Browse entries in the PDBbind-CN Database
HEADER HYDROLASE/HYDROLASE INHIBITOR 10-JUN-04 1TM5 TITLE CRYSTAL STRUCTURE OF THE COMPLEX OF SUBTILISIN BPN' WITH CHYMOTRYPSIN TITLE 2 INHIBITOR 2 M59A MUTANT COMPND MOL_ID: 1; COMPND 2 MOLECULE: SUBTILISIN BPN'; COMPND 3 CHAIN: E; COMPND 4 SYNONYM: SUBTILISIN NOVO, 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 SUBSP. VULGARE; SOURCE 12 ORGANISM_COMMON: DOMESTICATED BARLEY; SOURCE 13 ORGANISM_TAXID: 112509; SOURCE 14 STRAIN: SUBSP. VULGARE; SOURCE 15 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 16 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 17 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3); SOURCE 18 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 19 EXPRESSION_SYSTEM_PLASMID: PCI2M59A KEYWDS SERINE PROTEASE, INHIBITOR, HYDROLASE-HYDROLASE INHIBITOR COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR E.S.RADISKY,G.KWAN,C.J.KAREN LU,D.E.KOSHLAND JR. REVDAT 3 11-OCT-17 1TM5 1 REMARK REVDAT 2 24-FEB-09 1TM5 1 VERSN REVDAT 1 09-NOV-04 1TM5 0 JRNL AUTH E.S.RADISKY,G.KWAN,C.J.KAREN LU,D.E.KOSHLAND JR. JRNL TITL BINDING, PROTEOLYTIC, AND CRYSTALLOGRAPHIC ANALYSES OF JRNL TITL 2 MUTATIONS AT THE PROTEASE-INHIBITOR INTERFACE OF THE JRNL TITL 3 SUBTILISIN BPN'/CHYMOTRYPSIN INHIBITOR 2 COMPLEX(,). JRNL REF BIOCHEMISTRY V. 43 13648 2004 JRNL REFN ISSN 0006-2960 JRNL PMID 15504027 JRNL DOI 10.1021/BI048797K REMARK 2 REMARK 2 RESOLUTION. 1.45 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) : 1.45 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 81.65 REMARK 3 DATA CUTOFF (SIGMA(F)) : -3.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 95.6 REMARK 3 NUMBER OF REFLECTIONS : 77651 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) : 0.162 REMARK 3 R VALUE (WORKING SET) : 0.161 REMARK 3 FREE R VALUE : 0.179 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 4095 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) : 1.45 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.49 REMARK 3 REFLECTION IN BIN (WORKING SET) : 5621 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 BIN R VALUE (WORKING SET) : 0.2590 REMARK 3 BIN FREE R VALUE SET COUNT : 324 REMARK 3 BIN FREE R VALUE : 0.2750 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2500 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 81 REMARK 3 SOLVENT ATOMS : 483 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 16.83 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.28000 REMARK 3 B22 (A**2) : 0.28000 REMARK 3 B33 (A**2) : -0.43000 REMARK 3 B12 (A**2) : 0.14000 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): 0.053 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.054 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.035 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 0.915 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.972 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.967 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2674 ; 0.019 ; 0.021 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3628 ; 1.880 ; 1.960 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 345 ; 5.769 ; 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): 407 ; 0.122 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 2005 ; 0.008 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 1334 ; 0.213 ; 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): 363 ; 0.165 ; 0.200 REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): 10 ; 0.064 ; 0.200 REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): 39 ; 0.416 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 55 ; 0.160 ; 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): 1715 ; 0.974 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2765 ; 1.642 ; 2.000 REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 959 ; 2.775 ; 3.000 REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 862 ; 4.549 ; 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 1TM5 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 22-JUN-04. REMARK 100 THE DEPOSITION ID IS D_1000022763. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 11-JUL-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) : 1.0 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 REMARK 200 DATA SCALING SOFTWARE : CCP4 (SCALA, TRUNCATE REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 81746 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.450 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 (%) : 95.6 REMARK 200 DATA REDUNDANCY : 2.300 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 0.04300 REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 9.7000 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: PDB ENTRY 1TM3 REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 63.20 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.40 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: SODIUM CITRATE, ISOPROPANOL, PEG REMARK 280 MONOMETHYL ETHER 750, PH 4.6, VAPOR DIFFUSION, HANGING DROP, REMARK 280 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 123.83867 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 61.91933 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 92.87900 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 30.95967 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 154.79833 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 123.83867 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 61.91933 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 30.95967 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 92.87900 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 154.79833 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: 2940 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 13380 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -25.0 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: 7580 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 25780 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -56.0 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 140.67150 REMARK 350 BIOMT2 2 -0.866025 0.500000 0.000000 81.21673 REMARK 350 BIOMT3 2 0.000000 0.000000 -1.000000 61.91933 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 MET I 20 N CA CB CG SD CE 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 585 O HOH E 773 2.00 REMARK 500 O3 CIT E 493 O HOH E 873 2.10 REMARK 500 O HOH E 836 O HOH E 837 2.19 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 C13 1PE E 495 C13 1PE E 495 9765 1.73 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. = 6.6 DEGREES REMARK 500 ASP I 74 CB - CG - OD2 ANGL. DEV. = 5.7 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 THR E 22 14.19 -140.52 REMARK 500 ASP E 32 -148.39 -167.93 REMARK 500 SER E 63 -22.76 115.65 REMARK 500 ALA E 73 23.02 -149.79 REMARK 500 ASN E 77 -157.41 -159.30 REMARK 500 SER E 159 68.83 -152.33 REMARK 500 LEU E 257 -120.17 -116.47 REMARK 500 ALA I 59 40.86 -103.34 REMARK 500 REMARK 500 REMARK: NULL REMARK 600 REMARK 600 HETEROGEN REMARK 600 ONLY PARTS OF THE THREE REMARK 600 POLYETHYLENE MOLECULES WERE MODELED. 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 1PE E 495 REMARK 610 1PE E 497 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 E 490 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLN E 2 OE1 REMARK 620 2 ASP E 41 OD1 159.8 REMARK 620 3 LEU E 75 O 75.6 88.8 REMARK 620 4 ASN E 77 OD1 83.5 84.0 91.2 REMARK 620 5 ILE E 79 O 99.4 94.2 170.6 80.3 REMARK 620 6 VAL E 81 O 91.0 102.6 92.3 172.6 95.7 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 NA E 491 NA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLY E 169 O REMARK 620 2 TYR E 171 O 92.8 REMARK 620 3 VAL E 174 O 107.5 89.3 REMARK 620 4 HOH E 631 O 105.7 87.6 146.8 REMARK 620 5 HOH E 529 O 108.4 158.5 81.4 89.6 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 490 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NA E 491 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CIT E 492 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CIT E 493 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CIT E 494 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 1PE E 495 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 1PE E 496 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 1PE E 497 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1TM1 RELATED DB: PDB REMARK 900 RELATED ID: 1TM3 RELATED DB: PDB REMARK 900 RELATED ID: 1TM4 RELATED DB: PDB REMARK 900 RELATED ID: 1TM7 RELATED DB: PDB REMARK 900 RELATED ID: 1TMG RELATED DB: PDB REMARK 900 RELATED ID: 1TO1 RELATED DB: PDB REMARK 900 RELATED ID: 1TO2 RELATED DB: PDB DBREF 1TM5 E 1 275 UNP P00782 SUBT_BACAM 108 382 DBREF 1TM5 I 21 82 UNP Q40059 Q40059_HORVU 22 83 SEQADV 1TM5 HIS E 276 UNP P00782 EXPRESSION TAG SEQADV 1TM5 HIS E 277 UNP P00782 EXPRESSION TAG SEQADV 1TM5 HIS E 278 UNP P00782 EXPRESSION TAG SEQADV 1TM5 HIS E 279 UNP P00782 EXPRESSION TAG SEQADV 1TM5 HIS E 280 UNP P00782 EXPRESSION TAG SEQADV 1TM5 HIS E 281 UNP P00782 EXPRESSION TAG SEQADV 1TM5 MET I 20 UNP Q40059 INITIATING METHIONINE SEQADV 1TM5 ALA I 59 UNP Q40059 MET 60 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 ALA GLU TYR ARG 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 E 490 1 HET NA E 491 1 HET CIT E 492 13 HET CIT E 493 13 HET CIT E 494 13 HET 1PE E 495 11 HET 1PE E 496 16 HET 1PE E 497 13 HETNAM CA CALCIUM ION HETNAM NA SODIUM ION HETNAM CIT CITRIC ACID HETNAM 1PE PENTAETHYLENE GLYCOL HETSYN 1PE PEG400 FORMUL 3 CA CA 2+ FORMUL 4 NA NA 1+ FORMUL 5 CIT 3(C6 H8 O7) FORMUL 8 1PE 3(C10 H22 O6) FORMUL 11 HOH *483(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 148 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 ARG 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 E 490 1555 1555 2.39 LINK OD1 ASP E 41 CA CA E 490 1555 1555 2.39 LINK O LEU E 75 CA CA E 490 1555 1555 2.33 LINK OD1 ASN E 77 CA CA E 490 1555 1555 2.37 LINK O ILE E 79 CA CA E 490 1555 1555 2.38 LINK O VAL E 81 CA CA E 490 1555 1555 2.37 LINK O GLY E 169 NA NA E 491 1555 1555 2.34 LINK O TYR E 171 NA NA E 491 1555 1555 2.37 LINK O VAL E 174 NA NA E 491 1555 1555 2.28 LINK NA NA E 491 O HOH E 631 1555 1555 2.40 LINK NA NA E 491 O HOH E 529 1555 1555 2.45 CISPEP 1 TYR E 167 PRO E 168 0 8.68 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 E 529 SITE 2 AC2 5 HOH E 631 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 E 493 SITE 3 AC3 13 HOH E 525 HOH E 580 HOH E 613 HOH E 812 SITE 4 AC3 13 HOH E 874 SITE 1 AC4 13 TRP E 241 GLN E 245 HIS E 276 CIT E 492 SITE 2 AC4 13 HOH E 557 HOH E 580 HOH E 714 HOH E 722 SITE 3 AC4 13 HOH E 797 HOH E 812 HOH E 873 HOH E 874 SITE 4 AC4 13 HOH E 875 SITE 1 AC5 12 PRO E 172 GLY E 211 LYS E 213 ARG E 247 SITE 2 AC5 12 HOH E 532 HOH E 558 HOH E 584 HOH E 616 SITE 3 AC5 12 HOH E 680 HOH E 707 HOH E 769 HOH E 799 SITE 1 AC6 5 HIS E 17 THR E 22 ASN E 76 HOH E 809 SITE 2 AC6 5 HOH E 834 SITE 1 AC7 6 ILE E 115 ASN E 118 MET E 119 SER E 145 SITE 2 AC7 6 HOH E 600 HOH E 657 SITE 1 AC8 5 SER E 37 VAL E 44 ALA E 45 GLY E 47 SITE 2 AC8 5 PHE E 58 CRYST1 93.781 93.781 185.758 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 0.010663 0.006156 0.000000 0.00000 SCALE2 0.000000 0.012313 0.000000 0.00000 SCALE3 0.000000 0.000000 0.005383 0.00000 ATOM 1 N ALA E 1 48.881 51.028 36.649 1.00 14.48 N ATOM 2 CA ALA E 1 50.313 51.126 36.185 1.00 12.03 C ATOM 3 C ALA E 1 50.343 50.892 34.688 1.00 12.46 C ATOM 4 O ALA E 1 49.530 50.137 34.138 1.00 14.34 O ATOM 5 CB ALA E 1 51.188 50.041 36.860 1.00 13.10 C ATOM 6 N GLN E 2 51.309 51.515 34.033 1.00 10.26 N ATOM 7 CA GLN E 2 51.582 51.315 32.612 1.00 9.83 C ATOM 8 C GLN E 2 52.447 50.063 32.382 1.00 9.45 C ATOM 9 O GLN E 2 53.318 49.723 33.216 1.00 11.13 O ATOM 10 CB GLN E 2 52.306 52.570 32.130 1.00 9.57 C ATOM 11 CG GLN E 2 52.835 52.507 30.703 1.00 10.97 C ATOM 12 CD GLN E 2 53.310 53.878 30.296 1.00 9.39 C ATOM 13 OE1 GLN E 2 52.524 54.692 29.744 1.00 9.33 O ATOM 14 NE2 GLN E 2 54.582 54.197 30.679 1.00 10.03 N ATOM 15 N SER E 3 52.201 49.394 31.263 1.00 9.56 N ATOM 16 CA SER E 3 52.995 48.262 30.834 1.00 9.90 C ATOM 17 C SER E 3 53.707 48.632 29.537 1.00 9.59 C ATOM 18 O SER E 3 53.179 49.392 28.714 1.00 10.88 O ATOM 19 CB SER E 3 52.098 47.026 30.637 1.00 11.81 C ATOM 20 OG ASER E 3 51.041 47.286 29.794 0.33 12.14 O ATOM 21 OG BSER E 3 52.704 46.041 29.835 0.33 12.19 O ATOM 22 OG CSER E 3 51.331 46.787 31.778 0.33 12.74 O ATOM 23 N VAL E 4 54.918 48.120 29.376 1.00 10.13 N ATOM 24 CA VAL E 4 55.646 48.349 28.133 1.00 10.10 C ATOM 25 C VAL E 4 55.541 47.052 27.318 1.00 9.60 C ATOM 26 O VAL E 4 56.136 46.026 27.711 1.00 10.83 O ATOM 27 CB VAL E 4 57.114 48.655 28.433 1.00 10.16 C ATOM 28 CG1 VAL E 4 57.891 48.895 27.120 1.00 11.09 C ATOM 29 CG2 VAL E 4 57.207 49.887 29.362 1.00 11.30 C ATOM 30 N PRO E 5 54.822 47.077 26.212 1.00 8.79 N ATOM 31 CA PRO E 5 54.701 45.844 25.402 1.00 10.08 C ATOM 32 C PRO E 5 56.088 45.372 24.984 1.00 10.40 C ATOM 33 O PRO E 5 57.025 46.155 24.756 1.00 10.36 O ATOM 34 CB PRO E 5 53.893 46.302 24.204 1.00 11.36 C ATOM 35 CG PRO E 5 53.071 47.522 24.767 1.00 10.97 C ATOM 36 CD PRO E 5 54.096 48.224 25.636 1.00 10.30 C ATOM 37 N TYR E 6 56.244 44.061 24.876 1.00 9.48 N ATOM 38 CA TYR E 6 57.587 43.508 24.603 1.00 8.93 C ATOM 39 C TYR E 6 58.195 44.068 23.354 1.00 9.38 C ATOM 40 O TYR E 6 59.438 44.244 23.322 1.00 9.56 O ATOM 41 CB TYR E 6 57.560 41.940 24.538 1.00 9.75 C ATOM 42 CG TYR E 6 57.146 41.393 23.159 1.00 11.48 C ATOM 43 CD1 TYR E 6 58.099 41.198 22.130 1.00 12.11 C ATOM 44 CD2 TYR E 6 55.813 41.054 22.858 1.00 11.55 C ATOM 45 CE1 TYR E 6 57.718 40.726 20.842 1.00 11.74 C ATOM 46 CE2 TYR E 6 55.425 40.600 21.601 1.00 11.44 C ATOM 47 CZ TYR E 6 56.409 40.406 