 O HOH E5361 46.961 62.710 28.727 1.00 40.04 O HETATM 3009 O HOH E5362 62.212 46.973 -6.455 1.00 55.55 O HETATM 3010 O HOH E5363 36.677 60.923 19.038 1.00 52.69 O HETATM 3011 O HOH E5364 55.077 31.148 -6.676 1.00 45.69 O HETATM 3012 O HOH E5365 76.874 61.909 19.137 0.50 21.02 O HETATM 3013 O HOH E5366 54.734 68.192 21.148 1.00 54.38 O HETATM 3014 O HOH E5367 55.779 37.252 23.831 1.00 56.21 O HETATM 3015 O HOH E5368 34.372 46.728 23.310 1.00 43.75 O HETATM 3016 O HOH E5369 34.948 50.321 -2.325 1.00 36.12 O HETATM 3017 O HOH E5370 68.346 47.203 -0.247 1.00 40.31 O HETATM 3018 O HOH E5371 71.406 35.647 13.900 1.00 44.20 O HETATM 3019 O HOH E5372 68.512 34.728 14.858 1.00 50.61 O HETATM 3020 O HOH E5373 68.413 50.084 -0.240 1.00 45.17 O HETATM 3021 O HOH E5374 32.332 51.064 16.099 1.00 51.01 O HETATM 3022 O HOH E5375 39.083 63.507 23.916 1.00 45.05 O HETATM 3023 O HOH E5376 45.638 37.213 -0.282 1.00 43.16 O HETATM 3024 O HOH E5377 69.518 39.495 19.137 1.00 40.72 O HETATM 3025 O HOH E5378 45.111 59.643 30.435 1.00 42.56 O HETATM 3026 O HOH E5379 32.580 56.333 -3.265 1.00 45.81 O HETATM 3027 O HOH E5380 32.678 47.551 26.348 1.00 41.24 O HETATM 3028 O HOH E5381 56.918 41.417 28.248 1.00 51.28 O HETATM 3029 O HOH E5382 29.826 52.307 4.931 1.00 42.28 O HETATM 3030 O HOH I 84 29.969 29.037 -8.327 1.00 14.20 O HETATM 3031 O HOH I 85 27.515 22.859 3.398 1.00 12.64 O HETATM 3032 O HOH I 86 28.691 25.376 4.013 1.00 14.39 O HETATM 3033 O HOH I 87 26.778 30.530 0.143 1.00 15.38 O HETATM 3034 O HOH I 88 41.830 36.434 4.582 1.00 13.58 O HETATM 3035 O HOH I 89 39.676 36.063 -2.477 1.00 17.27 O HETATM 3036 O HOH I 90 41.717 35.856 1.223 1.00 17.50 O HETATM 3037 O HOH I 91 31.301 31.043 10.695 1.00 19.14 O HETATM 3038 O HOH I 92 30.904 25.519 -9.881 1.00 19.75 O HETATM 3039 O HOH I 93 46.405 38.621 6.599 1.00 19.49 O HETATM 3040 O HOH I 94 42.192 36.500 -1.549 1.00 24.36 O HETATM 3041 O HOH I 95 40.287 44.839 9.121 1.00 18.73 O HETATM 3042 O HOH I 96 34.247 36.788 -13.466 1.00 19.03 O HETATM 3043 O HOH I 97 47.301 32.398 5.629 1.00 25.69 O HETATM 3044 O HOH I 98 45.239 35.302 -6.226 1.00 24.72 O HETATM 3045 O HOH I 99 27.289 30.044 2.921 1.00 29.27 O HETATM 3046 O HOH I 100 31.003 40.618 3.798 1.00 24.07 O HETATM 3047 O HOH I 101 25.231 22.246 1.836 1.00 23.33 O HETATM 3048 O HOH I 102 42.886 41.175 14.807 1.00 37.02 O HETATM 3049 O HOH I 103 25.708 20.727 -0.227 1.00 27.52 O HETATM 3050 O HOH I 104 43.407 37.844 2.443 1.00 25.62 O HETATM 3051 O HOH I 105 31.332 34.191 8.294 1.00 25.53 O HETATM 3052 O HOH I 106 37.819 42.251 8.954 1.00 29.01 O HETATM 3053 O HOH I 107 43.750 43.835 -1.566 1.00 38.11 O HETATM 3054 O HOH I 108 23.525 