20.621 1.00 13.20 C ATOM 48 OH TYR E 6 56.087 39.924 19.375 1.00 15.78 O ATOM 49 N GLY E 7 57.401 44.348 22.326 1.00 8.34 N ATOM 50 CA GLY E 7 57.991 44.803 21.066 1.00 8.67 C ATOM 51 C GLY E 7 58.617 46.185 21.184 1.00 9.35 C ATOM 52 O GLY E 7 59.612 46.437 20.500 1.00 9.92 O ATOM 53 N VAL E 8 58.089 47.039 22.066 1.00 8.76 N ATOM 54 CA VAL E 8 58.724 48.366 22.277 1.00 9.26 C ATOM 55 C VAL E 8 60.122 48.165 22.883 1.00 9.15 C ATOM 56 O VAL E 8 61.091 48.825 22.454 1.00 9.60 O ATOM 57 CB VAL E 8 57.812 49.197 23.210 1.00 9.15 C ATOM 58 CG1 VAL E 8 58.471 50.562 23.603 1.00 9.60 C ATOM 59 CG2 VAL E 8 56.491 49.469 22.507 1.00 11.10 C ATOM 60 N SER E 9 60.258 47.241 23.834 1.00 8.73 N ATOM 61 CA SER E 9 61.570 46.941 24.402 1.00 9.05 C ATOM 62 C SER E 9 62.458 46.271 23.391 1.00 9.58 C ATOM 63 O SER E 9 63.680 46.531 23.348 1.00 9.91 O ATOM 64 CB SER E 9 61.414 46.028 25.641 1.00 10.10 C ATOM 65 OG SER E 9 60.621 46.729 26.606 1.00 12.87 O ATOM 66 N GLN E 10 61.879 45.403 22.560 1.00 8.64 N ATOM 67 CA GLN E 10 62.677 44.575 21.646 1.00 10.16 C ATOM 68 C GLN E 10 63.419 45.446 20.611 1.00 10.87 C ATOM 69 O GLN E 10 64.564 45.105 20.196 1.00 12.07 O ATOM 70 CB GLN E 10 61.757 43.559 20.973 1.00 9.84 C ATOM 71 CG GLN E 10 62.524 42.581 20.084 1.00 12.24 C ATOM 72 CD GLN E 10 61.656 41.369 19.764 1.00 14.64 C ATOM 73 OE1 GLN E 10 60.813 41.018 20.561 1.00 18.36 O ATOM 74 NE2 GLN E 10 61.906 40.700 18.650 1.00 13.34 N ATOM 75 N ILE E 11 62.801 46.546 20.193 1.00 9.52 N ATOM 76 CA ILE E 11 63.453 47.414 19.207 1.00 9.51 C ATOM 77 C ILE E 11 64.344 48.459 19.888 1.00 9.92 C ATOM 78 O ILE E 11 64.936 49.272 19.181 1.00 9.66 O ATOM 79 CB ILE E 11 62.412 48.121 18.300 1.00 9.45 C ATOM 80 CG1 ILE E 11 61.514 49.129 19.081 1.00 10.42 C ATOM 81 CG2 ILE E 11 61.561 47.101 17.529 1.00 10.39 C ATOM 82 CD1 ILE E 11 60.802 50.154 18.148 1.00 10.00 C ATOM 83 N LYS E 12 64.444 48.407 21.208 1.00 9.87 N ATOM 84 CA LYS E 12 65.348 49.260 22.023 1.00 9.87 C ATOM 85 C LYS E 12 64.832 50.689 22.113 1.00 10.74 C ATOM 86 O LYS E 12 65.618 51.639 22.378 1.00 11.57 O ATOM 87 CB LYS E 12 66.821 49.143 21.574 1.00 10.93 C ATOM 88 CG LYS E 12 67.305 47.664 21.676 1.00 14.43 C ATOM 89 CD LYS E 12 68.813 47.577 21.482 1.00 19.69 C ATOM 90 CE LYS E 12 69.237 46.106 21.363 1.00 24.87 C ATOM 91 NZ LYS E 12 68.796 45.258 22.493 1.00 31.96 N ATOM 92 N ALA E 13 63.522 50.877 21.978 1.00 10.33 N ATOM 93 CA ALA E 13 62.981 52.228 22.183 1.00 9.24 C ATOM 94 C ALA E 13 63.234 52.780 23.595 1.00 9.89 C ATOM 95 O ALA E 13 63.451 54.000 23.710 1.00 10.29 O ATOM 96 CB ALA E 13 61.466 52.268 21.842 1.00 9.77 C ATOM 97 N PRO E 14 63.231 51.993 24.672 1.00 10.09 N ATOM 98 CA PRO E 14 63.495 52.566 26.013 1.00 9.78 C ATOM 99 C PRO E 14 64.870 53.226 26.087 1.00 9.98 C ATOM 100 O PRO E 14 64.996 54.161 26.907 1.00 11.07 O ATOM 101 CB PRO E 14 63.398 51.355 26.956 1.00 11.88 C ATOM 102 CG PRO E 14 62.313 50.502 26.240 1.00 11.40 C ATOM 103 CD PRO E 14 62.768 50.580 24.768 1.00 9.47 C ATOM 104 N ALA E 15 65.844 52.813 25.274 1.00 10.37 N ATOM 105 CA ALA E 15 67.148 53.527 25.287 1.00 10.32 C ATOM 106 C ALA E 15 66.987 54.942 24.796 1.00 11.46 C ATOM 107 O ALA E 15 67.642 55.860 25.366 1.00 12.83 O ATOM 108 CB ALA E 15 68.178 52.796 24.432 1.00 11.92 C ATOM 109 N LEU E 16 66.138 55.177 23.815 1.00 9.81 N ATOM 110 CA LEU E 16 65.905 56.574 23.393 1.00 9.44 C ATOM 111 C LEU E 16 65.139 57.321 24.478 1.00 10.16 C ATOM 112 O LEU E 16 65.444 58.493 24.747 1.00 9.74 O ATOM 113 CB LEU E 16 65.092 56.623 22.068 1.00 10.38 C ATOM 114 CG LEU E 16 65.896 56.642 20.755 1.00 10.28 C ATOM 115 CD1 LEU E 16 66.563 58.009 20.572 1.00 12.88 C ATOM 116 CD2 LEU E 16 66.931 55.507 20.798 1.00 11.92 C ATOM 117 N HIS E 17 64.114 56.699 25.073 1.00 8.94 N ATOM 118 CA HIS E 17 63.342 57.372 26.087 1.00 9.85 C ATOM 119 C HIS E 17 64.273 57.805 27.241 1.00 9.62 C ATOM 120 O HIS E 17 64.096 58.917 27.754 1.00 10.92 O ATOM 121 CB HIS E 17 62.263 56.428 26.644 1.00 9.90 C ATOM 122 CG HIS E 17 61.293 55.955 25.611 1.00 9.74 C ATOM 123 ND1 HIS E 17 60.411 54.921 25.875 1.00 11.42 N ATOM 124 CD2 HIS E 17 61.063 56.360 24.343 1.00 9.12 C ATOM 125 CE1 HIS E 17 59.671 54.724 24.792 1.00 12.99 C ATOM 126 NE2 HIS E 17 60.051 55.571 23.844 1.00 9.72 N ATOM 127 N SER E 18 65.219 56.937 27.641 1.00 9.88 N ATOM 128 CA SER E 18 66.130 57.288 28.740 1.00 10.17 C ATOM 129 C SER E 18 67.095 58.410 28.385 1.00 10.18 C ATOM 130 O SER E 18 67.535 59.120 29.288 1.00 9.46 O ATOM 131 CB SER E 18 66.905 56.079 29.234 1.00 10.49 C ATOM 132 OG ASER E 18 66.106 55.005 29.645 0.50 11.87 O ATOM 133 OG BSER E 18 67.844 55.665 28.312 0.50 11.90 O ATOM 134 N GLN E 19 67.389 58.564 27.089 1.00 10.12 N ATOM 135 CA GLN E 19 68.167 59.723 26.602 1.00 9.10 C ATOM 136 C GLN E 19 67.354 61.006 26.624 1.00 9.86 C ATOM 137 O GLN E 19 67.933 62.091 26.454 1.00 9.03 O ATOM 138 CB GLN E 19 68.692 59.449 25.188 1.00 9.77 C ATOM 139 CG GLN E 19 69.802 58.350 25.088 1.00 10.97 C ATOM 140 CD GLN E 19 70.086 58.081 23.613 1.00 16.61 C ATOM 141 OE1 GLN E 19 70.243 59.009 22.860 1.00 21.01 O ATOM 142 NE2 GLN E 19 70.029 56.833 23.182 1.00 18.33 N ATOM 143 N GLY E 20 66.021 60.901 26.760 1.00 10.12 N ATOM 144 CA GLY E 20 65.125 62.055 26.794 1.00 10.77 C ATOM 145 C GLY E 20 64.351 62.255 25.496 1.00 11.45 C ATOM 146 O GLY E 20 63.720 63.321 25.311 1.00 12.96 O ATOM 147 N TYR E 21 64.372 61.259 24.598 1.00 9.56 N ATOM 148 CA TYR E 21 63.761 61.434 23.285 1.00 8.67 C ATOM 149 C TYR E 21 62.572 60.494 23.093 1.00 9.84 C ATOM 150 O TYR E 21 62.654 59.262 23.343 1.00 11.35 O ATOM 151 CB TYR E 21 64.804 61.221 22.172 1.00 9.46 C ATOM 152 CG TYR E 21 65.868 62.290 22.255 1.00 9.43 C ATOM 153 CD1 TYR E 21 65.539 63.599 21.927 1.00 12.42 C ATOM 154 CD2 TYR E 21 67.175 61.978 22.675 1.00 11.65 C ATOM 155 CE1 TYR E 21 66.468 64.636 22.032 1.00 13.74 C ATOM 156 CE2 TYR E 21 68.147 63.033 22.764 1.00 12.18 C ATOM 157 CZ TYR E 21 67.748 64.322 22.451 1.00 13.50 C ATOM 158 OH TYR E 21 68.680 65.339 22.544 1.00 15.46 O ATOM 159 N THR E 22 61.441 61.096 22.725 1.00 8.62 N ATOM 160 CA THR E 22 60.156 60.380 22.728 1.00 9.55 C ATOM 161 C THR E 22 59.337 60.775 21.519 1.00 9.40 C ATOM 162 O THR E 22 58.145 60.454 21.476 1.00 8.67 O ATOM 163 CB THR E 22 59.345 60.721 23.971 1.00 10.55 C ATOM 164 OG1 THR E 22 59.204 62.161 24.133 1.00 11.39 O ATOM 165 CG2 THR E 22 60.000 60.180 25.239 1.00 11.24 C ATOM 166 N GLY E 23 59.912 61.422 20.515 1.00 8.28 N ATOM 167 CA GLY E 23 59.158 61.800 19.327 1.00 9.54 C ATOM 168 C GLY E 23 58.490 63.164 19.385 1.00 9.85 C ATOM 169 O GLY E 23 57.675 63.466 18.512 1.00 9.91 O ATOM 170 N SER E 24 58.851 63.997 20.374 1.00 9.65 N ATOM 171 CA SER E 24 58.205 65.290 20.502 1.00 10.81 C ATOM 172 C SER E 24 58.347 66.129 19.247 1.00 12.08 C ATOM 173 O SER E 24 59.407 66.198 18.656 1.00 12.93 O ATOM 174 CB SER E 24 58.882 66.102 21.585 1.00 12.17 C ATOM 175 OG ASER E 24 58.827 65.500 22.831 0.67 12.76 O ATOM 176 OG BSER E 24 58.043 67.210 21.881 0.33 10.92 O ATOM 177 N ASN E 25 57.232 66.766 18.874 1.00 13.12 N ATOM 178 CA ASN E 25 57.174 67.654 17.709 1.00 15.98 C ATOM 179 C ASN E 25 57.302 66.949 16.361 1.00 15.08 C ATOM 180 O ASN E 25 57.351 67.618 15.331 1.00 19.76 O ATOM 181 CB ASN E 25 58.229 68.771 17.771 1.00 16.99 C ATOM 182 CG ASN E 25 58.102 69.594 19.015 1.00 24.67 C ATOM 183 OD1 ASN E 25 56.991 69.976 19.395 1.00 29.20 O ATOM 184 ND2 ASN E 25 59.222 69.828 19.693 1.00 31.77 N ATOM 185 N VAL E 26 57.257 65.614 16.351 1.00 11.09 N ATOM 186 CA VAL E 26 57.282 64.924 15.074 1.00 10.78 C ATOM 187 C VAL E 26 55.864 64.543 14.701 1.00 9.99 C ATOM 188 O VAL E 26 55.157 63.941 15.502 1.00 11.40 O ATOM 189 CB VAL E 26 58.173 63.666 15.149 1.00 10.06 C ATOM 190 CG1 VAL E 26 58.212 62.939 13.806 1.00 10.86 C ATOM 191 CG2 VAL E 26 59.608 64.031 15.647 1.00 11.48 C ATOM 192 N LYS E 27 55.485 64.874 13.476 1.00 9.65 N ATOM 193 CA LYS E 27 54.108 64.645 13.001 1.00 9.58 C ATOM 194 C LYS E 27 54.078 63.295 12.296 1.00 9.63 C ATOM 195 O LYS E 27 54.763 63.104 11.278 1.00 10.59 O ATOM 196 CB LYS E 27 53.674 65.765 12.052 1.00 10.44 C ATOM 197 CG LYS E 27 53.654 67.119 12.780 1.00 11.36 C ATOM 198 CD LYS E 27 53.031 68.204 11.875 1.00 16.82 C ATOM 199 CE LYS E 27 53.036 69.529 12.579 1.00 22.47 C ATOM 200 NZ LYS E 27 54.400 70.090 12.366 1.00 30.91 N ATOM 201 N VAL E 28 53.265 62.376 12.838 1.00 9.77 N ATOM 202 CA VAL E 28 53.098 61.019 12.248 1.00 10.02 C ATOM 203 C VAL E 28 51.640 60.817 11.833 1.00 10.36 C ATOM 204 O VAL E 28 50.719 60.927 12.675 1.00 11.28 O ATOM 205 CB VAL E 28 53.485 59.940 13.257 1.00 9.34 C ATOM 206 CG1 VAL E 28 53.351 58.518 12.632 1.00 12.29 C ATOM 207 CG2 VAL E 28 54.900 60.210 13.813 1.00 10.54 C ATOM 208 N ALA E 29 51.457 60.576 10.545 1.00 9.67 N ATOM 209 CA ALA E 29 50.096 60.261 10.032 1.00 11.06 C ATOM 210 C ALA E 29 49.934 58.765 10.050 1.00 10.68 C ATOM 211 O ALA E 29 50.710 58.051 9.414 1.00 10.77 O ATOM 212 CB ALA E 29 49.919 60.798 8.587 1.00 11.33 C ATOM 213 N VAL E 30 48.897 58.303 10.729 1.00 10.68 N ATOM 214 CA VAL E 30 48.475 56.888 10.687 1.00 10.30 C ATOM 215 C VAL E 30 47.372 56.827 9.628 1.00 10.34 C ATOM 216 O VAL E 30 46.250 57.286 9.858 1.00 11.47 O ATOM 217 CB VAL E 30 48.035 56.412 12.079 1.00 9.82 C ATOM 218 CG1 VAL E 30 47.449 55.002 12.002 1.00 11.04 C ATOM 219 CG2 VAL E 30 49.236 56.412 13.066 1.00 11.32 C ATOM 220 N ILE E 31 47.737 56.303 8.453 1.00 11.13 N ATOM 221 CA ILE E 31 46.835 56.263 7.283 1.00 11.69 C ATOM 222 C ILE E 31 46.170 54.908 7.376 1.00 11.30 C ATOM 223 O ILE E 31 46.804 53.885 7.130 1.00 11.17 O ATOM 224 CB ILE E 31 47.656 56.477 6.005 1.00 11.89 C ATOM 225 CG1 ILE E 31 48.237 57.917 5.983 1.00 13.23 C ATOM 226 CG2 ILE E 31 46.753 56.252 4.772 1.00 13.24 C ATOM 227 CD1 ILE E 31 48.868 58.345 4.626 1.00 14.04 C ATOM 228 N ASP E 32 44.912 54.920 7.829 1.00 11.15 N ATOM 229 CA ASP E 32 44.341 53.662 8.308 1.00 11.18 C ATOM 230 C ASP E 32 42.811 53.823 8.496 1.00 11.79 C ATOM 231 O ASP E 32 42.184 54.612 7.764 1.00 11.92 O ATOM 232 CB ASP E 32 45.067 53.319 9.626 1.00 11.35 C ATOM 233 CG ASP E 32 45.159 51.833 9.896 1.00 12.74 C ATOM 234 OD1 ASP E 32 44.057 51.224 10.084 1.00 12.92 O ATOM 235 OD2 ASP E 32 46.250 51.216 10.010 1.00 13.73 O ATOM 236 N SER E 33 42.215 53.126 9.450 1.00 11.28 N ATOM 237 CA SER E 33 40.756 53.090 9.612 1.00 11.84 C ATOM 238 C SER E 33 40.261 54.149 10.548 1.00 13.02 C ATOM 239 O SER E 33 39.114 54.079 11.017 1.00 13.06 O ATOM 240 CB SER E 33 40.345 51.678 10.094 1.00 13.36 C ATOM 241 OG SER E 33 40.718 51.459 11.475 1.00 12.61 O ATOM 242 N GLY E 34 41.105 55.146 10.847 1.00 11.95 N ATOM 243 CA GLY E 34 40.737 56.120 11.862 1.00 12.58 C ATOM 244 C GLY E 34 41.496 55.883 13.168 1.00 11.72 C ATOM 245 O GLY E 34 42.223 54.907 13.287 1.00 12.94 O ATOM 246 N ILE E 35 41.298 56.777 14.140 1.00 11.14 N ATOM 247 CA ILE E 35 41.874 56.584 15.487 1.00 11.64 C ATOM 248 C ILE E 35 40.850 57.032 16.493 1.00 13.50 C ATOM 249 O ILE E 35 40.369 58.160 16.419 1.00 13.59 O ATOM 250 CB ILE E 35 43.203 57.408 15.730 1.00 11.71 C ATOM 251 CG1 ILE E 35 44.274 57.135 14.653 1.00 11.27 C ATOM 252 CG2 ILE E 35 43.759 57.040 17.126 1.00 11.78 C ATOM 253 CD1 ILE E 35 45.532 58.049 14.813 1.00 11.63 C ATOM 254 N ASP E 36 40.547 56.191 17.467 1.00 12.58 N ATOM 255 CA ASP E 36 39.612 56.571 18.517 1.00 13.16 C ATOM 256 C ASP E 36 40.235 57.621 19.451 1.00 15.21 C ATOM 257 O ASP E 36 40.968 57.295 20.388 1.00 14.45 O ATOM 258 CB ASP E 36 39.174 55.351 19.328 1.00 13.76 C ATOM 259 CG ASP E 36 38.199 55.714 20.431 1.00 17.35 C ATOM 260 OD1 ASP E 36 37.791 56.895 20.566 1.00 18.33 O ATOM 261 OD2 ASP E 36 37.810 54.860 21.243 1.00 23.06 O ATOM 262 N SER E 37 39.918 58.881 19.193 1.00 16.68 N ATOM 263 CA SER E 37 40.535 59.998 19.920 1.00 18.13 C ATOM 264 C SER E 37 40.085 60.078 21.379 1.00 17.77 C ATOM 265 O SER E 37 40.777 60.736 22.175 1.00 21.26 O ATOM 266 CB SER E 37 40.274 61.348 19.218 1.00 18.57 C ATOM 267 OG SER E 37 38.899 61.658 19.244 1.00 21.98 O ATOM 268 N SER E 38 38.995 59.401 21.739 1.00 16.12 N ATOM 269 CA SER E 38 38.545 59.380 23.134 1.00 15.40 C ATOM 270 C SER E 38 39.352 58.418 24.020 1.00 14.02 C ATOM 271 O SER E 38 39.151 58.394 25.233 1.00 15.18 O ATOM 272 CB SER E 38 37.060 59.037 23.239 1.00 15.39 C ATOM 273 OG ASER E 38 36.882 57.684 22.931 0.50 15.55 O ATOM 274 OG BSER E 38 36.284 60.135 22.782 0.50 16.42 O ATOM 275 N HIS E 39 40.283 57.640 23.421 1.00 11.70 N ATOM 276 CA HIS E 39 41.034 56.702 24.241 1.00 11.69 C ATOM 277 C HIS E 39 41.967 57.489 25.202 1.00 11.25 C ATOM 278 O HIS E 39 42.725 58.313 24.731 1.00 11.93 O ATOM 279 CB HIS E 39 41.879 55.785 23.354 1.00 11.25 C ATOM 280 CG HIS E 39 42.298 54.540 24.054 1.00 10.92 C ATOM 281 ND1 HIS E 39 43.142 54.548 25.152 1.00 9.98 N ATOM 282 CD2 HIS E 39 41.943 53.241 23.856 1.00 10.86 C ATOM 283 CE1 HIS E 39 43.284 53.303 25.598 1.00 10.71 C ATOM 284 NE2 HIS E 39 42.602 52.491 24.798 1.00 10.20 N ATOM 285 N PRO E 40 41.945 57.217 26.506 1.00 10.40 N ATOM 286 CA PRO E 40 42.781 58.003 27.433 1.00 10.50 C ATOM 287 C PRO E 40 44.256 57.733 27.263 1.00 11.14 C ATOM 288 O PRO E 40 45.041 58.493 27.808 1.00 12.58 O ATOM 289 CB PRO E 40 42.344 57.535 28.821 1.00 11.19 C ATOM 290 CG PRO E 40 41.801 56.176 28.625 1.00 12.21 C ATOM 291 CD PRO E 40 41.115 56.193 27.216 1.00 11.60 C ATOM 292 N ASP E 41 44.625 56.689 26.545 1.00 9.25 N ATOM 293 CA ASP E 41 46.075 56.446 26.365 1.00 9.91 C ATOM 294 C ASP E 41 46.562 56.936 24.997 1.00 9.90 C ATOM 295 O ASP E 41 47.653 56.533 24.563 1.00 9.55 O ATOM 296 CB ASP E 41 46.379 54.952 26.578 1.00 10.49 C ATOM 297 CG ASP E 41 47.804 54.716 27.062 1.00 11.16 C ATOM 298 OD1 ASP E 41 48.355 55.577 27.737 1.00 11.67 O ATOM 299 OD2 ASP E 41 48.332 53.598 26.811 1.00 13.96 O ATOM 300 N LEU E 42 45.776 57.758 24.303 1.00 10.08 N ATOM 301 CA LEU E 42 46.148 58.362 23.005 1.00 10.68 C ATOM 302 C LEU E 42 45.873 59.834 23.035 1.00 11.36 C ATOM 303 O LEU E 42 44.850 60.259 23.644 1.00 12.82 O ATOM 304 CB LEU E 42 45.361 57.743 21.840 1.00 10.85 C ATOM 305 CG LEU E 42 45.586 56.257 21.606 1.00 10.51 C ATOM 306 CD1 LEU E 42 44.657 55.729 20.476 1.00 10.97 C ATOM 307 CD2 LEU E 42 47.032 55.977 21.186 1.00 11.81 C ATOM 308 N LYS E 43 46.720 60.579 22.370 1.00 11.56 N ATOM 309 CA LYS E 43 46.413 62.004 22.121 1.00 12.44 C ATOM 310 C LYS E 43 46.463 62.208 20.616 1.00 11.98 C ATOM 311 O LYS E 43 47.520 62.078 20.001 1.00 15.10 O ATOM 312 CB LYS E 43 47.417 62.922 22.836 1.00 13.63 C ATOM 313 CG LYS E 43 47.101 64.410 22.554 1.00 16.44 C ATOM 314 CD LYS E 43 48.166 65.231 23.307 1.00 24.84 C ATOM 315 CE LYS E 43 47.851 66.712 23.387 1.00 31.41 C ATOM 316 NZ LYS E 43 49.054 67.431 23.958 1.00 35.28 N ATOM 317 N VAL E 44 45.334 62.479 19.994 1.00 12.45 N ATOM 318 CA VAL E 44 45.292 62.705 18.554 1.00 12.82 C ATOM 319 C VAL E 44 45.350 64.215 18.282 1.00 14.74 C ATOM 320 O VAL E 44 44.531 64.974 18.811 1.00 16.19 O ATOM 321 CB VAL E 44 44.001 62.091 17.971 1.00 12.96 C ATOM 322 CG1 VAL E 44 43.954 62.340 16.481 1.00 15.21 C ATOM 323 CG2 VAL E 44 43.988 60.575 18.208 1.00 14.07 C ATOM 324 N ALA E 45 46.328 64.630 17.490 1.00 13.82 N ATOM 325 CA ALA E 45 46.586 66.053 17.258 1.00 14.22 C ATOM 326 C ALA E 45 45.729 66.601 16.113 1.00 15.85 C ATOM 327 O ALA E 45 45.577 67.821 16.005 1.00 16.92 O ATOM 328 CB ALA E 45 48.084 66.284 16.927 1.00 14.54 C ATOM 329 N GLY E 46 45.240 65.753 15.218 1.00 13.97 N ATOM 330 CA GLY E 46 44.506 66.246 14.048 1.00 14.20 C ATOM 331 C GLY E 46 44.254 65.110 13.098 1.00 14.22 C ATOM 332 O GLY E 46 44.473 63.930 13.463 1.00 13.12 O ATOM 333 N GLY E 47 43.784 65.436 11.906 1.00 14.72 N ATOM 334 CA GLY E 47 43.522 64.410 10.910 1.00 14.19 C ATOM 335 C GLY E 47 42.401 64.806 9.966 1.00 15.27 C ATOM 336 O GLY E 47 41.913 65.946 9.995 1.00 16.88 O ATOM 337 N ALA E 48 42.035 63.842 9.146 1.00 15.71 N ATOM 338 CA ALA E 48 41.025 64.055 8.112 1.00 14.52 C ATOM 339 C ALA E 48 40.554 62.709 7.643 1.00 14.81 C ATOM 340 O ALA E 48 41.309 61.739 7.670 1.00 14.52 O ATOM 341 CB ALA E 48 41.640 64.823 6.964 1.00 16.14 C ATOM 342 N SER E 49 39.310 62.631 7.150 1.00 15.70 N ATOM 343 CA SER E 49 38.825 61.390 6.559 1.00 16.93 C ATOM 344 C SER E 49 38.627 61.515 5.052 1.00 16.97 C ATOM 345 O SER E 49 38.036 62.487 4.580 1.00 18.98 O ATOM 346 CB SER E 49 37.486 60.984 7.156 1.00 16.44 C ATOM 347 OG SER E 49 37.029 59.827 6.452 1.00 17.01 O ATOM 348 N MET E 50 39.123 60.530 4.321 1.00 16.24 N ATOM 349 CA MET E 50 38.944 60.385 2.866 1.00 16.83 C ATOM 350 C MET E 50 37.880 59.316 2.523 1.00 17.90 C ATOM 351 O MET E 50 37.725 58.957 1.337 1.00 19.62 O ATOM 352 CB MET E 50 40.263 59.940 2.241 1.00 17.24 C ATOM 353 CG MET E 50 41.425 60.769 2.693 1.00 16.87 C ATOM 354 SD MET E 50 41.196 62.531 2.282 1.00 21.43 S ATOM 355 CE MET E 50 42.074 63.340 3.640 1.00 23.78 C ATOM 356 N VAL E 51 37.206 58.778 3.530 1.00 17.71 N ATOM 357 CA VAL E 51 36.173 57.745 3.318 1.00 19.23 C ATOM 358 C VAL E 51 34.812 58.444 3.147 1.00 20.45 C ATOM 359 O VAL E 51 34.323 59.060 4.100 1.00 19.77 O ATOM 360 CB VAL E 51 36.169 56.734 4.487 1.00 18.36 C ATOM 361 CG1 VAL E 51 35.023 55.687 4.325 1.00 17.92 C ATOM 362 CG2 VAL E 51 37.557 56.043 4.567 1.00 16.86 C ATOM 363 N PRO E 52 34.220 58.359 1.940 1.00 21.74 N ATOM 364 CA PRO E 52 32.993 59.123 1.652 1.00 23.05 C ATOM 365 C PRO E 52 31.856 58.880 2.652 1.00 23.12 C ATOM 366 O PRO E 52 31.195 59.836 3.059 1.00 23.90 O ATOM 367 CB PRO E 52 32.608 58.659 0.234 1.00 23.88 C ATOM 368 CG PRO E 52 33.894 58.209 -0.395 1.00 23.74 C ATOM 369 CD PRO E 52 34.706 57.626 0.755 1.00 22.03 C ATOM 370 N SER E 53 31.646 57.637 3.075 1.00 23.76 N ATOM 371 CA SER E 53 30.553 57.359 4.006 1.00 25.82 C ATOM 372 C SER E 53 30.906 57.400 5.527 1.00 25.52 C ATOM 373 O SER E 53 30.028 57.202 6.389 1.00 25.90 O ATOM 374 CB SER E 53 29.883 56.030 3.646 1.00 26.44 C ATOM 375 OG SER E 53 30.650 54.950 4.132 1.00 31.84 O ATOM 376 N GLU E 54 32.177 57.672 5.855 1.00 23.96 N ATOM 377 CA GLU E 54 32.605 57.758 7.255 1.00 23.34 C ATOM 378 C GLU E 54 33.464 59.021 7.427 1.00 23.19 C ATOM 379 O GLU E 54 34.702 58.947 7.322 1.00 23.40 O ATOM 380 CB GLU E 54 33.420 56.532 7.656 1.00 23.61 C ATOM 381 CG GLU E 54 32.621 55.250 7.733 1.00 25.12 C ATOM 382 CD GLU E 54 33.458 54.081 8.234 1.00 26.18 C ATOM 383 OE1 GLU E 54 34.435 54.313 9.012 1.00 28.29 O ATOM 384 OE2 GLU E 54 33.133 52.940 7.862 1.00 28.63 O ATOM 385 N THR E 55 32.832 60.153 7.688 1.00 22.95 N ATOM 386 CA THR E 55 33.495 61.451 7.576 1.00 22.48 C ATOM 387 C THR E 55 34.305 61.881 8.798 1.00 20.31 C ATOM 388 O THR E 55 34.964 62.938 8.763 1.00 21.07 O ATOM 389 CB THR E 55 32.467 62.584 7.248 1.00 22.90 C ATOM 390 OG1 THR E 55 31.487 62.640 8.295 1.00 25.23 O ATOM 391 CG2 THR E 55 31.691 62.257 5.976 1.00 25.83 C ATOM 392 N ASN E 56 34.213 61.108 9.884 1.00 18.99 N ATOM 393 CA ASN E 56 34.882 61.461 11.125 1.00 18.66 C ATOM 394 C ASN E 56 36.139 60.593 11.282 1.00 16.92 C ATOM 395 O ASN E 56 36.031 59.382 11.541 1.00 17.83 O ATOM 396 CB ASN E 56 33.943 61.271 12.327 1.00 18.12 C ATOM 397 CG ASN E 56 34.562 61.783 13.617 1.00 20.61 C ATOM 398 OD1 ASN E 56 35.734 62.174 13.637 1.00 20.56 O ATOM 399 ND2 ASN E 56 33.784 61.812 14.685 1.00 25.07 N ATOM 400 N PRO E 57 37.323 61.189 11.129 1.00 15.92 N ATOM 401 CA PRO E 57 38.560 60.377 11.257 1.00 15.41 C ATOM 402 C PRO E 57 38.845 59.940 12.702 1.00 15.53 C ATOM 403 O PRO E 57 39.727 59.105 12.904 1.00 14.64 O ATOM 404 CB PRO E 57 39.659 61.322 10.746 1.00 15.68 C ATOM 405 CG PRO E 57 39.122 62.713 11.138 1.00 14.77 C ATOM 406 CD PRO E 57 37.621 62.615 10.898 1.00 15.66 C ATOM 407 N PHE E 58 38.134 60.512 13.668 1.00 14.41 N ATOM 408 CA PHE E 58 38.357 60.256 15.097 1.00 15.34 C ATOM 409 C PHE E 58 37.409 59.208 15.662 1.00 15.36 C ATOM 410 O PHE E 58 37.330 59.018 16.886 1.00 16.95 O ATOM 411 CB PHE E 58 38.245 61.579 15.834 1.00 14.34 C ATOM 412 CG PHE E 58 39.074 62.688 15.198 1.00 17.10 C ATOM 413 CD1 PHE E 58 40.454 62.514 14.985 1.00 17.11 C ATOM 414 CD2 PHE E 58 38.480 63.886 14.786 1.00 18.37 C ATOM 415 CE1 PHE E 58 41.228 63.518 14.422 1.00 16.08 C ATOM 416 CE2 PHE E 58 39.252 64.906 14.212 1.00 17.94 C ATOM 417 CZ PHE E 58 40.642 64.725 14.028 1.00 17.24 C ATOM 418 N GLN E 59 36.660 58.573 14.766 1.00 16.30 N ATOM 419 CA GLN E 59 35.843 57.440 15.094 1.00 17.27 C ATOM 420 C GLN E 59 36.430 56.284 14.315 1.00 17.28 C ATOM 421 O GLN E 59 36.464 56.321 13.069 1.00 18.65 O ATOM 422 CB GLN E 59 34.391 57.692 14.642 1.00 18.61 C ATOM 423 CG GLN E 59 33.480 56.527 15.026 1.00 23.34 C ATOM 424 CD GLN E 59 32.030 56.875 14.928 1.00 34.05 C ATOM 425 OE1 GLN E 59 31.602 57.934 15.415 1.00 40.59 O ATOM 426 NE2 GLN E 59 31.247 55.989 14.307 1.00 37.45 N ATOM 427 N ASP E 60 36.870 55.253 15.023 1.00 15.14 N ATOM 428 CA ASP E 60 37.418 54.098 14.375 1.00 14.73 C ATOM 429 C ASP E 60 36.421 52.960 14.548 1.00 15.27 C ATOM 430 O ASP E 60 36.308 52.375 15.606 1.00 16.44 O ATOM 431 CB ASP E 60 38.780 53.769 15.026 1.00 14.20 C ATOM 432 CG ASP E 60 39.367 52.491 14.499 1.00 13.90 C ATOM 433 OD1 ASP E 60 38.852 51.902 13.501 1.00 12.86 O ATOM 434 OD2 ASP E 60 40.384 51.995 15.079 1.00 13.16 O ATOM 435 N ASN E 61 35.698 52.690 13.469 1.00 16.32 N ATOM 436 CA ASN E 61 34.666 51.656 13.465 1.00 17.49 C ATOM 437 C ASN E 61 35.207 50.276 13.174 1.00 18.14 C ATOM 438 O ASN E 61 34.448 49.308 13.093 1.00 18.97 O ATOM 439 CB ASN E 61 33.599 52.048 12.416 1.00 18.94 C ATOM 440 CG ASN E 61 32.924 53.335 12.767 1.00 20.80 C ATOM 441 OD1 ASN E 61 32.439 53.469 13.888 1.00 25.15 O ATOM 442 ND2 ASN E 61 32.912 54.293 11.837 1.00 25.25 N ATOM 443 N ASN E 62 36.523 50.148 12.985 1.00 14.65 N ATOM 444 CA ASN E 62 37.124 48.856 12.719 1.00 14.55 C ATOM 445 C ASN E 62 37.912 48.309 13.926 1.00 13.34 C ATOM 446 O ASN E 62 37.750 47.145 14.315 1.00 15.19 O ATOM 447 CB ASN E 62 38.052 48.997 11.508 1.00 13.64 C ATOM 448 CG ASN E 62 38.806 47.738 11.188 1.00 14.73 C ATOM 449 OD1 ASN E 62 39.735 47.338 11.903 1.00 13.75 O ATOM 450 ND2 ASN E 62 38.388 47.039 10.109 1.00 16.46 N ATOM 451 N SER E 63 38.801 49.168 14.455 1.00 12.91 N ATOM 452 CA SER E 63 39.704 48.959 15.638 1.00 12.54 C ATOM 453 C SER E 63 41.166 48.988 15.215 1.00 11.76 C ATOM 454 O SER E 63 42.042 49.274 16.038 1.00 11.33 O ATOM 455 CB SER E 63 39.436 47.656 16.438 1.00 11.88 C ATOM 456 OG SER E 63 39.967 46.538 15.766 1.00 14.89 O ATOM 457 N HIS E 64 41.422 48.719 13.951 1.00 11.47 N ATOM 458 CA HIS E 64 42.794 48.488 13.475 1.00 10.35 C ATOM 459 C HIS E 64 43.610 49.778 13.576 1.00 10.68 C ATOM 460 O HIS E 64 44.732 49.710 14.123 1.00 10.39 O ATOM 461 CB HIS E 64 42.702 47.991 12.048 1.00 11.38 C ATOM 462 CG HIS E 64 43.999 47.707 11.393 1.00 11.04 C ATOM 463 ND1 HIS E 64 44.707 48.656 10.682 1.00 11.97 N ATOM 464 CD2 HIS E 64 44.699 46.554 11.297 1.00 12.40 C ATOM 465 CE1 HIS E 64 45.790 48.086 10.172 1.00 10.85 C ATOM 466 NE2 HIS E 64 45.811 46.820 10.539 1.00 13.14 N ATOM 467 N GLY E 65 43.098 50.911 13.119 1.00 10.00 N ATOM 468 CA GLY E 65 43.902 52.135 13.171 1.00 10.34 C ATOM 469 C GLY E 65 44.216 52.551 14.602 1.00 9.81 C ATOM 470 O GLY E 65 45.282 53.166 14.852 1.00 10.43 O ATOM 471 N THR E 66 43.322 52.298 15.540 1.00 10.36 N ATOM 472 CA THR E 66 43.553 52.653 16.936 1.00 9.11 C ATOM 473 C THR E 66 44.683 51.776 17.487 1.00 10.43 C ATOM 474 O THR E 66 45.534 52.274 18.248 1.00 9.69 O ATOM 475 CB THR E 66 42.254 52.439 17.718 1.00 10.53 C ATOM 476 OG1 THR E 66 41.266 53.362 17.211 1.00 11.78 O ATOM 477 CG2 THR E 66 42.479 52.770 19.229 1.00 12.29 C ATOM 478 N HIS E 67 44.702 50.487 17.137 1.00 9.29 N ATOM 479 CA HIS E 67 45.753 49.592 17.594 1.00 9.23 C ATOM 480 C HIS E 67 47.118 50.072 17.007 1.00 8.89 C ATOM 481 O HIS E 67 48.130 50.203 17.757 1.00 8.38 O ATOM 482 CB HIS E 67 45.396 48.148 17.193 1.00 9.72 C ATOM 483 CG HIS E 67 46.246 47.134 17.867 1.00 9.03 C ATOM 484 ND1 HIS E 67 47.536 46.841 17.463 1.00 9.95 N ATOM 485 CD2 HIS E 67 45.998 46.348 18.946 1.00 8.43 C ATOM 486 CE1 HIS E 67 48.045 45.916 18.256 1.00 9.04 C ATOM 487 NE2 HIS E 67 47.132 45.598 19.166 1.00 8.92 N ATOM 488 N VAL E 68 47.166 50.300 15.705 1.00 9.06 N ATOM 489 CA VAL E 68 48.392 50.776 15.072 1.00 8.33 C ATOM 490 C VAL E 68 48.861 52.077 15.722 1.00 9.30 C ATOM 491 O VAL E 68 50.092 52.243 16.012 1.00 9.11 O ATOM 492 CB VAL E 68 48.141 50.968 13.544 1.00 8.82 C ATOM 493 CG1 VAL E 68 49.251 51.742 12.837 1.00 9.83 C ATOM 494 CG2 VAL E 68 47.878 49.589 12.857 1.00 9.95 C ATOM 495 N ALA E 69 47.934 53.003 15.947 1.00 9.02 N ATOM 496 CA ALA E 69 48.298 54.278 16.558 1.00 9.06 C ATOM 497 C ALA E 69 48.926 54.072 17.920 1.00 9.90 C ATOM 498 O ALA E 69 49.847 54.832 18.271 1.00 9.42 O ATOM 499 CB ALA E 69 47.025 55.172 16.677 1.00 10.08 C ATOM 500 N GLY E 70 48.413 53.147 18.753 1.00 8.76 N ATOM 501 CA GLY E 70 49.002 52.941 20.067 1.00 7.76 C ATOM 502 C GLY E 70 50.415 52.400 20.016 1.00 8.79 C ATOM 503 O GLY E 70 51.212 52.678 20.927 1.00 8.97 O ATOM 504 N THR E 71 50.739 51.608 18.993 1.00 9.15 N ATOM 505 CA THR E 71 52.118 51.128 18.900 1.00 8.05 C ATOM 506 C THR E 71 52.989 52.335 18.532 1.00 8.46 C ATOM 507 O THR E 71 54.079 52.460 19.089 1.00 8.15 O ATOM 508 CB THR E 71 52.200 50.053 17.851 1.00 8.62 C ATOM 509 OG1 THR E 71 51.480 48.908 18.336 1.00 9.92 O ATOM 510 CG2 THR E 71 53.618 49.571 17.672 1.00 8.61 C ATOM 511 N VAL E 72 52.521 53.227 17.654 1.00 8.56 N ATOM 512 CA VAL E 72 53.336 54.407 17.323 1.00 8.41 C ATOM 513 C VAL E 72 53.521 55.253 18.568 1.00 8.09 C ATOM 514 O VAL E 72 54.637 55.775 18.814 1.00 9.82 O ATOM 515 CB VAL E 72 52.673 55.258 16.229 1.00 8.03 C ATOM 516 CG1 VAL E 72 53.578 56.479 15.938 1.00 10.27 C ATOM 517 CG2 VAL E 72 52.460 54.441 14.951 1.00 9.35 C ATOM 518 N ALA E 73 52.422 55.550 19.276 1.00 8.65 N ATOM 519 CA ALA E 73 52.415 56.726 20.162 1.00 9.42 C ATOM 520 C ALA E 73 51.534 56.644 21.394 1.00 9.28 C ATOM 521 O ALA E 73 51.147 57.694 21.948 1.00 9.83 O ATOM 522 CB ALA E 73 52.036 57.956 19.313 1.00 10.45 C ATOM 523 N ALA E 74 51.196 55.454 21.875 1.00 8.87 N ATOM 524 CA ALA E 74 50.459 55.440 23.138 1.00 8.74 C ATOM 525 C ALA E 74 51.214 56.265 24.213 1.00 9.05 C ATOM 526 O ALA E 74 52.433 56.231 24.328 1.00 9.59 O ATOM 527 CB ALA E 74 50.178 53.998 23.632 1.00 8.80 C ATOM 528 N LEU E 75 50.462 56.999 25.000 1.00 8.57 N ATOM 529 CA LEU E 75 51.043 58.025 25.890 1.00 9.64 C ATOM 530 C LEU E 75 51.856 57.405 27.030 1.00 9.04 C ATOM 531 O LEU E 75 51.567 56.323 27.556 1.00 9.16 O ATOM 532 CB LEU E 75 49.916 58.842 26.509 1.00 9.87 C ATOM 533 CG LEU E 75 49.153 59.698 25.506 1.00 10.06 C ATOM 534 CD1 LEU E 75 47.931 60.308 26.231 1.00 10.39 C ATOM 535 CD2 LEU E 75 50.020 60.795 24.880 1.00 11.45 C ATOM 536 N ASN E 76 52.875 58.164 27.451 1.00 9.84 N ATOM 537 CA ASN E 76 53.684 57.827 28.619 1.00 9.77 C ATOM 538 C ASN E 76 53.044 58.401 29.864 1.00 10.11 C ATOM 539 O ASN E 76 53.021 59.628 30.114 1.00 11.76 O ATOM 540 CB ASN E 76 55.098 58.397 28.420 1.00 9.36 C ATOM 541 CG ASN E 76 56.010 58.013 29.546 1.00 11.29 C ATOM 542 OD1 ASN E 76 55.818 57.007 30.193 1.00 11.83 O ATOM 543 ND2 ASN E 76 57.059 58.843 29.780 1.00 12.07 N ATOM 544 N ASN E 77 52.445 57.505 30.634 1.00 10.24 N ATOM 545 CA ASN E 77 51.652 57.885 31.803 1.00 10.04 C ATOM 546 C ASN E 77 51.565 56.663 32.708 1.00 10.37 C ATOM 547 O ASN E 77 52.428 55.774 32.641 1.00 10.03 O ATOM 548 CB ASN E 77 50.281 58.424 31.380 1.00 10.77 C ATOM 549 CG ASN E 77 49.554 57.461 30.488 1.00 10.40 C ATOM 550 OD1 ASN E 77 49.870 56.284 30.455 1.00 10.14 O ATOM 551 ND2 ASN E 77 48.594 57.973 29.699 1.00 10.90 N ATOM 552 N SER E 78 50.556 56.586 33.582 1.00 10.75 N ATOM 553 CA SER E 78 50.457 55.472 