24.875 -0.430 1.00 33.54 O HETATM 3055 O HOH I 109 44.842 41.419 -0.423 1.00 28.27 O HETATM 3056 O HOH I 110 30.682 42.618 -6.992 1.00 28.05 O HETATM 3057 O HOH I 111 35.187 40.514 -14.556 1.00 54.89 O HETATM 3058 O HOH I 112 24.937 36.413 -2.317 1.00 24.82 O HETATM 3059 O HOH I 113 34.479 44.233 -7.328 1.00 24.70 O HETATM 3060 O HOH I 114 37.966 35.514 -11.427 1.00 34.22 O HETATM 3061 O HOH I 115 27.381 32.240 4.352 1.00 34.08 O HETATM 3062 O HOH I 116 34.599 21.906 1.351 1.00 35.28 O HETATM 3063 O HOH I 117 29.293 27.188 10.247 1.00 27.11 O HETATM 3064 O HOH I 118 38.190 29.033 12.270 1.00 36.32 O HETATM 3065 O HOH I 119 29.858 42.003 -3.322 1.00 31.33 O HETATM 3066 O HOH I 120 37.821 38.102 -12.205 1.00 29.04 O HETATM 3067 O HOH I 121 25.584 32.898 0.251 1.00 40.08 O HETATM 3068 O HOH I 122 29.457 33.832 5.161 1.00 42.97 O HETATM 3069 O HOH I 123 38.745 21.100 7.442 1.00 32.13 O HETATM 3070 O HOH I 124 38.338 24.781 11.437 1.00 31.56 O HETATM 3071 O HOH I 125 23.981 30.986 -1.203 1.00 30.52 O HETATM 3072 O HOH I 126 45.466 35.780 14.358 1.00 31.02 O HETATM 3073 O HOH I 127 43.688 29.338 -8.632 1.00 29.38 O HETATM 3074 O HOH I 128 35.953 43.670 -11.692 1.00 34.77 O HETATM 3075 O HOH I 129 28.111 42.325 -8.371 1.00 39.51 O HETATM 3076 O HOH I 130 28.634 31.513 9.521 1.00 35.34 O HETATM 3077 O HOH I 131 42.687 42.783 -4.273 1.00 32.71 O HETATM 3078 O HOH I 132 44.181 40.468 2.382 1.00 29.75 O HETATM 3079 O HOH I 133 31.912 44.018 -2.926 1.00 36.75 O HETATM 3080 O HOH I 134 34.876 32.908 -13.757 1.00 34.75 O HETATM 3081 O HOH I 135 47.527 32.653 -0.929 1.00 41.58 O HETATM 3082 O HOH I 136 45.676 41.468 6.126 1.00 23.00 O HETATM 3083 O HOH I 137 28.431 19.865 -0.111 1.00 32.83 O HETATM 3084 O HOH I 138 45.647 34.772 -1.670 1.00 36.86 O HETATM 3085 O HOH I 139 37.870 22.282 -0.075 1.00 32.17 O HETATM 3086 O HOH I 140 36.527 45.775 -7.872 1.00 33.36 O HETATM 3087 O HOH I 141 32.209 44.429 -0.554 1.00 39.25 O HETATM 3088 O HOH I 142 31.080 22.849 -4.123 1.00 41.36 O HETATM 3089 O HOH I 143 31.681 20.782 -1.469 1.00 49.52 O HETATM 3090 O HOH I 144 29.243 22.588 -2.767 1.00 40.05 O HETATM 3091 O HOH I 145 27.378 39.382 -2.694 1.00 35.33 O HETATM 3092 O HOH I 146 26.371 35.341 -0.209 1.00 50.06 O HETATM 3093 O HOH I 147 37.365 23.118 -2.416 1.00 36.81 O HETATM 3094 O HOH I 148 39.849 24.740 8.996 1.00 33.48 O HETATM 3095 O HOH I 149 44.913 24.247 -0.331 1.00 42.06 O HETATM 3096 O HOH I 150 38.616 41.635 -11.785 1.00 43.04 O HETATM 3097 O HOH I 151 27.948 43.615 -12.358 1.00 31.91 O HETATM 3098 O HOH I 152 28.789 42.999 -17.377 1.00 38.75 O HETATM 3099 O HOH I 153 47.083 25.482 -2.208 1.00 43.99 O HETATM 3100 O HOH