34.496 1.00 11.21 C ATOM 554 C SER E 78 49.371 54.476 34.068 1.00 10.24 C ATOM 555 O SER E 78 48.880 53.672 34.893 1.00 12.22 O ATOM 556 CB SER E 78 50.253 55.940 35.971 1.00 12.04 C ATOM 557 OG SER E 78 49.000 56.644 36.078 1.00 16.18 O ATOM 558 N ILE E 79 49.009 54.494 32.784 1.00 10.30 N ATOM 559 CA ILE E 79 47.954 53.578 32.323 1.00 11.01 C ATOM 560 C ILE E 79 48.343 52.850 31.054 1.00 11.62 C ATOM 561 O ILE E 79 49.200 53.301 30.250 1.00 11.33 O ATOM 562 CB ILE E 79 46.608 54.290 32.093 1.00 12.20 C ATOM 563 CG1 ILE E 79 46.722 55.301 30.981 1.00 13.42 C ATOM 564 CG2 ILE E 79 46.146 54.946 33.410 1.00 13.36 C ATOM 565 CD1 ILE E 79 45.334 55.780 30.384 1.00 13.89 C ATOM 566 N GLY E 80 47.678 51.713 30.830 1.00 10.44 N ATOM 567 CA GLY E 80 47.685 51.119 29.503 1.00 10.64 C ATOM 568 C GLY E 80 49.046 50.686 29.045 1.00 10.70 C ATOM 569 O GLY E 80 49.793 50.091 29.811 1.00 11.45 O ATOM 570 N VAL E 81 49.337 51.002 27.788 1.00 10.51 N ATOM 571 CA VAL E 81 50.629 50.630 27.222 1.00 10.22 C ATOM 572 C VAL E 81 51.460 51.892 27.019 1.00 9.91 C ATOM 573 O VAL E 81 50.988 53.001 27.229 1.00 13.14 O ATOM 574 CB VAL E 81 50.428 49.848 25.904 1.00 11.33 C ATOM 575 CG1 VAL E 81 49.780 48.464 26.161 1.00 12.34 C ATOM 576 CG2 VAL E 81 49.557 50.628 24.885 1.00 10.90 C ATOM 577 N LEU E 82 52.705 51.700 26.623 1.00 10.72 N ATOM 578 CA LEU E 82 53.615 52.810 26.252 1.00 9.91 C ATOM 579 C LEU E 82 53.884 52.681 24.771 1.00 9.81 C ATOM 580 O LEU E 82 54.235 51.563 24.274 1.00 10.81 O ATOM 581 CB LEU E 82 54.900 52.630 27.021 1.00 8.76 C ATOM 582 CG LEU E 82 55.993 53.682 26.681 1.00 9.73 C ATOM 583 CD1 LEU E 82 55.545 55.083 27.097 1.00 11.01 C ATOM 584 CD2 LEU E 82 57.260 53.245 27.440 1.00 11.77 C ATOM 585 N GLY E 83 53.792 53.753 24.002 1.00 9.91 N ATOM 586 CA GLY E 83 54.121 53.734 22.600 1.00 9.26 C ATOM 587 C GLY E 83 55.616 53.817 22.323 1.00 8.86 C ATOM 588 O GLY E 83 56.384 54.196 23.223 1.00 9.12 O ATOM 589 N VAL E 84 55.983 53.500 21.088 1.00 8.45 N ATOM 590 CA VAL E 84 57.382 53.705 20.680 1.00 7.88 C ATOM 591 C VAL E 84 57.794 55.181 20.824 1.00 8.20 C ATOM 592 O VAL E 84 58.921 55.461 21.283 1.00 8.78 O ATOM 593 CB VAL E 84 57.635 53.172 19.254 1.00 8.51 C ATOM 594 CG1 VAL E 84 59.072 53.511 18.803 1.00 9.25 C ATOM 595 CG2 VAL E 84 57.452 51.595 19.254 1.00 9.99 C ATOM 596 N ALA E 85 56.921 56.084 20.376 1.00 8.23 N ATOM 597 CA ALA E 85 57.233 57.535 20.323 1.00 8.41 C ATOM 598 C ALA E 85 56.056 58.238 21.026 1.00 8.14 C ATOM 599 O ALA E 85 55.183 58.815 20.365 1.00 8.89 O ATOM 600 CB ALA E 85 57.376 58.008 18.821 1.00 8.96 C ATOM 601 N PRO E 86 56.040 58.141 22.351 1.00 7.99 N ATOM 602 CA PRO E 86 54.833 58.549 23.099 1.00 8.48 C ATOM 603 C PRO E 86 54.558 60.043 23.060 1.00 9.06 C ATOM 604 O PRO E 86 53.455 60.442 23.464 1.00 9.94 O ATOM 605 CB PRO E 86 55.125 58.076 24.525 1.00 9.99 C ATOM 606 CG PRO E 86 56.679 58.020 24.581 1.00 9.30 C ATOM 607 CD PRO E 86 57.091 57.542 23.219 1.00 8.96 C ATOM 608 N SER E 87 55.511 60.879 22.658 1.00 8.63 N ATOM 609 CA SER E 87 55.204 62.300 22.478 1.00 9.22 C ATOM 610 C SER E 87 54.928 62.721 21.066 1.00 10.18 C ATOM 611 O SER E 87 54.817 63.922 20.801 1.00 11.78 O ATOM 612 CB SER E 87 56.406 63.128 22.985 1.00 9.70 C ATOM 613 OG SER E 87 56.617 62.899 24.362 1.00 12.80 O ATOM 614 N ALA E 88 54.869 61.797 20.123 1.00 9.88 N ATOM 615 CA ALA E 88 54.637 62.201 18.732 1.00 10.02 C ATOM 616 C ALA E 88 53.313 62.908 18.567 1.00 10.41 C ATOM 617 O ALA E 88 52.371 62.642 19.328 1.00 12.18 O ATOM 618 CB ALA E 88 54.715 60.954 17.810 1.00 10.39 C ATOM 619 N SER E 89 53.240 63.779 17.576 1.00 10.57 N ATOM 620 CA SER E 89 51.977 64.447 17.203 1.00 10.25 C ATOM 621 C SER E 89 51.302 63.479 16.253 1.00 10.86 C ATOM 622 O SER E 89 51.785 63.265 15.125 1.00 10.90 O ATOM 623 CB SER E 89 52.273 65.767 16.488 1.00 11.98 C ATOM 624 OG SER E 89 52.788 66.668 17.487 1.00 13.72 O ATOM 625 N LEU E 90 50.215 62.864 16.705 1.00 11.28 N ATOM 626 CA LEU E 90 49.569 61.767 15.989 1.00 11.30 C ATOM 627 C LEU E 90 48.389 62.254 15.152 1.00 11.86 C ATOM 628 O LEU E 90 47.503 62.911 15.720 1.00 12.62 O ATOM 629 CB LEU E 90 49.082 60.799 17.082 1.00 13.87 C ATOM 630 CG LEU E 90 48.382 59.534 16.742 1.00 15.02 C ATOM 631 CD1 LEU E 90 49.427 58.634 15.996 1.00 16.49 C ATOM 632 CD2 LEU E 90 47.974 58.865 18.037 1.00 14.99 C ATOM 633 N TYR E 91 48.358 61.925 13.871 1.00 11.30 N ATOM 634 CA TYR E 91 47.270 62.354 12.996 1.00 10.96 C ATOM 635 C TYR E 91 46.489 61.166 12.457 1.00 12.15 C ATOM 636 O TYR E 91 47.058 60.205 11.948 1.00 12.16 O ATOM 637 CB TYR E 91 47.840 63.217 11.847 1.00 11.42 C ATOM 638 CG TYR E 91 48.401 64.528 12.354 1.00 11.56 C ATOM 639 CD1 TYR E 91 49.681 64.593 12.941 1.00 11.82 C ATOM 640 CD2 TYR E 91 47.625 65.674 12.338 1.00 13.82 C ATOM 641 CE1 TYR E 91 50.178 65.744 13.481 1.00 14.20 C ATOM 642 CE2 TYR E 91 48.129 66.864 12.873 1.00 14.38 C ATOM 643 CZ TYR E 91 49.413 66.869 13.424 1.00 15.62 C ATOM 644 OH TYR E 91 49.969 68.033 13.954 1.00 20.53 O ATOM 645 N ALA E 92 45.172 61.238 12.602 1.00 12.02 N ATOM 646 CA ALA E 92 44.283 60.176 12.125 1.00 11.79 C ATOM 647 C ALA E 92 43.888 60.487 10.666 1.00 12.51 C ATOM 648 O ALA E 92 43.092 61.423 10.432 1.00 12.99 O ATOM 649 CB ALA E 92 42.999 60.131 12.990 1.00 11.36 C ATOM 650 N VAL E 93 44.446 59.740 9.727 1.00 12.30 N ATOM 651 CA VAL E 93 44.139 59.942 8.297 1.00 12.52 C ATOM 652 C VAL E 93 43.358 58.722 7.846 1.00 12.22 C ATOM 653 O VAL E 93 43.911 57.669 7.502 1.00 13.58 O ATOM 654 CB VAL E 93 45.421 60.184 7.469 1.00 13.26 C ATOM 655 CG1 VAL E 93 45.064 60.425 5.990 1.00 14.13 C ATOM 656 CG2 VAL E 93 46.183 61.382 8.052 1.00 13.67 C ATOM 657 N LYS E 94 42.025 58.877 7.928 1.00 13.17 N ATOM 658 CA LYS E 94 41.145 57.732 7.705 1.00 13.53 C ATOM 659 C LYS E 94 40.935 57.493 6.206 1.00 14.07 C ATOM 660 O LYS E 94 40.360 58.366 5.524 1.00 14.24 O ATOM 661 CB LYS E 94 39.803 57.951 8.431 1.00 13.90 C ATOM 662 CG LYS E 94 38.880 56.754 8.215 1.00 16.13 C ATOM 663 CD LYS E 94 37.463 57.018 8.666 1.00 21.57 C ATOM 664 CE LYS E 94 37.252 56.644 10.059 1.00 24.57 C ATOM 665 NZ LYS E 94 35.754 56.566 10.378 1.00 22.14 N ATOM 666 N VAL E 95 41.409 56.356 5.711 1.00 13.18 N ATOM 667 CA VAL E 95 41.231 55.995 4.311 1.00 13.83 C ATOM 668 C VAL E 95 40.599 54.613 4.156 1.00 14.25 C ATOM 669 O VAL E 95 40.402 54.143 3.015 1.00 14.87 O ATOM 670 CB VAL E 95 42.583 56.007 3.578 1.00 13.17 C ATOM 671 CG1 VAL E 95 43.251 57.387 3.762 1.00 13.71 C ATOM 672 CG2 VAL E 95 43.513 54.870 4.080 1.00 14.48 C ATOM 673 N LEU E 96 40.333 53.952 5.294 1.00 13.86 N ATOM 674 CA LEU E 96 39.703 52.608 5.291 1.00 14.57 C ATOM 675 C LEU E 96 38.419 52.725 6.078 1.00 15.79 C ATOM 676 O LEU E 96 38.341 53.414 7.115 1.00 16.28 O ATOM 677 CB LEU E 96 40.601 51.548 5.970 1.00 13.76 C ATOM 678 CG LEU E 96 42.038 51.507 5.458 1.00 13.02 C ATOM 679 CD1 LEU E 96 42.847 50.472 6.245 1.00 14.24 C ATOM 680 CD2 LEU E 96 42.062 51.092 3.956 1.00 15.90 C ATOM 681 N GLY E 97 37.373 52.062 5.551 1.00 17.59 N ATOM 682 CA GLY E 97 36.118 52.031 6.276 1.00 17.93 C ATOM 683 C GLY E 97 36.080 50.942 7.336 1.00 18.92 C ATOM 684 O GLY E 97 37.088 50.222 7.575 1.00 19.18 O ATOM 685 N ALA E 98 34.900 50.793 7.953 1.00 18.03 N ATOM 686 CA ALA E 98 34.676 49.797 8.989 1.00 17.64 C ATOM 687 C ALA E 98 35.112 48.385 8.615 1.00 16.90 C ATOM 688 O ALA E 98 35.609 47.637 9.459 1.00 17.47 O ATOM 689 CB ALA E 98 33.179 49.790 9.420 1.00 17.23 C ATOM 690 N ASP E 99 34.944 48.009 7.336 1.00 16.79 N ATOM 691 CA ASP E 99 35.277 46.661 6.916 1.00 17.33 C ATOM 692 C ASP E 99 36.760 46.457 6.631 1.00 16.70 C ATOM 693 O ASP E 99 37.159 45.427 6.124 1.00 17.22 O ATOM 694 CB ASP E 99 34.390 46.181 5.738 1.00 18.97 C ATOM 695 CG ASP E 99 34.632 46.917 4.464 1.00 21.85 C ATOM 696 OD1 ASP E 99 35.611 47.727 4.323 1.00 20.58 O ATOM 697 OD2 ASP E 99 33.852 46.738 3.500 1.00 24.87 O ATOM 698 N GLY E 100 37.562 47.494 6.875 1.00 17.27 N ATOM 699 CA GLY E 100 38.995 47.334 6.722 1.00 16.21 C ATOM 700 C GLY E 100 39.526 47.562 5.318 1.00 16.04 C ATOM 701 O GLY E 100 40.708 47.310 5.048 1.00 14.72 O ATOM 702 N SER E 101 38.679 48.040 4.389 1.00 15.11 N ATOM 703 CA SER E 101 39.068 48.220 2.983 1.00 15.83 C ATOM 704 C SER E 101 38.881 49.673 2.572 1.00 15.67 C ATOM 705 O SER E 101 38.053 50.398 3.126 1.00 15.36 O ATOM 706 CB SER E 101 38.248 47.301 2.072 1.00 17.24 C ATOM 707 OG SER E 101 36.962 47.843 1.901 1.00 20.77 O ATOM 708 N GLY E 102 39.697 50.087 1.608 1.00 14.90 N ATOM 709 CA GLY E 102 39.505 51.355 0.945 1.00 16.40 C ATOM 710 C GLY E 102 39.857 51.295 -0.513 1.00 14.84 C ATOM 711 O GLY E 102 40.657 50.484 -0.985 1.00 15.91 O ATOM 712 N GLN E 103 39.273 52.245 -1.224 1.00 16.50 N ATOM 713 CA GLN E 103 39.625 52.412 -2.632 1.00 17.37 C ATOM 714 C GLN E 103 40.998 53.056 -2.790 1.00 17.62 C ATOM 715 O GLN E 103 41.402 53.836 -1.906 1.00 18.07 O ATOM 716 CB AGLN E 103 38.570 53.259 -3.333 0.50 17.98 C ATOM 717 CB BGLN E 103 38.567 53.287 -3.308 0.50 18.03 C ATOM 718 CG AGLN E 103 37.368 52.428 -3.782 0.50 20.43 C ATOM 719 CG BGLN E 103 37.187 52.601 -3.442 0.50 20.81 C ATOM 720 CD AGLN E 103 36.138 53.262 -4.063 0.50 23.93 C ATOM 721 CD BGLN E 103 37.181 51.462 -4.474 0.50 25.05 C ATOM 722 OE1AGLN E 103 36.216 54.300 -4.727 0.50 23.36 O ATOM 723 OE1BGLN E 103 37.983 51.446 -5.410 0.50 27.40 O ATOM 724 NE2AGLN E 103 34.996 52.816 -3.559 0.50 24.17 N ATOM 725 NE2BGLN E 103 36.279 50.508 -4.289 0.50 28.19 N ATOM 726 N TYR E 104 41.718 52.728 -3.873 1.00 16.50 N ATOM 727 CA TYR E 104 43.041 53.343 -4.127 1.00 16.46 C ATOM 728 C TYR E 104 42.978 54.876 -4.055 1.00 17.77 C ATOM 729 O TYR E 104 43.854 55.495 -3.459 1.00 16.81 O ATOM 730 CB TYR E 104 43.681 52.855 -5.449 1.00 17.32 C ATOM 731 CG TYR E 104 44.374 51.516 -5.363 1.00 20.14 C ATOM 732 CD1 TYR E 104 43.695 50.379 -4.914 1.00 22.64 C ATOM 733 CD2 TYR E 104 45.710 51.363 -5.758 1.00 20.98 C ATOM 734 CE1 TYR E 104 44.329 49.133 -4.843 1.00 23.63 C ATOM 735 CE2 TYR E 104 46.356 50.116 -5.687 1.00 22.83 C ATOM 736 CZ TYR E 104 45.654 49.014 -5.222 1.00 24.03 C ATOM 737 OH TYR E 104 46.234 47.751 -5.131 1.00 29.09 O ATOM 738 N SER E 105 41.942 55.493 -4.599 1.00 17.01 N ATOM 739 CA SER E 105 41.859 56.931 -4.576 1.00 18.61 C ATOM 740 C SER E 105 41.791 57.500 -3.143 1.00 17.87 C ATOM 741 O SER E 105 42.292 58.594 -2.896 1.00 16.83 O ATOM 742 CB SER E 105 40.672 57.429 -5.423 1.00 18.36 C ATOM 743 OG SER E 105 39.448 57.076 -4.818 1.00 21.32 O ATOM 744 N TRP E 106 41.130 56.791 -2.229 1.00 17.73 N ATOM 745 CA TRP E 106 41.038 57.222 -0.824 1.00 17.18 C ATOM 746 C TRP E 106 42.436 57.189 -0.189 1.00 17.10 C ATOM 747 O TRP E 106 42.838 58.152 0.470 1.00 16.89 O ATOM 748 CB TRP E 106 40.116 56.297 -0.033 1.00 18.08 C ATOM 749 CG TRP E 106 38.719 56.130 -0.595 1.00 18.78 C ATOM 750 CD1 TRP E 106 38.143 56.805 -1.674 1.00 20.21 C ATOM 751 CD2 TRP E 106 37.736 55.217 -0.114 1.00 18.84 C ATOM 752 NE1 TRP E 106 36.860 56.343 -1.853 1.00 21.00 N ATOM 753 CE2 TRP E 106 36.592 55.354 -0.934 1.00 19.69 C ATOM 754 CE3 TRP E 106 37.709 54.279 0.940 1.00 18.40 C ATOM 755 CZ2 TRP E 106 35.423 54.598 -0.721 1.00 20.67 C ATOM 756 CZ3 TRP E 106 36.551 53.527 1.154 1.00 20.92 C ATOM 757 CH2 TRP E 106 35.434 53.679 0.301 1.00 21.26 C ATOM 758 N ILE E 107 43.177 56.116 -0.444 1.00 15.67 N ATOM 759 CA ILE E 107 44.554 56.009 0.101 1.00 15.74 C ATOM 760 C ILE E 107 45.423 57.153 -0.459 1.00 16.05 C ATOM 761 O ILE E 107 46.153 57.858 0.305 1.00 14.16 O ATOM 762 CB ILE E 107 45.182 54.634 -0.186 1.00 16.43 C ATOM 763 CG1 ILE E 107 44.696 53.566 0.810 1.00 18.48 C ATOM 764 CG2 ILE E 107 46.721 54.640 0.015 1.00 17.85 C ATOM 765 CD1 ILE E 107 43.228 53.243 0.843 1.00 19.70 C ATOM 766 N ILE E 108 45.329 57.400 -1.766 1.00 15.20 N ATOM 767 CA ILE E 108 46.123 58.459 -2.391 1.00 15.72 C ATOM 768 C ILE E 108 45.702 59.797 -1.832 1.00 15.35 C ATOM 769 O ILE E 108 46.552 60.623 -1.515 1.00 15.92 O ATOM 770 CB ILE E 108 45.935 58.390 -3.941 1.00 16.88 C ATOM 771 CG1 ILE E 108 46.623 57.125 -4.446 1.00 15.93 C ATOM 772 CG2 ILE E 108 46.437 59.692 -4.665 1.00 16.37 C ATOM 773 CD1 ILE E 108 46.098 56.637 -5.869 1.00 17.94 C ATOM 774 N ASN E 109 44.406 60.046 -1.673 1.00 14.55 N ATOM 775 CA ASN E 109 43.980 61.299 -1.095 1.00 16.05 C ATOM 776 C ASN E 109 44.549 61.495 0.327 1.00 15.87 C ATOM 777 O ASN E 109 44.888 62.609 0.725 1.00 15.50 O ATOM 778 CB ASN E 109 42.453 61.439 -1.075 1.00 16.57 C ATOM 779 CG ASN E 109 41.863 61.716 -2.444 1.00 21.60 C ATOM 780 OD1 ASN E 109 42.566 62.117 -3.366 1.00 24.95 O ATOM 781 ND2 ASN E 109 40.564 61.442 -2.589 1.00 22.67 N ATOM 782 N GLY E 110 44.660 60.410 1.083 1.00 15.53 N ATOM 783 CA GLY E 110 45.220 60.522 2.433 1.00 13.78 C ATOM 784 C GLY E 110 46.727 60.813 2.375 1.00 13.60 C ATOM 785 O GLY E 110 47.203 61.616 3.209 1.00 13.12 O ATOM 786 N ILE E 111 47.456 60.182 1.453 1.00 14.19 N ATOM 787 CA ILE E 111 48.878 60.488 1.299 1.00 14.14 C ATOM 788 C ILE E 111 49.035 61.967 0.906 1.00 15.10 C ATOM 789 O ILE E 111 49.896 62.680 1.453 1.00 14.47 O ATOM 790 CB ILE E 111 49.525 59.574 0.261 1.00 15.02 C ATOM 791 CG1 ILE E 111 49.540 58.108 0.763 1.00 13.98 C ATOM 792 CG2 ILE E 111 50.925 60.060 -0.066 1.00 15.54 C ATOM 793 CD1 ILE E 111 49.650 57.037 -0.370 1.00 14.33 C ATOM 794 N GLU E 112 48.209 62.441 -0.033 1.00 14.68 N ATOM 795 CA GLU E 112 48.268 63.861 -0.424 1.00 15.00 C ATOM 796 C GLU E 112 47.943 64.815 0.730 1.00 15.35 C ATOM 797 O GLU E 112 48.607 65.847 0.881 1.00 15.72 O ATOM 798 CB GLU E 112 47.307 64.133 -1.625 1.00 16.99 C ATOM 799 CG GLU E 112 47.698 63.415 -2.912 1.00 18.02 C ATOM 800 CD GLU E 112 48.840 64.054 -3.681 1.00 26.56 C ATOM 801 OE1 GLU E 112 49.425 65.059 -3.218 1.00 25.02 O ATOM 802 OE2 GLU E 112 49.161 63.531 -4.786 1.00 31.88 O ATOM 803 N TRP E 113 46.969 64.470 1.570 1.00 14.36 N ATOM 804 CA TRP E 113 46.675 65.262 2.773 1.00 14.08 C ATOM 805 C TRP E 113 47.917 65.310 3.681 1.00 13.83 C ATOM 806 O TRP E 113 48.296 66.360 4.209 1.00 14.25 O ATOM 807 CB TRP E 113 45.456 64.702 3.534 1.00 13.74 C ATOM 808 CG TRP E 113 45.067 65.516 4.708 1.00 15.26 C ATOM 809 CD1 TRP E 113 44.116 66.495 4.733 1.00 17.32 C ATOM 810 CD2 TRP E 113 45.633 65.486 6.038 1.00 14.68 C ATOM 811 NE1 TRP E 113 44.038 67.060 5.980 1.00 17.50 N ATOM 812 CE2 TRP E 113 44.958 66.452 6.802 1.00 17.29 C ATOM 813 CE3 TRP E 113 46.658 64.724 6.659 1.00 15.21 C ATOM 814 CZ2 TRP E 113 45.257 66.695 8.163 1.00 19.04 C ATOM 815 CZ3 TRP E 113 46.961 64.973 8.028 1.00 15.86 C ATOM 816 CH2 TRP E 113 46.264 65.956 8.744 1.00 16.69 C ATOM 817 N ALA E 114 48.559 64.154 3.836 1.00 13.09 N ATOM 818 CA ALA E 114 49.726 64.110 4.707 1.00 13.58 C ATOM 819 C ALA E 114 50.844 65.010 4.197 1.00 13.82 C ATOM 820 O ALA E 114 51.496 65.695 4.994 1.00 13.85 O ATOM 821 CB ALA E 114 50.202 62.689 4.844 1.00 13.52 C ATOM 822 N ILE E 115 51.051 65.030 2.876 1.00 13.90 N ATOM 823 CA ILE E 115 52.090 65.880 2.289 1.00 14.93 C ATOM 824 C ILE E 115 51.699 67.344 2.505 1.00 15.67 C ATOM 825 O ILE E 115 52.527 68.157 2.954 1.00 16.60 O ATOM 826 CB ILE E 115 52.260 65.593 0.804 1.00 14.17 C ATOM 827 CG1 ILE E 115 52.723 64.146 0.580 1.00 16.65 C ATOM 828 CG2 ILE E 115 53.264 66.586 0.150 1.00 17.27 C ATOM 829 CD1 ILE E 115 52.616 63.746 -0.921 1.00 16.93 C ATOM 830 N ALA E 116 50.431 67.670 2.230 1.00 15.30 N ATOM 831 CA ALA E 116 49.993 69.081 2.313 1.00 16.62 C ATOM 832 C ALA E 116 50.033 69.606 3.752 1.00 17.44 C ATOM 833 O ALA E 116 50.142 70.832 4.002 1.00 17.78 O ATOM 834 CB ALA E 116 48.580 69.214 1.764 1.00 16.41 C ATOM 835 N ASN E 117 49.931 68.689 4.725 1.00 14.95 N ATOM 836 CA ASN E 117 49.925 69.051 6.133 1.00 15.88 C ATOM 837 C ASN E 117 51.255 68.828 6.857 1.00 13.96 C ATOM 838 O ASN E 117 51.322 68.849 8.091 1.00 14.78 O ATOM 839 CB ASN E 117 48.737 68.400 6.842 1.00 15.57 C ATOM 840 CG ASN E 117 47.433 69.055 6.462 1.00 18.85 C ATOM 841 OD1 ASN E 117 46.968 69.980 7.153 1.00 22.29 O ATOM 842 ND2 ASN E 117 46.860 68.626 5.345 1.00 17.17 N ATOM 843 N ASN E 118 52.290 68.640 6.057 1.00 14.63 N ATOM 844 CA ASN E 118 53.680 68.602 6.538 1.00 15.55 C ATOM 845 C ASN E 118 53.949 67.487 7.539 1.00 15.16 C ATOM 846 O ASN E 118 54.654 67.676 8.521 1.00 15.36 O ATOM 847 CB ASN E 118 54.134 69.969 7.116 1.00 18.04 C ATOM 848 CG ASN E 118 53.943 71.093 6.104 1.00 20.84 C ATOM 849 OD1 ASN E 118 54.459 71.047 5.007 1.00 23.41 O ATOM 850 ND2 ASN E 118 53.129 72.075 6.468 1.00 28.00 N ATOM 851 N MET E 119 53.382 66.310 7.269 1.00 13.54 N ATOM 852 CA MET E 119 53.706 65.148 8.097 1.00 12.03 C ATOM 853 C MET E 119 55.160 64.793 7.907 1.00 12.52 C ATOM 854 O MET E 119 55.667 64.839 6.789 1.00 14.91 O ATOM 855 CB MET E 119 52.859 63.943 7.674 1.00 11.32 C ATOM 856 CG MET E 119 51.358 64.156 7.943 1.00 14.00 C ATOM 857 SD MET E 119 50.881 64.338 9.691 1.00 13.12 S ATOM 858 CE MET E 119 50.385 66.091 9.724 1.00 12.36 C ATOM 859 N ASP E 120 55.805 64.385 8.999 1.00 11.25 N ATOM 860 CA ASP E 120 57.203 63.905 8.955 1.00 10.48 C ATOM 861 C ASP E 120 57.270 62.422 8.630 1.00 10.17 C ATOM 862 O ASP E 120 58.262 61.964 8.025 1.00 9.99 O ATOM 863 CB ASP E 120 57.901 64.169 10.292 1.00 11.21 C ATOM 864 CG ASP E 120 57.910 65.657 10.613 1.00 13.78 C ATOM 865 OD1 ASP E 120 58.527 66.403 9.797 1.00 15.04 O ATOM 866 OD2 ASP E 120 57.276 66.099 11.590 1.00 14.17 O ATOM 867 N VAL E 121 56.245 61.680 9.065 1.00 10.45 N ATOM 868 CA VAL E 121 56.266 60.213 8.921 1.00 9.77 C ATOM 869 C VAL E 121 54.849 59.778 8.535 1.00 10.35 C ATOM 870 O VAL E 121 53.883 60.326 9.061 1.00 10.82 O ATOM 871 CB VAL E 121 56.652 59.512 10.253 1.00 8.49 C ATOM 872 CG1 VAL E 121 56.704 57.962 10.057 1.00 9.33 C ATOM 873 CG2 VAL E 121 57.995 59.972 10.813 1.00 10.46 C ATOM 874 N ILE E 122 54.764 58.853 7.598 1.00 10.27 N ATOM 875 CA ILE E 122 53.498 58.172 7.281 1.00 10.08 C ATOM 876 C ILE E 122 53.640 56.691 7.614 1.00 10.35 C ATOM 877 O ILE E 122 54.629 56.066 7.228 1.00 10.75 O ATOM 878 CB ILE E 122 53.201 58.310 5.754 1.00 11.20 C ATOM 879 CG1 ILE E 122 52.735 59.735 5.460 1.00 12.14 C ATOM 880 CG2 ILE E 122 52.175 57.198 5.276 1.00 13.27 C ATOM 881 CD1 ILE E 122 52.625 60.037 3.931 1.00 13.83 C ATOM 882 N ASN E 123 52.640 56.167 8.335 1.00 10.41 N ATOM 883 CA ASN E 123 52.555 54.709 8.533 1.00 9.98 C ATOM 884 C ASN E 123 51.357 54.215 7.739 1.00 10.59 C ATOM 885 O ASN E 123 50.261 54.737 7.913 1.00 10.09 O ATOM 886 CB ASN E 123 52.355 54.356 9.988 1.00 10.33 C ATOM 887 CG ASN E 123 52.353 52.862 10.184 1.00 9.01 C ATOM 888 OD1 ASN E 123 53.406 52.258 10.301 1.00 10.52 O ATOM 889 ND2 ASN E 123 51.153 52.255 10.182 1.00 10.12 N ATOM 890 N MET E 124 51.587 53.222 6.890 1.00 11.69 N ATOM 891 CA MET E 124 50.526 52.519 6.152 1.00 11.07 C ATOM 892 C MET E 124 50.480 51.017 6.466 1.00 10.39 C ATOM 893 O MET E 124 51.168 50.206 5.798 1.00 10.84 O ATOM 894 CB MET E 124 50.684 52.701 4.654 1.00 11.47 C ATOM 895 CG MET E 124 50.182 54.113 4.290 1.00 12.15 C ATOM 896 SD MET E 124 50.247 54.485 2.510 1.00 14.88 S ATOM 897 CE MET E 124 51.811 54.584 2.334 1.00 13.60 C ATOM 898 N SER E 125 49.704 50.667 7.494 1.00 10.35 N ATOM 899 CA SER E 125 49.544 49.265 7.868 1.00 10.14 C ATOM 900 C SER E 125 48.469 48.606 6.985 1.00 11.40 C ATOM 901 O SER E 125 47.406 48.214 7.466 1.00 11.80 O ATOM 902 CB SER E 125 49.202 49.165 9.321 1.00 10.39 C ATOM 903 OG SER E 125 50.393 49.390 10.087 1.00 9.82 O ATOM 904 N LEU E 126 48.749 48.579 5.685 1.00 12.47 N ATOM 905 CA LEU E 126 47.712 48.220 4.714 1.00 12.97 C ATOM 906 C LEU E 126 48.408 47.797 3.438 1.00 14.44 C ATOM 907 O LEU E 126 49.619 48.019 3.257 1.00 14.43 O ATOM 908 CB LEU E 126 46.748 49.412 4.485 1.00 13.08 C ATOM 909 CG LEU E 126 47.328 50.828 4.274 1.00 13.42 C ATOM 910 CD1 LEU E 126 48.061 50.899 2.897 1.00 17.97 C ATOM 911 CD2 LEU E 126 46.219 51.875 4.341 1.00 16.82 C ATOM 912 N GLY E 127 47.659 47.154 2.546 1.00 15.52 N ATOM 913 CA GLY E 127 48.248 46.775 1.272 1.00 17.66 C ATOM 914 C GLY E 127 47.266 46.101 0.335 1.00 18.49 C ATOM 915 O GLY E 127 46.124 45.799 0.711 1.00 18.08 O ATOM 916 N GLY E 128 47.732 45.904 -0.901 1.00 18.89 N ATOM 917 CA GLY E 128 47.005 45.085 -1.877 1.00 19.68 C ATOM 918 C GLY E 128 48.002 44.488 -2.823 1.00 20.11 C ATOM 919 O GLY E 128 49.135 44.969 -2.931 1.00 19.18 O ATOM 920 N PRO E 129 47.611 43.420 -3.521 1.00 19.54 N ATOM 921 CA PRO E 129 48.557 42.681 -4.376 1.00 20.18 C ATOM 922 C PRO E 129 48.930 43.391 -5.666 1.00 21.23 C ATOM 923 O PRO E 129 49.923 42.937 -6.294 1.00 23.44 O ATOM 924 CB PRO E 129 47.782 41.415 -4.730 1.00 20.31 C ATOM 925 CG PRO E 129 46.370 41.805 -4.596 1.00 20.45 C ATOM 926 CD PRO E 129 46.286 42.765 -3.433 1.00 20.18 C ATOM 927 N SER E 130 48.191 44.415 -6.064 1.00 22.10 N ATOM 928 CA SER E 130 48.500 45.123 -7.303 1.00 25.66 C ATOM 929 C SER E 130 48.862 46.574 -7.031 1.00 26.74 C ATOM 930 O SER E 130 48.313 47.193 -6.116 1.00 29.36 O ATOM 931 CB SER E 130 47.316 45.075 -8.298 1.00 25.38 C ATOM 932 OG ASER E 130 46.131 45.595 -7.753 0.50 26.29 O ATOM 933 OG BSER E 130 46.839 43.758 -8.485 0.50 25.61 O ATOM 934 N GLY E 131 49.765 47.125 -7.819 1.00 28.00 N ATOM 935 CA GLY E 131 50.024 48.545 -7.669 1.00 27.30 C ATOM 936 C GLY E 131 49.111 49.355 -8.570 1.00 26.94 C ATOM 937 O GLY E 131 48.183 48.814 -9.214 1.00 27.23 O ATOM 938 N SER E 132 49.334 50.662 -8.589 1.00 24.52 N ATOM 939 CA SER E 132 48.815 51.515 -9.649 1.00 23.62 C ATOM 940 C SER E 132 49.822 52.636 -9.830 1.00 23.62 C ATOM 941 O SER E 132 50.570 52.976 -8.889 1.00 21.56 O ATOM 942 CB SER E 132 47.414 52.047 -9.347 1.00 23.69 C ATOM 943 OG SER E 132 47.431 53.143 -8.437 1.00 21.62 O ATOM 944 N ALA E 133 49.881 53.195 -11.033 1.00 23.49 N ATOM 945 CA ALA E 133 50.781 54.299 -11.283 1.00 22.13 C ATOM 946 C ALA E 133 50.495 55.482 -10.350 1.00 21.46 C ATOM 947 O ALA E 133 51.447 56.125 -9.886 1.00 20.95 O ATOM 948 CB ALA E 133 50.718 54.721 -12.796 1.00 22.20 C ATOM 949 N ALA E 134 49.215 55.749 -10.072 1.00 20.24 N ATOM 950 CA ALA E 134 48.812 56.854 -9.230 1.00 19.49 C ATOM 951 C ALA E 134 49.241 56.577 -7.775 1.00 18.58 C ATOM 952 O ALA E 134 49.647 57.506 -7.075 1.00 18.98 O ATOM 953 CB ALA E 134 47.279 57.102 -9.317 1.00 19.05 C ATOM 954 N LEU E 135 49.183 55.320 -7.344 1.00 18.79 N ATOM 955 CA LEU E 135 49.630 55.047 -5.965 1.00 18.23 C ATOM 956 C LEU E 135 51.140 55.238 -5.856 1.00 18.63 C ATOM 957 O LEU E 135 51.638 55.845 -4.877 1.00 16.49 O ATOM 958 CB LEU E 135 49.252 53.633 -5.555 1.00 17.61 C ATOM 959 CG LEU E 135 49.712 53.209 -4.148 1.00 17.25 C ATOM 960 CD1 LEU E 135 49.006 54.130 -3.123 1.00 17.71 C ATOM 961 CD2 LEU E 135 49.365 51.710 -3.902 1.00 18.83 C ATOM 962 N LYS E 136 51.879 54.680 -6.815 1.00 17.85 N ATOM 963 CA LYS E 136 53.321 54.857 -6.849 1.00 17.11 C ATOM 964 C LYS E 136 53.680 56.344 -6.899 1.00 17.20 C ATOM 965 O LYS E 136 54.625 56.792 -6.212 1.00 16.04 O ATOM 966 CB LYS E 136 53.955 54.111 -8.051 1.00 17.02 C ATOM 967 CG LYS E 136 55.496 54.086 -7.967 1.00 17.51 C ATOM 968 CD LYS E 136 56.178 53.408 -9.158 1.00 20.22 C ATOM 969 CE LYS E 136 57.657 53.233 -8.940 1.00 21.84 C ATOM 970 NZ LYS E 136 58.419 54.540 -8.884 1.00 22.99 N ATOM 971 N ALA E 137 52.949 57.138 -7.684 1.00 17.84 N ATOM 972 CA ALA E 137 53.277 58.562 -7.755 1.00 17.78 C ATOM 973 C ALA E 137 53.032 59.283 -6.408 1.00 16.72 C ATOM 974 O ALA E 137 53.797 60.187 -6.037 1.00 16.96 O ATOM 975 CB ALA E 137 52.463 59.222 -8.889 1.00 17.54 C ATOM 976 N ALA E 138 51.997 58.879 -5.663 1.00 16.65 N ATOM 977 CA ALA E 138 51.695 59.512 -4.367 1.00 15.70 C ATOM 978 C ALA E 138 52.792 59.189 -3.341 1.00 15.15 C ATOM 979 O ALA E 138 53.306 60.105 -2.665 1.00 14.22 O ATOM 980 CB ALA E 138 50.329 59.067 -3.866 1.00 16.70 C ATOM 981 N VAL E 139 53.167 57.920 -3.226 1.00 14.42 N ATOM 982 CA VAL E 139 54.269 57.611 -2.301 1.00 15.55 C ATOM 983 C VAL E 139 55.608 58.231 -2.731 1.00 15.58 C ATOM 984 O VAL E 139 56.337 58.751 -1.875 1.00 15.69 O ATOM 985 CB VAL E 139 54.387 56.092 -1.934 1.00 14.85 C ATOM 986 CG1 VAL E 139 53.105 55.590 -1.255 1.00 17.23 C ATOM 987 CG2 VAL E 139 54.787 55.222 -3.132 1.00 17.05 C ATOM 988 N ASP E 140 55.925 58.236 -4.037 1.00 15.53 N ATOM 989 CA ASP E 140 57.159 58.839 -4.490 1.00 15.99 C ATOM 990 C ASP E 140 57.127 60.331 -4.220 1.00 15.09 C ATOM 991 O ASP E 140 58.163 60.905 -3.880 1.00 16.05 O ATOM 992 CB ASP E 140 57.337 58.620 -6.007 1.00 16.85 C ATOM 993 CG ASP E 140 57.625 57.178 -6.379 1.00 20.99 C ATOM 994 OD1 ASP E 140 57.807 56.322 -5.478 1.00 18.41 O ATOM 995 OD2 ASP E 140 57.699 56.817 -7.590 1.00 19.51 O ATOM 996 N LYS E 141 55.974 60.965 -4.383 1.00 14.96 N ATOM 997 CA LYS E 141 55.847 62.394 -4.083 1.00 16.03 C ATOM 998 C LYS E 141 56.086 62.677 -2.598 1.00 15.26 C ATOM 999 O LYS E 141 56.750 63.665 -2.240 1.00 15.60 O ATOM 1000 CB LYS E 141 54.461 62.920 -4.513 1.00 16.53 C ATOM 1001 CG LYS E 141 54.242 64.431 -4.359 1.00 18.67 C ATOM 1002 CD LYS E 141 52.793 64.819 -4.676 1.00 22.13 C ATOM 1003 CE LYS E 141 52.500 66.291 -4.417 1.00 24.96 C ATOM 1004 NZ LYS E 141 51.133 66.606 -4.936 1.00 26.78 N ATOM 1005 N ALA E 142 55.516 61.820 -1.736 1.00 15.15 N ATOM 1006 CA ALA E 142 55.679 62.031 -0.287 1.00 14.03 C ATOM 1007 C ALA E 142 57.160 61.916 0.057 1.00 12.91 C ATOM 1008 O ALA E 142 57.693 62.772 0.787 1.00 13.06 O ATOM 1009 CB ALA E 142 54.824 61.010 0.515 1.00 14.35 C ATOM 1010 N VAL E 143 57.846 60.913 -0.474 1.00 12.06 N ATOM 1011 CA VAL E 143 59.272 60.758 -0.198 1.00 13.40 C ATOM 1012 C VAL E 143 60.080 61.921 -0.799 1.00 13.69 C ATOM 1013 O VAL E 143 60.992 62.447 -0.130 1.00 13.40 O ATOM 1014 CB VAL E 143 59.751 59.376 -0.672 1.00 13.40 C ATOM 1015 CG1 VAL E 143 61.255 59.234 -0.584 1.00 14.88 C ATOM 1016 CG2 VAL E 143 59.042 58.261 0.153 1.00 13.49 C ATOM 1017 N ALA E 144 59.740 62.380 -2.011 1.00 13.79 N ATOM 1018 CA ALA E 144 60.491 63.487 -2.609 1.00 13.68 C ATOM 1019 C ALA E 144 60.339 64.731 -1.772 1.00 15.10 C ATOM 1020 O ALA E 144 61.248 65.592 -1.761 1.00 16.46 O ATOM 1021 CB ALA E 144 60.012 63.755 -4.059 1.00 14.29 C ATOM 1022 N SER E 145 59.176 64.844 -1.127 1.00 13.83 N ATOM 1023 CA SER E 145 58.857 65.986 -0.263 1.00 15.21 C ATOM 1024 C SER E 145 59.448 65.886 1.142 1.00 14.16 C ATOM 1025 O SER E 145 59.269 66.802 1.920 1.00 15.18 O ATOM 1026 CB SER E 145 57.351 66.192 -0.142 1.00 16.21 C ATOM 1027 OG SER E 145 56.772 66.304 -1.429 1.00 21.43 O ATOM 1028 N GLY E 146 60.161 64.788 1.469 1.00 12.36 N ATOM 1029 CA GLY E 146 60.850 64.703 2.756 1.00 11.49 C ATOM 1030 C GLY E 146 60.188 63.786 3.800 1.00 11.16 C ATOM 1031 O GLY E 146 60.676 63.739 4.905 1.00 11.42 O ATOM 1032 N VAL E 147 59.067 63.151 3.436 1.00 11.15 N ATOM 1033 CA VAL E 147 58.322 62.293 4.397 1.00 10.84 C ATOM 1034 C VAL E 147 58.952 60.888 4.490 1.00 10.31 C ATOM 1035 O VAL E 147 59.286 60.291 3.459 1.00 11.73 O ATOM 1036 CB VAL E 147 56.854 62.135 3.979 1.00 11.45 C ATOM 1037 CG1 VAL E 147 56.080 61.339 5.099 1.00 11.46 C ATOM 1038 CG2 VAL E 147 56.204 63.502 3.677 1.00 12.91 C ATOM 1039 N VAL E 148 59.113 60.361 5.701 1.00 9.46 N ATOM 1040 CA VAL E 148 59.509 58.946 5.860 1.00 10.06 C ATOM 1041 C VAL E 148 58.226 58.125 5.684 1.00 9.79 C ATOM 1042 O VAL E 148 57.297 58.326 6.466 1.00 10.98 O ATOM 1043 CB VAL E 148 60.049 58.673 7.290 1.00 10.12 C ATOM 1044 CG1 VAL E 148 60.343 57.190 7.496 1.00 11.04 C ATOM 1045 CG2 VAL E 148 61.356 59.506 7.524 1.00 9.74 C ATOM 1046 N VAL E 149 58.222 57.220 4.725 1.00 10.09 N ATOM 1047 CA VAL E 149 57.011 56.432 4.432 1.00 10.15 C ATOM 1048 C VAL E 149 57.274 54.966 4.751 1.00 9.80 C ATOM 1049 O VAL E 149 58.198 54.350 4.211 1.00 11.06 O ATOM 1050 CB VAL E 149 56.554 56.579 2.939 1.00 10.80 C ATOM 1051 CG1 VAL E 149 55.239 55.807 2.771 