I 154 49.520 32.739 2.114 1.00 34.57 O HETATM 3101 O HOH I 155 29.371 37.600 4.020 1.00 51.94 O HETATM 3102 O HOH I 156 30.760 32.280 12.945 1.00 41.07 O HETATM 3103 O HOH I 157 45.509 39.904 14.784 1.00 21.94 O HETATM 3104 O HOH I 158 36.644 28.405 -11.764 1.00 37.30 O HETATM 3105 O HOH I 159 42.554 36.842 15.801 1.00 34.39 O HETATM 3106 O HOH I 160 36.481 34.703 16.113 1.00 49.18 O HETATM 3107 O HOH I 161 32.483 44.166 3.476 1.00 45.43 O HETATM 3108 O HOH I 162 35.900 24.723 -7.102 1.00 53.37 O HETATM 3109 O HOH I 163 36.509 26.526 12.056 1.00 24.14 O HETATM 3110 O HOH I 164 45.834 24.949 2.575 1.00 34.51 O HETATM 3111 O HOH I 165 29.560 45.321 -13.739 1.00 51.92 O HETATM 3112 O HOH I 166 47.775 29.972 4.190 1.00 38.31 O HETATM 3113 O HOH I 167 30.662 40.173 6.507 1.00 48.25 O HETATM 3114 O HOH I 168 41.193 41.995 12.760 0.50 26.00 O HETATM 3115 O HOH I 169 47.128 28.588 -2.917 1.00 42.19 O HETATM 3116 O HOH I 170 41.959 27.823 9.647 1.00 42.96 O HETATM 3117 O HOH I 171 36.393 39.418 10.519 1.00 49.98 O HETATM 3118 O HOH I 172 47.876 24.937 5.557 1.00 53.41 O HETATM 3119 O HOH I 173 32.234 44.847 -5.442 1.00 41.06 O HETATM 3120 O HOH I 174 46.447 40.429 3.875 1.00 22.67 O HETATM 3121 O HOH I 175 28.398 39.099 1.807 1.00 44.21 O HETATM 3122 O HOH I 176 44.007 40.454 -6.927 1.00 36.34 O HETATM 3123 O HOH I 177 44.658 28.563 10.379 1.00 51.95 O HETATM 3124 O HOH I 178 35.820 23.384 -4.270 1.00 45.67 O HETATM 3125 O HOH I 179 31.031 30.249 15.128 1.00 51.30 O CONECT 13 2558 CONECT 298 2558 CONECT 299 2558 CONECT 534 2558 CONECT 553 2558 CONECT 564 2558 CONECT 576 2558 CONECT 1180 2559 CONECT 1193 2559 CONECT 1218 2559 CONECT 2558 13 298 299 534 CONECT 2558 553 564 576 CONECT 2559 1180 1193 1218 2683 CONECT 2559 2785 CONECT 2560 2561 2562 2563 CONECT 2561 2560 CONECT 2562 2560 CONECT 2563 2560 2564 CONECT 2564 2563 2565 2566 2570 CONECT 2565 2564 CONECT 2566 2564 2567 CONECT 2567 2566 2568 2569 CONECT 2568 2567 CONECT 2569 2567 CONECT 2570 2564 2571 2572 CONECT 2571 2570 CONECT 2572 2570 CONECT 2573 2574 2575 2576 CONECT 2574 2573 CONECT 2575 2573 CONECT 2576 2573 2577 CONECT 2577 2576 2578 2579 2583 CONECT 2578 2577 CONECT 2579 2577 2580 CONECT 2580 2579 2581 2582 CONECT 2581 2580 CONECT 2582 2580 CONECT 2583 2577 2584 2585 CONECT 2584 2583 CONECT 2585 2583 CONECT 2586 2587 2588 2589 CONECT 2587 2586 CONECT 2588 2586 CONECT 2589 2586 2590 CONECT 2590 2589 2591 2592 2596 CONECT 2591 2590 CONECT 2592 2590 2593 CONECT 2593 2592 2594 2595 CONECT 2594 2593 CONECT 2595 2593 CONECT 2596 2590 2597 2598 CONECT 2597 2596 CONECT 2598 2596 CONECT 2599 2600 CONECT 2600 2599 2601 CONECT 2601 2600 2602 CONECT 2602 2601 2603 