1.00 12.27 C ATOM 1052 CG2 VAL E 149 56.316 58.064 2.618 1.00 13.95 C ATOM 1053 N VAL E 150 56.472 54.459 5.681 1.00 9.54 N ATOM 1054 CA VAL E 150 56.658 53.074 6.187 1.00 10.38 C ATOM 1055 C VAL E 150 55.369 52.313 5.916 1.00 10.39 C ATOM 1056 O VAL E 150 54.271 52.840 6.133 1.00 10.91 O ATOM 1057 CB VAL E 150 56.861 53.101 7.700 1.00 9.71 C ATOM 1058 CG1 VAL E 150 57.211 51.674 8.247 1.00 10.82 C ATOM 1059 CG2 VAL E 150 58.026 54.083 8.090 1.00 9.89 C ATOM 1060 N ALA E 151 55.486 51.052 5.493 1.00 10.49 N ATOM 1061 CA ALA E 151 54.278 50.247 5.265 1.00 10.60 C ATOM 1062 C ALA E 151 54.483 48.786 5.667 1.00 9.95 C ATOM 1063 O ALA E 151 55.614 48.272 5.666 1.00 11.79 O ATOM 1064 CB ALA E 151 53.831 50.350 3.776 1.00 10.22 C ATOM 1065 N ALA E 152 53.373 48.116 5.991 1.00 10.67 N ATOM 1066 CA ALA E 152 53.441 46.670 6.210 1.00 11.59 C ATOM 1067 C ALA E 152 53.873 45.947 4.922 1.00 11.35 C ATOM 1068 O ALA E 152 53.416 46.304 3.843 1.00 12.62 O ATOM 1069 CB ALA E 152 52.033 46.162 6.650 1.00 11.78 C ATOM 1070 N ALA E 153 54.676 44.910 5.069 1.00 11.41 N ATOM 1071 CA ALA E 153 55.065 44.129 3.889 1.00 12.12 C ATOM 1072 C ALA E 153 53.918 43.296 3.350 1.00 13.75 C ATOM 1073 O ALA E 153 53.881 43.056 2.134 1.00 14.98 O ATOM 1074 CB ALA E 153 56.237 43.228 4.219 1.00 12.95 C ATOM 1075 N GLY E 154 52.969 42.938 4.207 1.00 12.85 N ATOM 1076 CA GLY E 154 51.849 42.078 3.850 1.00 13.41 C ATOM 1077 C GLY E 154 51.968 40.767 4.603 1.00 11.54 C ATOM 1078 O GLY E 154 52.989 40.386 5.166 1.00 12.24 O ATOM 1079 N ASN E 155 50.844 40.028 4.585 1.00 12.91 N ATOM 1080 CA ASN E 155 50.755 38.776 5.311 1.00 13.29 C ATOM 1081 C ASN E 155 50.516 37.596 4.384 1.00 15.76 C ATOM 1082 O ASN E 155 49.684 36.723 4.703 1.00 16.62 O ATOM 1083 CB ASN E 155 49.601 38.818 6.329 1.00 14.12 C ATOM 1084 CG ASN E 155 49.739 39.952 7.348 1.00 13.12 C ATOM 1085 OD1 ASN E 155 50.859 40.375 7.694 1.00 13.16 O ATOM 1086 ND2 ASN E 155 48.612 40.385 7.869 1.00 13.00 N ATOM 1087 N GLU E 156 51.261 37.574 3.284 1.00 15.41 N ATOM 1088 CA GLU E 156 50.982 36.578 2.211 1.00 17.46 C ATOM 1089 C GLU E 156 51.879 35.371 2.324 1.00 19.70 C ATOM 1090 O GLU E 156 51.841 34.475 1.434 1.00 22.67 O ATOM 1091 CB GLU E 156 51.144 37.206 0.833 1.00 17.89 C ATOM 1092 CG GLU E 156 50.190 38.333 0.555 1.00 19.35 C ATOM 1093 CD GLU E 156 48.747 37.950 0.781 1.00 28.44 C ATOM 1094 OE1 GLU E 156 48.390 36.831 0.355 1.00 28.05 O ATOM 1095 OE2 GLU E 156 47.993 38.735 1.413 1.00 31.30 O ATOM 1096 N GLY E 157 52.723 35.317 3.346 1.00 18.94 N ATOM 1097 CA GLY E 157 53.549 34.148 3.617 1.00 19.91 C ATOM 1098 C GLY E 157 54.520 33.893 2.478 1.00 21.55 C ATOM 1099 O GLY E 157 54.918 34.828 1.795 1.00 20.46 O ATOM 1100 N THR E 158 54.858 32.627 2.228 1.00 23.18 N ATOM 1101 CA THR E 158 55.778 32.303 1.130 1.00 25.72 C ATOM 1102 C THR E 158 55.062 31.759 -0.108 1.00 27.13 C ATOM 1103 O THR E 158 53.914 31.289 -0.031 1.00 27.47 O ATOM 1104 CB THR E 158 56.846 31.280 1.562 1.00 25.85 C ATOM 1105 OG1 THR E 158 56.196 30.071 1.982 1.00 27.06 O ATOM 1106 CG2 THR E 158 57.589 31.730 2.796 1.00 26.37 C ATOM 1107 N SER E 159 55.741 31.821 -1.251 1.00 28.13 N ATOM 1108 CA SER E 159 55.188 31.233 -2.472 1.00 29.67 C ATOM 1109 C SER E 159 56.378 30.852 -3.324 1.00 29.06 C ATOM 1110 O SER E 159 56.662 31.505 -4.323 1.00 29.44 O ATOM 1111 CB SER E 159 54.289 32.238 -3.183 1.00 29.50 C ATOM 1112 OG SER E 159 53.775 31.693 -4.391 1.00 35.08 O ATOM 1113 N GLY E 160 57.113 29.845 -2.858 1.00 29.63 N ATOM 1114 CA GLY E 160 58.304 29.370 -3.528 1.00 30.47 C ATOM 1115 C GLY E 160 59.339 30.463 -3.603 1.00 30.79 C ATOM 1116 O GLY E 160 59.756 31.002 -2.577 1.00 31.48 O ATOM 1117 N SER E 161 59.748 30.809 -4.819 1.00 30.40 N ATOM 1118 CA SER E 161 60.785 31.815 -5.001 1.00 29.78 C ATOM 1119 C SER E 161 60.211 33.192 -5.329 1.00 28.46 C ATOM 1120 O SER E 161 60.975 34.123 -5.567 1.00 29.01 O ATOM 1121 CB SER E 161 61.769 31.355 -6.100 1.00 31.20 C ATOM 1122 OG ASER E 161 61.156 31.413 -7.380 0.67 31.34 O ATOM 1123 OG BSER E 161 62.572 30.277 -5.643 0.33 30.82 O ATOM 1124 N SER E 162 58.883 33.323 -5.334 1.00 26.39 N ATOM 1125 CA SER E 162 58.225 34.565 -5.739 1.00 24.90 C ATOM 1126 C SER E 162 58.169 35.543 -4.571 1.00 23.02 C ATOM 1127 O SER E 162 57.969 35.135 -3.426 1.00 22.72 O ATOM 1128 CB SER E 162 56.779 34.341 -6.166 1.00 25.91 C ATOM 1129 OG SER E 162 56.711 33.474 -7.303 1.00 31.08 O ATOM 1130 N SER E 163 58.290 36.823 -4.895 1.00 21.54 N ATOM 1131 CA SER E 163 58.000 37.854 -3.904 1.00 20.12 C ATOM 1132 C SER E 163 56.517 37.846 -3.569 1.00 20.11 C ATOM 1133 O SER E 163 55.672 37.733 -4.431 1.00 20.88 O ATOM 1134 CB SER E 163 58.377 39.220 -4.438 1.00 19.78 C ATOM 1135 OG SER E 163 57.906 40.227 -3.555 1.00 19.60 O ATOM 1136 N THR E 164 56.184 38.031 -2.295 1.00 17.52 N ATOM 1137 CA THR E 164 54.795 38.185 -1.918 1.00 17.55 C ATOM 1138 C THR E 164 54.532 39.511 -1.171 1.00 17.05 C ATOM 1139 O THR E 164 53.464 39.713 -0.584 1.00 16.83 O ATOM 1140 CB THR E 164 54.313 37.039 -1.029 1.00 18.18 C ATOM 1141 OG1 THR E 164 55.048 37.038 0.199 1.00 16.33 O ATOM 1142 CG2 THR E 164 54.623 35.638 -1.677 1.00 18.99 C ATOM 1143 N VAL E 165 55.481 40.431 -1.270 1.00 17.19 N ATOM 1144 CA VAL E 165 55.296 41.744 -0.676 1.00 15.48 C ATOM 1145 C VAL E 165 54.220 42.510 -1.462 1.00 16.07 C ATOM 1146 O VAL E 165 54.278 42.572 -2.721 1.00 17.54 O ATOM 1147 CB VAL E 165 56.663 42.524 -0.667 1.00 14.61 C ATOM 1148 CG1 VAL E 165 56.478 43.967 -0.150 1.00 14.61 C ATOM 1149 CG2 VAL E 165 57.737 41.775 0.134 1.00 16.58 C ATOM 1150 N GLY E 166 53.247 43.090 -0.756 1.00 16.52 N ATOM 1151 CA GLY E 166 52.216 43.869 -1.393 1.00 16.30 C ATOM 1152 C GLY E 166 52.582 45.336 -1.541 1.00 15.70 C ATOM 1153 O GLY E 166 53.659 45.775 -1.101 1.00 15.01 O ATOM 1154 N TYR E 167 51.679 46.069 -2.170 1.00 15.09 N ATOM 1155 CA TYR E 167 51.811 47.498 -2.410 1.00 15.75 C ATOM 1156 C TYR E 167 51.022 48.250 -1.341 1.00 15.84 C ATOM 1157 O TYR E 167 49.914 47.838 -0.962 1.00 15.17 O ATOM 1158 CB TYR E 167 51.198 47.820 -3.785 1.00 15.78 C ATOM 1159 CG TYR E 167 51.991 47.209 -4.933 1.00 17.19 C ATOM 1160 CD1 TYR E 167 53.048 47.882 -5.518 1.00 18.59 C ATOM 1161 CD2 TYR E 167 51.659 45.949 -5.431 1.00 20.57 C ATOM 1162 CE1 TYR E 167 53.779 47.294 -6.586 1.00 20.06 C ATOM 1163 CE2 TYR E 167 52.363 45.372 -6.522 1.00 20.00 C ATOM 1164 CZ TYR E 167 53.414 46.064 -7.074 1.00 23.28 C ATOM 1165 OH TYR E 167 54.117 45.488 -8.123 1.00 26.26 O ATOM 1166 N PRO E 168 51.482 49.398 -0.873 1.00 14.65 N ATOM 1167 CA PRO E 168 52.626 50.164 -1.396 1.00 14.47 C ATOM 1168 C PRO E 168 54.003 49.739 -0.865 1.00 13.80 C ATOM 1169 O PRO E 168 55.027 50.292 -1.323 1.00 13.73 O ATOM 1170 CB PRO E 168 52.275 51.617 -0.968 1.00 15.22 C ATOM 1171 CG PRO E 168 51.506 51.441 0.345 1.00 14.75 C ATOM 1172 CD PRO E 168 50.694 50.138 0.124 1.00 15.63 C ATOM 1173 N GLY E 169 54.039 48.774 0.054 1.00 12.74 N ATOM 1174 CA GLY E 169 55.315 48.277 0.573 1.00 13.70 C ATOM 1175 C GLY E 169 56.336 47.964 -0.518 1.00 14.00 C ATOM 1176 O GLY E 169 57.530 48.260 -0.382 1.00 13.74 O ATOM 1177 N LYS E 170 55.860 47.347 -1.620 1.00 14.68 N ATOM 1178 CA LYS E 170 56.724 46.836 -2.677 1.00 15.53 C ATOM 1179 C LYS E 170 57.445 47.952 -3.472 1.00 15.04 C ATOM 1180 O LYS E 170 58.465 47.678 -4.098 1.00 16.57 O ATOM 1181 CB LYS E 170 55.875 45.927 -3.587 1.00 15.83 C ATOM 1182 CG LYS E 170 56.731 44.993 -4.443 1.00 18.56 C ATOM 1183 CD LYS E 170 55.867 44.057 -5.290 1.00 22.25 C ATOM 1184 CE LYS E 170 56.734 43.097 -6.077 1.00 26.77 C ATOM 1185 NZ LYS E 170 55.813 42.090 -6.724 1.00 30.25 N ATOM 1186 N TYR E 171 56.947 49.193 -3.379 1.00 13.67 N ATOM 1187 CA TYR E 171 57.597 50.312 -4.097 1.00 14.41 C ATOM 1188 C TYR E 171 58.940 50.630 -3.436 1.00 15.61 C ATOM 1189 O TYR E 171 59.016 50.743 -2.192 1.00 14.94 O ATOM 1190 CB TYR E 171 56.703 51.549 -4.093 1.00 15.64 C ATOM 1191 CG TYR E 171 55.476 51.376 -4.926 1.00 14.96 C ATOM 1192 CD1 TYR E 171 55.560 50.930 -6.255 1.00 18.79 C ATOM 1193 CD2 TYR E 171 54.221 51.655 -4.401 1.00 15.53 C ATOM 1194 CE1 TYR E 171 54.421 50.746 -7.010 1.00 17.68 C ATOM 1195 CE2 TYR E 171 53.066 51.490 -5.156 1.00 16.05 C ATOM 1196 CZ TYR E 171 53.178 51.079 -6.469 1.00 16.22 C ATOM 1197 OH TYR E 171 52.032 50.914 -7.227 1.00 20.90 O ATOM 1198 N PRO E 172 60.002 50.823 -4.214 1.00 15.13 N ATOM 1199 CA PRO E 172 61.302 51.165 -3.611 1.00 14.89 C ATOM 1200 C PRO E 172 61.278 52.398 -2.696 1.00 13.94 C ATOM 1201 O PRO E 172 62.077 52.408 -1.753 1.00 14.35 O ATOM 1202 CB PRO E 172 62.204 51.442 -4.834 1.00 16.17 C ATOM 1203 CG PRO E 172 61.596 50.555 -5.927 1.00 18.90 C ATOM 1204 CD PRO E 172 60.105 50.648 -5.691 1.00 16.72 C ATOM 1205 N SER E 173 60.382 53.360 -2.923 1.00 13.99 N ATOM 1206 CA SER E 173 60.391 54.557 -2.067 1.00 14.41 C ATOM 1207 C SER E 173 59.847 54.324 -0.643 1.00 13.93 C ATOM 1208 O SER E 173 60.034 55.187 0.218 1.00 13.14 O ATOM 1209 CB SER E 173 59.690 55.716 -2.731 1.00 14.53 C ATOM 1210 OG SER E 173 58.315 55.420 -2.832 1.00 16.66 O ATOM 1211 N VAL E 174 59.197 53.173 -0.428 1.00 12.81 N ATOM 1212 CA VAL E 174 58.499 52.853 0.822 1.00 12.82 C ATOM 1213 C VAL E 174 59.313 51.812 1.572 1.00 11.95 C ATOM 1214 O VAL E 174 59.840 50.850 0.966 1.00 13.50 O ATOM 1215 CB VAL E 174 57.091 52.288 0.491 1.00 12.67 C ATOM 1216 CG1 VAL E 174 56.393 51.820 1.749 1.00 12.52 C ATOM 1217 CG2 VAL E 174 56.226 53.347 -0.207 1.00 13.39 C ATOM 1218 N ILE E 175 59.430 51.996 2.877 1.00 11.27 N ATOM 1219 CA ILE E 175 60.086 50.993 3.713 1.00 11.39 C ATOM 1220 C ILE E 175 59.083 49.886 4.017 1.00 11.99 C ATOM 1221 O ILE E 175 58.122 50.122 4.714 1.00 11.74 O ATOM 1222 CB ILE E 175 60.542 51.634 5.036 1.00 11.13 C ATOM 1223 CG1 ILE E 175 61.598 52.716 4.771 1.00 13.11 C ATOM 1224 CG2 ILE E 175 61.070 50.564 6.012 1.00 12.73 C ATOM 1225 CD1 ILE E 175 61.741 53.671 5.970 1.00 11.79 C ATOM 1226 N ALA E 176 59.328 48.677 3.474 1.00 11.44 N ATOM 1227 CA ALA E 176 58.414 47.537 3.723 1.00 12.06 C ATOM 1228 C ALA E 176 58.882 46.745 4.931 1.00 10.90 C ATOM 1229 O ALA E 176 60.030 46.289 5.047 1.00 11.00 O ATOM 1230 CB ALA E 176 58.386 46.598 2.488 1.00 11.72 C ATOM 1231 N VAL E 177 57.958 46.554 5.867 1.00 11.02 N ATOM 1232 CA VAL E 177 58.293 45.968 7.170 1.00 11.17 C ATOM 1233 C VAL E 177 57.631 44.597 7.378 1.00 11.06 C ATOM 1234 O VAL E 177 56.403 44.472 7.337 1.00 10.89 O ATOM 1235 CB VAL E 177 57.803 46.899 8.314 1.00 10.13 C ATOM 1236 CG1 VAL E 177 58.238 46.360 9.642 1.00 10.19 C ATOM 1237 CG2 VAL E 177 58.386 48.346 8.087 1.00 10.71 C ATOM 1238 N GLY E 178 58.468 43.591 7.619 1.00 10.02 N ATOM 1239 CA GLY E 178 57.947 42.246 7.938 1.00 11.52 C ATOM 1240 C GLY E 178 57.844 42.025 9.445 1.00 11.59 C ATOM 1241 O GLY E 178 58.283 42.860 10.249 1.00 11.13 O ATOM 1242 N ALA E 179 57.278 40.900 9.857 1.00 11.53 N ATOM 1243 CA ALA E 179 56.990 40.631 11.266 1.00 11.77 C ATOM 1244 C ALA E 179 57.778 39.505 11.833 1.00 12.36 C ATOM 1245 O ALA E 179 57.846 38.409 11.213 1.00 12.35 O ATOM 1246 CB ALA E 179 55.522 40.304 11.426 1.00 10.90 C ATOM 1247 N VAL E 180 58.377 39.728 12.993 1.00 11.31 N ATOM 1248 CA VAL E 180 58.964 38.666 13.796 1.00 11.84 C ATOM 1249 C VAL E 180 58.261 38.548 15.148 1.00 12.13 C ATOM 1250 O VAL E 180 57.446 39.402 15.530 1.00 12.09 O ATOM 1251 CB VAL E 180 60.473 38.866 14.043 1.00 10.83 C ATOM 1252 CG1 VAL E 180 61.295 38.738 12.751 1.00 12.70 C ATOM 1253 CG2 VAL E 180 60.744 40.226 14.771 1.00 11.31 C ATOM 1254 N ASP E 181 58.501 37.413 15.834 1.00 13.23 N ATOM 1255 CA ASP E 181 58.005 37.277 17.188 1.00 13.51 C ATOM 1256 C ASP E 181 59.053 37.651 18.229 1.00 13.40 C ATOM 1257 O ASP E 181 60.112 38.218 17.871 1.00 13.48 O ATOM 1258 CB ASP E 181 57.454 35.854 17.396 1.00 14.65 C ATOM 1259 CG ASP E 181 58.510 34.811 17.292 1.00 18.00 C ATOM 1260 OD1 ASP E 181 59.716 35.106 17.434 1.00 16.40 O ATOM 1261 OD2 ASP E 181 58.166 33.597 17.129 1.00 20.90 O ATOM 1262 N SER E 182 58.789 37.394 19.518 1.00 13.84 N ATOM 1263 CA SER E 182 59.737 37.799 20.563 1.00 15.78 C ATOM 1264 C SER E 182 61.065 37.062 20.559 1.00 16.41 C ATOM 1265 O SER E 182 62.004 37.483 21.279 1.00 17.71 O ATOM 1266 CB SER E 182 59.125 37.665 21.979 1.00 17.29 C ATOM 1267 OG SER E 182 58.760 36.290 22.223 1.00 20.40 O ATOM 1268 N SER E 183 61.144 35.960 19.798 1.00 16.82 N ATOM 1269 CA SER E 183 62.392 35.225 19.632 1.00 17.48 C ATOM 1270 C SER E 183 63.111 35.600 18.356 1.00 16.91 C ATOM 1271 O SER E 183 64.105 34.954 17.955 1.00 17.59 O ATOM 1272 CB SER E 183 62.115 33.705 19.627 1.00 18.95 C ATOM 1273 OG ASER E 183 61.455 33.338 20.826 0.67 20.21 O ATOM 1274 OG BSER E 183 61.537 33.314 18.407 0.33 18.62 O ATOM 1275 N ASN E 184 62.623 36.660 17.682 1.00 15.34 N ATOM 1276 CA ASN E 184 63.184 37.051 16.389 1.00 16.00 C ATOM 1277 C ASN E 184 62.947 36.092 15.228 1.00 15.78 C ATOM 1278 O ASN E 184 63.579 36.208 14.184 1.00 17.44 O ATOM 1279 CB ASN E 184 64.678 37.428 16.473 1.00 15.83 C ATOM 1280 CG ASN E 184 64.897 38.779 17.154 1.00 18.86 C ATOM 1281 OD1 ASN E 184 63.978 39.584 17.220 1.00 19.64 O ATOM 1282 ND2 ASN E 184 66.121 39.036 17.616 1.00 22.09 N ATOM 1283 N GLN E 185 61.971 35.194 15.378 1.00 15.91 N ATOM 1284 CA GLN E 185 61.622 34.306 14.282 1.00 17.06 C ATOM 1285 C GLN E 185 60.579 34.979 13.415 1.00 15.39 C ATOM 1286 O GLN E 185 59.634 35.556 13.927 1.00 14.36 O ATOM 1287 CB GLN E 185 61.026 33.003 14.850 1.00 18.50 C ATOM 1288 CG GLN E 185 62.010 32.046 15.405 1.00 28.17 C ATOM 1289 CD GLN E 185 62.761 31.360 14.275 1.00 37.19 C ATOM 1290 OE1 GLN E 185 62.142 30.738 13.396 1.00 42.26 O ATOM 1291 NE2 GLN E 185 64.085 31.517 14.261 1.00 40.10 N ATOM 1292 N ARG E 186 60.720 34.865 12.106 1.00 15.03 N ATOM 1293 CA ARG E 186 59.740 35.368 11.195 1.00 16.18 C ATOM 1294 C ARG E 186 58.404 34.727 11.488 1.00 15.26 C ATOM 1295 O ARG E 186 58.345 33.499 11.652 1.00 17.65 O ATOM 1296 CB ARG E 186 60.238 35.004 9.801 1.00 17.90 C ATOM 1297 CG ARG E 186 59.364 35.297 8.734 1.00 20.29 C ATOM 1298 CD ARG E 186 59.876 34.670 7.405 1.00 19.65 C ATOM 1299 NE ARG E 186 58.699 34.705 6.614 1.00 19.00 N ATOM 1300 CZ ARG E 186 57.875 33.682 6.461 1.00 19.18 C ATOM 1301 NH1 ARG E 186 58.178 32.487 6.953 1.00 20.92 N ATOM 1302 NH2 ARG E 186 56.772 33.851 5.786 1.00 19.27 N ATOM 1303 N ALA E 187 57.350 35.521 11.559 1.00 14.85 N ATOM 1304 CA ALA E 187 55.995 34.984 11.625 1.00 15.56 C ATOM 1305 C ALA E 187 55.683 34.242 10.329 1.00 15.93 C ATOM 1306 O ALA E 187 56.039 34.690 9.239 1.00 14.89 O ATOM 1307 CB ALA E 187 54.994 36.122 11.836 1.00 16.65 C ATOM 1308 N SER E 188 55.010 33.087 10.452 1.00 17.69 N ATOM 1309 CA SER E 188 54.671 32.285 9.253 1.00 19.02 C ATOM 1310 C SER E 188 53.921 33.065 8.173 1.00 17.88 C ATOM 1311 O SER E 188 54.086 32.802 6.984 1.00 19.39 O ATOM 1312 CB SER E 188 53.846 31.049 9.676 1.00 20.01 C ATOM 1313 OG SER E 188 52.595 31.464 10.216 1.00 25.27 O ATOM 1314 N PHE E 189 53.082 34.042 8.556 1.00 16.83 N ATOM 1315 CA PHE E 189 52.337 34.822 7.604 1.00 15.52 C ATOM 1316 C PHE E 189 53.132 35.963 6.952 1.00 14.57 C ATOM 1317 O PHE E 189 52.622 36.565 6.020 1.00 15.83 O ATOM 1318 CB PHE E 189 51.052 35.399 8.234 1.00 16.12 C ATOM 1319 CG PHE E 189 51.307 36.269 9.461 1.00 16.25 C ATOM 1320 CD1 PHE E 189 51.837 37.568 9.320 1.00 14.51 C ATOM 1321 CD2 PHE E 189 51.073 35.753 10.749 1.00 16.83 C ATOM 1322 CE1 PHE E 189 52.107 38.335 10.441 1.00 15.97 C ATOM 1323 CE2 PHE E 189 51.339 36.509 11.886 1.00 17.60 C ATOM 1324 CZ PHE E 189 51.856 37.805 11.735 1.00 16.33 C ATOM 1325 N SER E 190 54.324 36.280 7.467 1.00 14.63 N ATOM 1326 CA SER E 190 54.981 37.539 7.031 1.00 14.50 C ATOM 1327 C SER E 190 55.394 37.410 5.556 1.00 14.38 C ATOM 1328 O SER E 190 56.033 36.426 5.190 1.00 15.24 O ATOM 1329 CB SER E 190 56.172 37.808 7.954 1.00 15.32 C ATOM 1330 OG SER E 190 56.803 39.040 7.537 1.00 13.82 O ATOM 1331 N SER E 191 55.034 38.366 4.713 1.00 12.93 N ATOM 1332 CA SER E 191 55.428 38.367 3.292 1.00 14.47 C ATOM 1333 C SER E 191 56.917 38.359 3.120 1.00 15.23 C ATOM 1334 O SER E 191 57.665 38.787 4.002 1.00 16.56 O ATOM 1335 CB SER E 191 54.838 39.562 2.563 1.00 13.92 C ATOM 1336 OG SER E 191 53.462 39.364 2.315 1.00 14.29 O ATOM 1337 N VAL E 192 57.357 37.908 1.948 1.00 15.81 N ATOM 1338 CA VAL E 192 58.764 37.673 1.667 1.00 16.12 C ATOM 1339 C VAL E 192 59.106 38.212 0.288 1.00 15.88 C ATOM 1340 O VAL E 192 58.239 38.502 -0.536 1.00 16.37 O ATOM 1341 CB VAL E 192 59.170 36.168 1.752 1.00 17.09 C ATOM 1342 CG1 VAL E 192 58.945 35.646 3.191 1.00 18.76 C ATOM 1343 CG2 VAL E 192 58.374 35.343 0.702 1.00 17.27 C ATOM 1344 N GLY E 193 60.396 38.420 0.073 1.00 16.35 N ATOM 1345 CA GLY E 193 60.814 38.899 -1.249 1.00 16.31 C ATOM 1346 C GLY E 193 61.947 39.910 -1.131 1.00 18.02 C ATOM 1347 O GLY E 193 62.287 40.350 -0.032 1.00 17.10 O ATOM 1348 N PRO E 194 62.584 40.247 -2.251 1.00 18.19 N ATOM 1349 CA PRO E 194 63.699 41.196 -2.216 1.00 18.91 C ATOM 1350 C PRO E 194 63.248 42.598 -1.787 1.00 18.02 C ATOM 1351 O PRO E 194 64.107 43.375 -1.355 1.00 19.19 O ATOM 1352 CB PRO E 194 64.240 41.180 -3.655 1.00 20.43 C ATOM 1353 CG PRO E 194 63.266 40.504 -4.472 1.00 21.62 C ATOM 1354 CD PRO E 194 62.337 39.710 -3.613 1.00 18.84 C ATOM 1355 N GLU E 195 61.963 42.897 -1.851 1.00 16.77 N ATOM 1356 CA GLU E 195 61.459 44.215 -1.392 1.00 16.45 C ATOM 1357 C GLU E 195 61.264 44.304 0.120 1.00 16.77 C ATOM 1358 O GLU E 195 60.979 45.390 0.631 1.00 17.11 O ATOM 1359 CB GLU E 195 60.149 44.574 -2.096 1.00 16.04 C ATOM 1360 CG GLU E 195 60.267 44.504 -3.624 1.00 19.52 C ATOM 1361 CD GLU E 195 59.979 43.103 -4.174 1.00 24.16 C ATOM 1362 OE1 GLU E 195 59.749 42.129 -3.390 1.00 20.38 O ATOM 1363 OE2 GLU E 195 60.029 42.965 -5.432 1.00 27.50 O ATOM 1364 N LEU E 196 61.402 43.199 0.836 1.00 15.15 N ATOM 1365 CA LEU E 196 61.297 43.213 2.296 1.00 14.57 C ATOM 1366 C LEU E 196 62.499 43.986 2.812 1.00 14.55 C ATOM 1367 O LEU E 196 63.644 43.634 2.497 1.00 15.58 O ATOM 1368 CB LEU E 196 61.253 41.762 2.816 1.00 16.31 C ATOM 1369 CG LEU E 196 61.212 41.488 4.292 1.00 17.90 C ATOM 1370 CD1 LEU E 196 59.940 42.151 4.860 1.00 19.39 C ATOM 1371 CD2 LEU E 196 61.173 39.955 4.446 1.00 16.48 C ATOM 1372 N ASP E 197 62.271 45.051 3.608 1.00 12.70 N ATOM 1373 CA ASP E 197 63.389 45.890 3.997 1.00 13.08 C ATOM 1374 C ASP E 197 63.924 45.566 5.390 1.00 11.72 C ATOM 1375 O ASP E 197 65.113 45.241 5.595 1.00 12.36 O ATOM 1376 CB ASP E 197 62.979 47.361 3.855 1.00 13.34 C ATOM 1377 CG ASP E 197 64.147 48.303 3.942 1.00 15.44 C ATOM 1378 OD1 ASP E 197 65.331 47.879 3.927 1.00 17.17 O ATOM 1379 OD2 ASP E 197 63.953 49.538 4.064 1.00 17.57 O ATOM 1380 N VAL E 198 63.034 45.693 6.403 1.00 11.42 N ATOM 1381 CA VAL E 198 63.413 45.408 7.782 1.00 10.45 C ATOM 1382 C VAL E 198 62.269 44.642 8.470 1.00 10.52 C ATOM 1383 O VAL E 198 61.171 44.559 7.912 1.00 11.06 O ATOM 1384 CB VAL E 198 63.686 46.735 8.577 1.00 10.29 C ATOM 1385 CG1 VAL E 198 64.876 47.517 7.955 1.00 11.29 C ATOM 1386 CG2 VAL E 198 62.371 47.622 8.669 1.00 11.25 C ATOM 1387 N MET E 199 62.541 44.114 9.656 1.00 10.25 N ATOM 1388 CA MET E 199 61.529 43.423 10.459 1.00 10.60 C ATOM 1389 C MET E 199 61.295 44.159 11.762 1.00 9.45 C ATOM 1390 O MET E 199 62.170 44.856 12.263 1.00 10.23 O ATOM 1391 CB MET E 199 62.043 42.022 10.865 1.00 11.52 C ATOM 1392 CG MET E 199 62.526 41.166 9.658 1.00 13.40 C ATOM 1393 SD MET E 199 61.304 40.837 8.407 1.00 13.37 S ATOM 1394 CE MET E 199 60.483 39.329 9.065 1.00 13.71 C ATOM 1395 N ALA E 200 60.108 43.956 12.311 1.00 9.14 N ATOM 1396 CA ALA E 200 59.814 44.446 13.666 1.00 9.63 C ATOM 1397 C ALA E 200 58.784 43.521 14.302 1.00 9.43 C ATOM 1398 O ALA E 200 58.245 42.639 13.606 1.00 9.89 O ATOM 1399 CB ALA E 200 59.289 45.910 13.641 1.00 10.91 C ATOM 1400 N PRO E 201 58.569 43.643 15.595 1.00 9.50 N ATOM 1401 CA PRO E 201 57.639 42.721 16.283 1.00 8.95 C ATOM 1402 C PRO E 201 56.207 42.824 15.724 1.00 10.12 C ATOM 1403 O PRO E 201 55.680 43.923 15.572 1.00 10.54 O ATOM 1404 CB PRO E 201 57.692 43.178 17.720 1.00 9.52 C ATOM 1405 CG PRO E 201 59.149 43.748 17.870 1.00 10.00 C ATOM 1406 CD PRO E 201 59.283 44.521 16.552 1.00 9.95 C ATOM 1407 N GLY E 202 55.612 41.665 15.395 1.00 10.33 N ATOM 1408 CA GLY E 202 54.284 41.657 14.812 1.00 10.92 C ATOM 1409 C GLY E 202 53.443 40.467 15.277 1.00 10.89 C ATOM 1410 O GLY E 202 52.425 40.160 14.623 1.00 12.24 O ATOM 1411 N VAL E 203 53.846 39.838 16.381 1.00 11.46 N ATOM 1412 CA VAL E 203 53.091 38.700 16.952 1.00 12.22 C ATOM 1413 C VAL E 203 52.681 39.085 18.363 1.00 12.02 C ATOM 1414 O VAL E 203 53.524 39.426 19.190 1.00 11.56 O ATOM 1415 CB VAL E 203 53.973 37.449 16.922 1.00 12.15 C ATOM 1416 CG1 VAL E 203 53.224 36.235 17.569 1.00 13.99 C ATOM 1417 CG2 VAL E 203 54.384 37.141 15.481 1.00 14.64 C ATOM 1418 N SER E 204 51.382 38.959 18.647 1.00 11.82 N ATOM 1419 CA SER E 204 50.860 39.171 20.011 1.00 11.95 C ATOM 1420 C SER E 204 51.259 40.551 20.562 1.00 10.63 C ATOM 1421 O SER E 204 51.828 40.663 21.640 1.00 10.90 O ATOM 1422 CB SER E 204 51.318 38.075 20.965 1.00 14.15 C ATOM 1423 OG SER E 204 50.844 36.827 20.455 1.00 18.96 O ATOM 1424 N ILE E 205 50.955 41.561 19.762 1.00 9.61 N ATOM 1425 CA ILE E 205 51.342 42.935 20.095 1.00 9.66 C ATOM 1426 C ILE E 205 50.173 43.602 20.807 1.00 9.08 C ATOM 1427 O ILE E 205 49.116 43.861 20.200 1.00 9.17 O ATOM 1428 CB ILE E 205 51.683 43.702 18.789 1.00 8.46 C ATOM 1429 CG1 ILE E 205 52.809 43.011 17.964 1.00 9.25 C ATOM 1430 CG2 ILE E 205 52.075 45.157 19.124 1.00 8.75 C ATOM 1431 CD1 ILE E 205 54.132 42.772 18.751 1.00 10.24 C ATOM 1432 N GLN E 206 50.385 43.917 22.081 1.00 8.59 N ATOM 1433 CA GLN E 206 49.391 44.657 22.887 1.00 9.09 C ATOM 1434 C GLN E 206 49.376 46.113 22.499 1.00 9.77 C ATOM 1435 O GLN E 206 50.457 46.749 22.395 1.00 9.29 O ATOM 1436 CB GLN E 206 49.710 44.526 24.395 1.00 9.66 C ATOM 1437 CG GLN E 206 49.426 43.125 24.919 1.00 11.83 C ATOM 1438 CD GLN E 206 47.910 42.874 25.072 1.00 13.41 C ATOM 1439 OE1 GLN E 206 47.090 43.798 24.944 1.00 14.30 O ATOM 1440 NE2 GLN E 206 47.548 41.615 25.375 1.00 16.98 N ATOM 1441 N SER E 207 48.190 46.662 22.295 1.00 9.40 N ATOM 1442 CA SER E 207 48.051 48.096 22.019 1.00 9.00 C ATOM 1443 C SER E 207 46.612 48.524 22.345 1.00 9.47 C ATOM 1444 O SER E 207 45.777 47.720 22.824 1.00 10.16 O ATOM 1445 CB SER E 207 48.402 48.405 20.546 1.00 9.41 C ATOM 1446 OG SER E 207 48.476 49.804 20.390 1.00 9.85 O ATOM 1447 N THR E 208 46.329 49.791 22.110 1.00 9.46 N ATOM 1448 CA THR E 208 45.021 50.432 22.377 1.00 9.30 C ATOM 1449 C THR E 208 43.972 49.959 21.387 1.00 10.09 C ATOM 1450 O THR E 208 44.256 49.793 20.212 1.00 10.68 O ATOM 1451 CB THR E 208 45.200 51.968 22.205 1.00 9.06 C ATOM 1452 OG1 THR E 208 45.992 52.240 21.019 1.00 9.97 O ATOM 1453 CG2 THR E 208 46.026 52.521 23.361 1.00 9.11 C ATOM 1454 N LEU E 209 42.739 49.787 21.889 1.00 10.91 N ATOM 1455 CA LEU E 209 41.613 49.460 21.028 1.00 11.04 C ATOM 1456 C LEU E 209 40.463 50.398 21.387 1.00 11.59 C ATOM 1457 O LEU E 209 40.411 50.900 22.511 1.00 11.81 O ATOM 1458 CB LEU E 209 41.184 48.012 21.279 1.00 11.97 C ATOM 1459 CG LEU E 209 42.147 46.959 20.712 1.00 11.10 C ATOM 1460 CD1 LEU E 209 41.821 45.500 21.203 1.00 15.53 C ATOM 1461 CD2 LEU E 209 42.192 46.985 19.205 1.00 11.65 C ATOM 1462 N PRO E 210 39.526 50.641 20.461 1.00 12.66 N ATOM 1463 CA PRO E 210 38.449 51.590 20.749 1.00 12.99 C ATOM 1464 C PRO E 210 37.574 51.262 21.980 1.00 12.93 C ATOM 1465 O PRO E 210 37.442 50.101 22.377 1.00 14.60 O ATOM 1466 CB PRO E 210 37.594 51.523 19.474 1.00 13.79 C ATOM 1467 CG PRO E 210 38.573 51.128 18.374 1.00 13.49 C ATOM 1468 CD PRO E 210 39.437 50.110 19.086 1.00 11.89 C ATOM 1469 N GLY E 211 37.077 52.338 22.574 1.00 13.77 N ATOM 1470 CA GLY E 211 36.260 52.239 23.774 1.00 13.95 C ATOM 1471 C GLY E 211 37.085 51.904 24.996 1.00 12.71 C ATOM 1472 O GLY E 211 36.662 51.113 25.858 1.00 15.12 O ATOM 1473 N ASN E 212 38.286 52.503 25.062 1.00 12.15 N ATOM 1474 CA ASN E 212 39.156 52.368 26.212 1.00 12.89 C ATOM 1475 C ASN E 212 39.471 50.922 26.515 1.00 12.82 C ATOM 1476 O ASN E 212 39.353 50.465 27.657 1.00 13.99 O ATOM 1477 CB ASN E 212 38.557 53.087 27.417 1.00 14.87 C ATOM 1478 CG ASN E 212 39.512 53.162 28.564 1.00 14.34 C ATOM 1479 OD1 ASN E 212 40.735 53.167 28.376 1.00 15.32 O ATOM 1480 ND2 ASN E 212 38.966 53.206 29.771 1.00 18.15 N ATOM 1481 N LYS E 213 39.925 50.198 25.483 1.00 11.69 N ATOM 1482 CA LYS E 213 40.306 48.797 25.661 1.00 11.36 C ATOM 1483 C LYS E 213 41.747 48.625 25.183 1.00 10.55 C ATOM 1484 O LYS E 213 42.402 49.613 24.713 1.00 10.91 O ATOM 1485 CB LYS E 213 39.387 47.874 24.820 1.00 13.22 C ATOM 1486 CG LYS E 213 37.847 47.922 25.173 1.00 15.80 C ATOM 1487 CD LYS E 213 37.612 47.475 26.592 1.00 21.02 C ATOM 1488 CE LYS E 213 36.111 47.315 26.955 1.00 21.96 C ATOM 1489 NZ ALYS E 213 36.005 46.711 28.311 0.50 19.81 N ATOM 1490 NZ BLYS E 213 35.425 48.638 26.838 0.50 20.81 N ATOM 1491 N TYR E 214 42.263 47.412 25.386 1.00 9.99 N ATOM 1492 CA TYR E 214 43.625 47.039 24.941 1.00 11.23 C ATOM 1493 C TYR E 214 43.509 45.622 24.454 1.00 11.80 C ATOM 1494 O TYR E 214 42.638 44.857 24.918 1.00 11.74 O ATOM 1495 CB TYR E 214 44.668 47.110 26.098 1.00 11.06 C ATOM 1496 CG TYR E 214 44.725 48.468 26.742 1.00 10.52 C ATOM 1497 CD1 TYR E 214 45.588 49.459 26.215 1.00 10.44 C ATOM 1498 CD2 TYR E 214 43.897 48.814 27.830 1.00 10.59 C ATOM 1499 CE1 TYR E 214 45.629 50.734 26.746 1.00 9.66 C ATOM 1500 CE2 TYR E 214 43.939 50.121 28.385 1.00 11.25 C ATOM 1501 CZ TYR E 214 44.797 51.055 27.813 1.00 11.36 C ATOM 1502 OH TYR E 214 44.799 52.308 28.379 1.00 10.21 O ATOM 1503 N GLY E 215 44.374 45.237 23.552 1.00 10.82 N ATOM 1504 CA GLY E 215 44.421 43.841 23.165 1.00 11.22 C ATOM 1505 C GLY E 215 45.571 43.495 22.248 1.00 10.38 C ATOM 1506 O GLY E 215 46.201 44.391 21.660 1.00 10.57 O ATOM 1507 N ALA E 216 45.831 42.196 22.118 1.00 9.73 N ATOM 1508 CA ALA E 216 46.966 41.704 21.347 1.00 10.28 C ATOM 1509 C ALA E 216 46.556 41.354 19.929 1.00 11.26 C ATOM 1510 O ALA E 216 45.694 40.505 19.712 1.00 11.71 O ATOM 1511 CB ALA E 216 47.543 40.465 22.054 1.00 10.62 C ATOM 1512 N TYR E 217 47.130 42.033 18.959 1.00 11.16 N ATOM 1513 CA TYR E 217 46.905 41.754 17.509 1.00 10.48 C ATOM 1514 C TYR E 217 48.202 41.234 16.896 1.00 11.69 C ATOM 1515 O TYR E 217 49.307 41.310 17.471 1.00 11.76 O ATOM 1516 CB TYR E 217 46.482 43.037 16.762 1.00 11.05 C ATOM 1517 CG TYR E 217 45.022 43.437 16.881 1.00 10.11 C ATOM 1518 CD1 TYR E 217 44.177 42.869 17.820 1.00 13.33 C ATOM 1519 CD2 TYR E 217 44.484 44.408 16.032 1.00 11.36 C ATOM 1520 CE1 TYR E 217 42.822 43.243 17.886 1.00 12.67 C ATOM 1521 CE2 TYR E 217 43.126 44.816 16.113 1.00 12.70 C ATOM 1522 CZ TYR E 217 42.309 44.218 17.031 1.00 12.46 C ATOM 1523 OH TYR E 217 40.973 44.555 17.087 1.00 13.81 O ATOM 1524 N ASN E 218 48.043 40.640 15.719 1.00 11.39 N ATOM 1525 CA ASN E 218 49.129 40.011 14.957 1.00 11.21 C ATOM 1526 C ASN E 218 49.089 40.545 13.557 1.00 10.19 C ATOM 1527 O ASN E 218 48.011 40.812 13.014 1.00 11.78 O ATOM 1528 CB ASN E 218 48.891 38.475 14.839 1.00 12.01 C ATOM 1529 CG ASN E 218 48.823 37.825 16.191 1.00 15.08 C ATOM 1530 OD1 ASN E 218 49.807 37.610 16.836 1.00 16.73 O ATOM 1531 ND2 ASN E 218 47.603 37.545 16.643 1.00 21.56 N ATOM 1532 N GLY E 219 50.262 40.722 12.956 1.00 10.55 N ATOM 1533 CA GLY E 219 50.284 41.120 11.563 1.00 10.34 C ATOM 1534 C GLY E 219 51.488 41.954 11.210 1.00 10.42 C ATOM 1535 O GLY E 219 52.127 42.564 12.107 1.00 10.09 O ATOM 1536 N THR E 220 51.772 42.046 9.909 1.00 10.60 N ATOM 1537 CA THR E 220 52.754 43.069 9.500 1.00 10.33 C ATOM 1538 C THR E 220 52.180 44.443 9.776 1.00 