CONECT 2603 2602 2604 CONECT 2604 2603 2605 CONECT 2605 2604 2606 CONECT 2606 2605 2607 CONECT 2607 2606 2608 CONECT 2608 2607 2609 CONECT 2609 2608 CONECT 2610 2611 CONECT 2611 2610 2612 CONECT 2612 2611 2613 CONECT 2613 2612 2614 CONECT 2614 2613 2615 CONECT 2615 2614 2616 CONECT 2616 2615 2617 CONECT 2617 2616 2618 CONECT 2618 2617 2619 CONECT 2619 2618 2620 CONECT 2620 2619 2621 CONECT 2621 2620 2622 CONECT 2622 2621 2623 CONECT 2623 2622 2624 CONECT 2624 2623 2625 CONECT 2625 2624 CONECT 2626 2627 CONECT 2627 2626 2628 CONECT 2628 2627 2629 CONECT 2629 2628 2630 CONECT 2630 2629 2631 CONECT 2631 2630 2632 CONECT 2632 2631 2633 CONECT 2633 2632 2634 CONECT 2634 2633 2635 CONECT 2635 2634 2636 CONECT 2636 2635 2637 CONECT 2637 2636 2638 CONECT 2638 2637 2639 CONECT 2639 2638 CONECT 2640 2641 CONECT 2641 2640 2642 CONECT 2642 2641 2643 CONECT 2643 2642 2644 CONECT 2644 2643 2645 CONECT 2645 2644 2646 CONECT 2646 2645 2647 CONECT 2647 2646 2648 CONECT 2648 2647 2649 CONECT 2649 2648 2650 CONECT 2650 2649 2651 CONECT 2651 2650 CONECT 2683 2559 CONECT 2785 2559 MASTER 439 0 9 11 15 0 21 6 3071 2 108 27 END
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Related entries of code: 1y3c
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RCSB PDB
PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
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RCSB PDB
PDBbind
64-mer
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64-mer
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PDBbind
64-mer
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64-mer
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PDBbind
64-mer
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RCSB PDB
PDBbind
64-mer
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RCSB PDB
PDBbind
64-mer
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PDBbind
64-mer
1y3b
RCSB PDB
PDBbind
64-mer
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PDBbind
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RCSB PDB
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64-mer
Entry Information
PDB ID
1y3c
Complex Type
Protein-Protein
PDBbind Subset
general set
Protein Name
subtilisin bpn
Ligand Name
64-mer
EC.Number
E.C.3.4.21.62
Resolution
1.69(Å)
Affinity (Kd/Ki/IC50)
Ki=0.025nM
Release Year
2005
Protein/NA Sequence
Check fasta file
Primary Reference
Biochemistry v44 pp. 6823-30, 2005
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P00782
Q40059
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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times since Nov 2007.
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