10.51 C ATOM 1539 O THR E 220 52.964 45.391 9.908 1.00 10.01 O ATOM 1540 CB THR E 220 53.253 42.896 8.051 1.00 10.88 C ATOM 1541 OG1 THR E 220 52.167 42.858 7.138 1.00 11.06 O ATOM 1542 CG2 THR E 220 54.108 41.587 7.933 1.00 11.36 C ATOM 1543 N SER E 221 50.862 44.591 9.872 1.00 10.00 N ATOM 1544 CA SER E 221 50.286 45.862 10.341 1.00 9.79 C ATOM 1545 C SER E 221 50.810 46.312 11.711 1.00 9.09 C ATOM 1546 O SER E 221 50.841 47.527 12.010 1.00 10.39 O ATOM 1547 CB SER E 221 48.813 45.668 10.600 1.00 10.49 C ATOM 1548 OG SER E 221 48.070 45.857 9.416 1.00 10.85 O ATOM 1549 N MET E 222 51.168 45.356 12.551 1.00 9.52 N ATOM 1550 CA MET E 222 51.648 45.657 13.899 1.00 9.69 C ATOM 1551 C MET E 222 53.138 45.960 13.876 1.00 9.05 C ATOM 1552 O MET E 222 53.664 46.680 14.761 1.00 9.20 O ATOM 1553 CB MET E 222 51.373 44.458 14.869 1.00 9.98 C ATOM 1554 CG MET E 222 49.891 44.360 15.364 1.00 10.54 C ATOM 1555 SD MET E 222 48.621 44.118 14.056 1.00 11.58 S ATOM 1556 CE MET E 222 47.910 45.720 13.959 1.00 11.12 C ATOM 1557 N ALA E 223 53.847 45.366 12.930 1.00 9.10 N ATOM 1558 CA ALA E 223 55.291 45.562 12.811 1.00 9.60 C ATOM 1559 C ALA E 223 55.568 46.974 12.270 1.00 9.35 C ATOM 1560 O ALA E 223 56.422 47.669 12.833 1.00 9.51 O ATOM 1561 CB ALA E 223 55.870 44.486 11.874 1.00 9.38 C ATOM 1562 N SER E 224 54.880 47.381 11.195 1.00 9.62 N ATOM 1563 CA SER E 224 55.061 48.700 10.552 1.00 8.76 C ATOM 1564 C SER E 224 55.091 49.872 11.580 1.00 10.10 C ATOM 1565 O SER E 224 56.061 50.663 11.505 1.00 9.08 O ATOM 1566 CB SER E 224 53.954 48.891 9.524 1.00 9.27 C ATOM 1567 OG SER E 224 54.196 50.079 8.770 1.00 10.15 O ATOM 1568 N PRO E 225 54.157 50.011 12.507 1.00 8.69 N ATOM 1569 CA PRO E 225 54.181 51.185 13.405 1.00 8.85 C ATOM 1570 C PRO E 225 55.342 51.139 14.379 1.00 8.73 C ATOM 1571 O PRO E 225 55.709 52.191 14.903 1.00 9.14 O ATOM 1572 CB PRO E 225 52.831 51.120 14.141 1.00 9.46 C ATOM 1573 CG PRO E 225 52.457 49.577 14.055 1.00 8.79 C ATOM 1574 CD PRO E 225 52.883 49.234 12.632 1.00 9.14 C ATOM 1575 N HIS E 226 55.971 50.004 14.645 1.00 7.98 N ATOM 1576 CA HIS E 226 57.223 50.076 15.415 1.00 8.08 C ATOM 1577 C HIS E 226 58.288 50.840 14.655 1.00 8.54 C ATOM 1578 O HIS E 226 59.064 51.559 15.289 1.00 8.10 O ATOM 1579 CB HIS E 226 57.751 48.658 15.686 1.00 7.65 C ATOM 1580 CG HIS E 226 56.991 47.861 16.719 1.00 7.97 C ATOM 1581 ND1 HIS E 226 55.886 47.079 16.412 1.00 9.64 N ATOM 1582 CD2 HIS E 226 57.216 47.706 18.049 1.00 8.19 C ATOM 1583 CE1 HIS E 226 55.461 46.486 17.523 1.00 8.47 C ATOM 1584 NE2 HIS E 226 56.240 46.834 18.527 1.00 9.87 N ATOM 1585 N VAL E 227 58.314 50.662 13.327 1.00 8.25 N ATOM 1586 CA VAL E 227 59.308 51.347 12.500 1.00 8.66 C ATOM 1587 C VAL E 227 58.896 52.787 12.313 1.00 9.34 C ATOM 1588 O VAL E 227 59.795 53.664 12.365 1.00 9.02 O ATOM 1589 CB VAL E 227 59.463 50.583 11.183 1.00 8.56 C ATOM 1590 CG1 VAL E 227 60.503 51.245 10.286 1.00 9.20 C ATOM 1591 CG2 VAL E 227 59.901 49.099 11.444 1.00 8.87 C ATOM 1592 N ALA E 228 57.614 53.082 12.131 1.00 8.82 N ATOM 1593 CA ALA E 228 57.194 54.482 12.012 1.00 8.33 C ATOM 1594 C ALA E 228 57.478 55.185 13.329 1.00 9.62 C ATOM 1595 O ALA E 228 57.990 56.341 13.337 1.00 8.79 O ATOM 1596 CB ALA E 228 55.708 54.521 11.647 1.00 7.97 C ATOM 1597 N GLY E 229 57.152 54.553 14.465 1.00 8.79 N ATOM 1598 CA GLY E 229 57.524 55.163 15.744 1.00 9.11 C ATOM 1599 C GLY E 229 59.023 55.332 15.903 1.00 9.34 C ATOM 1600 O GLY E 229 59.478 56.344 16.424 1.00 9.30 O ATOM 1601 N ALA E 230 59.815 54.374 15.448 1.00 7.88 N ATOM 1602 CA ALA E 230 61.291 54.485 15.580 1.00 8.33 C ATOM 1603 C ALA E 230 61.759 55.678 14.753 1.00 7.40 C ATOM 1604 O ALA E 230 62.652 56.426 15.198 1.00 8.58 O ATOM 1605 CB ALA E 230 61.989 53.178 15.087 1.00 9.15 C ATOM 1606 N ALA E 231 61.185 55.879 13.580 1.00 7.78 N ATOM 1607 CA ALA E 231 61.532 57.056 12.756 1.00 7.89 C ATOM 1608 C ALA E 231 61.226 58.340 13.522 1.00 8.83 C ATOM 1609 O ALA E 231 62.024 59.313 13.454 1.00 9.59 O ATOM 1610 CB ALA E 231 60.732 57.061 11.427 1.00 7.67 C ATOM 1611 N ALA E 232 60.075 58.405 14.214 1.00 8.52 N ATOM 1612 CA ALA E 232 59.787 59.597 15.005 1.00 8.04 C ATOM 1613 C ALA E 232 60.754 59.767 16.165 1.00 8.79 C ATOM 1614 O ALA E 232 61.143 60.921 16.491 1.00 9.09 O ATOM 1615 CB ALA E 232 58.354 59.495 15.515 1.00 8.75 C ATOM 1616 N LEU E 233 61.189 58.699 16.843 1.00 8.65 N ATOM 1617 CA LEU E 233 62.213 58.870 17.876 1.00 8.40 C ATOM 1618 C LEU E 233 63.502 59.420 17.280 1.00 9.23 C ATOM 1619 O LEU E 233 64.083 60.353 17.852 1.00 9.09 O ATOM 1620 CB LEU E 233 62.545 57.490 18.515 1.00 8.08 C ATOM 1621 CG LEU E 233 61.407 56.921 19.371 1.00 8.67 C ATOM 1622 CD1 LEU E 233 61.917 55.526 19.890 1.00 9.34 C ATOM 1623 CD2 LEU E 233 61.105 57.838 20.580 1.00 10.07 C ATOM 1624 N ILE E 234 63.935 58.864 16.145 1.00 8.97 N ATOM 1625 CA ILE E 234 65.185 59.287 15.502 1.00 9.60 C ATOM 1626 C ILE E 234 65.089 60.771 15.142 1.00 9.13 C ATOM 1627 O ILE E 234 66.067 61.531 15.430 1.00 9.21 O ATOM 1628 CB ILE E 234 65.489 58.403 14.276 1.00 8.79 C ATOM 1629 CG1 ILE E 234 65.839 56.982 14.727 1.00 9.36 C ATOM 1630 CG2 ILE E 234 66.649 59.070 13.452 1.00 11.34 C ATOM 1631 CD1 ILE E 234 65.712 55.930 13.610 1.00 9.71 C ATOM 1632 N LEU E 235 63.963 61.199 14.553 1.00 8.56 N ATOM 1633 CA LEU E 235 63.797 62.613 14.169 1.00 9.53 C ATOM 1634 C LEU E 235 63.732 63.504 15.400 1.00 10.89 C ATOM 1635 O LEU E 235 64.164 64.666 15.353 1.00 12.18 O ATOM 1636 CB LEU E 235 62.549 62.814 13.322 1.00 9.09 C ATOM 1637 CG LEU E 235 62.694 62.311 11.901 1.00 9.43 C ATOM 1638 CD1 LEU E 235 61.344 62.212 11.218 1.00 11.94 C ATOM 1639 CD2 LEU E 235 63.661 63.243 11.086 1.00 10.86 C ATOM 1640 N SER E 236 63.208 63.026 16.516 1.00 9.07 N ATOM 1641 CA SER E 236 63.209 63.880 17.713 1.00 10.27 C ATOM 1642 C SER E 236 64.595 64.080 18.279 1.00 10.16 C ATOM 1643 O SER E 236 64.871 65.146 18.903 1.00 13.17 O ATOM 1644 CB SER E 236 62.195 63.365 18.760 1.00 10.74 C ATOM 1645 OG SER E 236 62.649 62.175 19.446 1.00 10.71 O ATOM 1646 N LYS E 237 65.493 63.120 18.091 1.00 9.59 N ATOM 1647 CA LYS E 237 66.894 63.269 18.521 1.00 10.59 C ATOM 1648 C LYS E 237 67.701 64.010 17.442 1.00 11.52 C ATOM 1649 O LYS E 237 68.676 64.740 17.793 1.00 12.06 O ATOM 1650 CB LYS E 237 67.523 61.899 18.771 1.00 9.88 C ATOM 1651 CG LYS E 237 68.956 62.030 19.339 1.00 9.70 C ATOM 1652 CD LYS E 237 69.506 60.694 19.711 1.00 12.17 C ATOM 1653 CE LYS E 237 70.937 60.824 20.228 1.00 13.51 C ATOM 1654 NZ LYS E 237 71.596 59.505 20.549 1.00 15.22 N ATOM 1655 N HIS E 238 67.353 63.867 16.168 1.00 10.78 N ATOM 1656 CA HIS E 238 68.105 64.486 15.060 1.00 10.19 C ATOM 1657 C HIS E 238 67.108 65.203 14.153 1.00 10.51 C ATOM 1658 O HIS E 238 66.782 64.707 13.076 1.00 10.99 O ATOM 1659 CB HIS E 238 68.864 63.434 14.244 1.00 9.22 C ATOM 1660 CG HIS E 238 69.865 62.668 15.039 1.00 10.63 C ATOM 1661 ND1 HIS E 238 71.136 63.158 15.327 1.00 10.00 N ATOM 1662 CD2 HIS E 238 69.789 61.441 15.615 1.00 9.90 C ATOM 1663 CE1 HIS E 238 71.787 62.252 16.050 1.00 11.22 C ATOM 1664 NE2 HIS E 238 70.979 61.204 16.238 1.00 11.37 N ATOM 1665 N PRO E 239 66.568 66.347 14.604 1.00 12.56 N ATOM 1666 CA PRO E 239 65.469 66.990 13.859 1.00 14.17 C ATOM 1667 C PRO E 239 65.816 67.476 12.449 1.00 14.27 C ATOM 1668 O PRO E 239 64.901 67.657 11.647 1.00 17.14 O ATOM 1669 CB PRO E 239 65.050 68.192 14.763 1.00 15.13 C ATOM 1670 CG PRO E 239 65.632 67.943 16.078 1.00 17.03 C ATOM 1671 CD PRO E 239 66.862 67.022 15.888 1.00 12.90 C ATOM 1672 N ASN E 240 67.094 67.625 12.159 1.00 14.26 N ATOM 1673 CA ASN E 240 67.450 67.996 10.791 1.00 14.95 C ATOM 1674 C AASN E 240 67.749 66.870 9.883 0.50 14.44 C ATOM 1675 C BASN E 240 68.072 66.846 9.965 0.50 15.29 C ATOM 1676 O AASN E 240 68.017 67.145 8.705 0.50 12.95 O ATOM 1677 O BASN E 240 68.728 67.025 8.927 0.50 15.39 O ATOM 1678 CB AASN E 240 68.773 68.815 10.916 0.50 14.48 C ATOM 1679 CB BASN E 240 68.115 69.348 10.696 0.50 16.46 C ATOM 1680 CG AASN E 240 68.468 70.268 11.116 0.50 13.03 C ATOM 1681 CG BASN E 240 69.336 69.305 11.400 0.50 13.53 C ATOM 1682 OD1AASN E 240 67.370 70.686 10.784 0.50 14.18 O ATOM 1683 OD1BASN E 240 69.675 68.242 11.871 0.50 16.95 O ATOM 1684 ND2AASN E 240 69.377 71.033 11.704 0.50 10.13 N ATOM 1685 ND2BASN E 240 70.048 70.398 11.498 0.50 16.10 N ATOM 1686 N TRP E 241 67.792 65.619 10.399 1.00 14.15 N ATOM 1687 CA TRP E 241 68.040 64.467 9.520 1.00 13.38 C ATOM 1688 C TRP E 241 66.895 64.369 8.514 1.00 12.70 C ATOM 1689 O TRP E 241 65.726 64.610 8.827 1.00 13.43 O ATOM 1690 CB TRP E 241 68.093 63.171 10.327 1.00 12.18 C ATOM 1691 CG TRP E 241 69.438 62.917 10.918 1.00 11.69 C ATOM 1692 CD1 TRP E 241 70.492 63.819 11.023 1.00 13.20 C ATOM 1693 CD2 TRP E 241 69.879 61.722 11.570 1.00 11.08 C ATOM 1694 NE1 TRP E 241 71.551 63.209 11.644 1.00 12.97 N ATOM 1695 CE2 TRP E 241 71.223 61.917 11.994 1.00 13.06 C ATOM 1696 CE3 TRP E 241 69.279 60.463 11.831 1.00 12.49 C ATOM 1697 CZ2 TRP E 241 71.940 60.959 12.702 1.00 12.76 C ATOM 1698 CZ3 TRP E 241 70.042 59.482 12.478 1.00 11.24 C ATOM 1699 CH2 TRP E 241 71.359 59.743 12.927 1.00 12.92 C ATOM 1700 N THR E 242 67.275 64.121 7.268 1.00 11.82 N ATOM 1701 CA THR E 242 66.309 63.915 6.203 1.00 11.29 C ATOM 1702 C THR E 242 65.663 62.552 6.329 1.00 10.39 C ATOM 1703 O THR E 242 66.167 61.658 7.044 1.00 10.58 O ATOM 1704 CB THR E 242 67.006 63.947 4.828 1.00 11.80 C ATOM 1705 OG1 THR E 242 67.973 62.905 4.788 1.00 14.30 O ATOM 1706 CG2 THR E 242 67.783 65.287 4.648 1.00 15.43 C ATOM 1707 N ASN E 243 64.562 62.396 5.624 1.00 10.30 N ATOM 1708 CA ASN E 243 63.984 61.039 5.507 1.00 10.53 C ATOM 1709 C ASN E 243 64.989 60.048 4.941 1.00 11.00 C ATOM 1710 O ASN E 243 65.044 58.903 5.399 1.00 11.54 O ATOM 1711 CB ASN E 243 62.696 61.014 4.699 1.00 9.43 C ATOM 1712 CG ASN E 243 62.814 61.597 3.271 1.00 11.74 C ATOM 1713 OD1 ASN E 243 63.758 62.348 2.948 1.00 12.68 O ATOM 1714 ND2 ASN E 243 61.803 61.309 2.435 1.00 11.74 N ATOM 1715 N THR E 244 65.828 60.468 3.993 1.00 10.91 N ATOM 1716 CA THR E 244 66.871 59.577 3.453 1.00 11.96 C ATOM 1717 C THR E 244 67.748 59.074 4.571 1.00 11.67 C ATOM 1718 O THR E 244 68.056 57.877 4.656 1.00 11.95 O ATOM 1719 CB THR E 244 67.753 60.413 2.481 1.00 11.66 C ATOM 1720 OG1 THR E 244 66.904 61.100 1.561 1.00 12.91 O ATOM 1721 CG2 THR E 244 68.655 59.482 1.669 1.00 15.48 C ATOM 1722 N GLN E 245 68.171 59.984 5.443 1.00 10.94 N ATOM 1723 CA GLN E 245 69.049 59.638 6.566 1.00 11.38 C ATOM 1724 C GLN E 245 68.349 58.769 7.632 1.00 10.92 C ATOM 1725 O GLN E 245 68.961 57.851 8.220 1.00 12.04 O ATOM 1726 CB GLN E 245 69.622 60.915 7.177 1.00 11.92 C ATOM 1727 CG GLN E 245 70.347 60.690 8.450 1.00 17.25 C ATOM 1728 CD GLN E 245 71.615 59.813 8.373 1.00 22.36 C ATOM 1729 OE1 GLN E 245 72.091 59.366 9.427 1.00 24.62 O ATOM 1730 NE2 GLN E 245 72.186 59.628 7.179 1.00 21.08 N ATOM 1731 N VAL E 246 67.083 59.082 7.919 1.00 10.55 N ATOM 1732 CA VAL E 246 66.336 58.251 8.886 1.00 10.73 C ATOM 1733 C VAL E 246 66.204 56.831 8.347 1.00 10.58 C ATOM 1734 O VAL E 246 66.450 55.860 9.080 1.00 9.86 O ATOM 1735 CB VAL E 246 64.959 58.855 9.163 1.00 10.04 C ATOM 1736 CG1 VAL E 246 64.151 57.944 10.064 1.00 10.58 C ATOM 1737 CG2 VAL E 246 65.100 60.218 9.877 1.00 11.72 C ATOM 1738 N ARG E 247 65.846 56.709 7.074 1.00 10.16 N ATOM 1739 CA ARG E 247 65.715 55.386 6.477 1.00 10.20 C ATOM 1740 C ARG E 247 67.030 54.644 6.520 1.00 10.93 C ATOM 1741 O ARG E 247 67.089 53.474 6.946 1.00 11.18 O ATOM 1742 CB ARG E 247 65.250 55.523 5.021 1.00 11.22 C ATOM 1743 CG ARG E 247 65.201 54.154 4.322 1.00 11.24 C ATOM 1744 CD ARG E 247 64.425 54.210 3.045 1.00 11.70 C ATOM 1745 NE ARG E 247 64.380 52.892 2.407 1.00 13.10 N ATOM 1746 CZ ARG E 247 63.580 52.589 1.370 1.00 15.35 C ATOM 1747 NH1 ARG E 247 62.757 53.494 0.832 1.00 14.60 N ATOM 1748 NH2 ARG E 247 63.611 51.331 0.896 1.00 18.06 N ATOM 1749 N SER E 248 68.105 55.286 6.084 1.00 10.99 N ATOM 1750 CA SER E 248 69.398 54.592 6.132 1.00 12.38 C ATOM 1751 C SER E 248 69.819 54.247 7.559 1.00 11.20 C ATOM 1752 O SER E 248 70.393 53.186 7.798 1.00 12.16 O ATOM 1753 CB SER E 248 70.543 55.399 5.474 1.00 12.66 C ATOM 1754 OG ASER E 248 70.327 55.795 4.123 0.67 14.25 O ATOM 1755 OG BSER E 248 70.775 56.602 6.081 0.33 11.30 O ATOM 1756 N SER E 249 69.518 55.114 8.545 1.00 10.90 N ATOM 1757 CA SER E 249 69.923 54.805 9.894 1.00 10.98 C ATOM 1758 C SER E 249 69.245 53.522 10.378 1.00 10.98 C ATOM 1759 O SER E 249 69.873 52.734 11.074 1.00 11.73 O ATOM 1760 CB SER E 249 69.633 55.991 10.843 1.00 11.66 C ATOM 1761 OG ASER E 249 70.216 57.171 10.370 0.33 13.02 O ATOM 1762 OG BSER E 249 68.265 56.095 11.197 0.67 10.28 O ATOM 1763 N LEU E 250 67.981 53.357 10.019 1.00 10.49 N ATOM 1764 CA LEU E 250 67.275 52.141 10.441 1.00 10.32 C ATOM 1765 C LEU E 250 67.773 50.903 9.702 1.00 10.89 C ATOM 1766 O LEU E 250 67.902 49.809 10.306 1.00 11.75 O ATOM 1767 CB LEU E 250 65.794 52.340 10.181 1.00 10.85 C ATOM 1768 CG LEU E 250 65.126 53.276 11.225 1.00 12.37 C ATOM 1769 CD1 LEU E 250 63.842 53.798 10.640 1.00 13.05 C ATOM 1770 CD2 LEU E 250 64.937 52.531 12.552 1.00 11.74 C ATOM 1771 N GLU E 251 68.026 51.054 8.419 1.00 10.46 N ATOM 1772 CA GLU E 251 68.507 49.923 7.602 1.00 10.66 C ATOM 1773 C GLU E 251 69.893 49.512 8.017 1.00 11.38 C ATOM 1774 O GLU E 251 70.207 48.310 8.009 1.00 12.38 O ATOM 1775 CB GLU E 251 68.505 50.326 6.128 1.00 10.87 C ATOM 1776 CG GLU E 251 67.113 50.420 5.577 1.00 11.42 C ATOM 1777 CD GLU E 251 67.047 51.053 4.203 1.00 14.20 C ATOM 1778 OE1 GLU E 251 68.038 51.646 3.734 1.00 17.25 O ATOM 1779 OE2 GLU E 251 65.959 50.925 3.593 1.00 14.94 O ATOM 1780 N ASN E 252 70.732 50.462 8.385 1.00 10.57 N ATOM 1781 CA ASN E 252 72.155 50.195 8.537 1.00 10.50 C ATOM 1782 C ASN E 252 72.513 49.702 9.931 1.00 10.35 C ATOM 1783 O ASN E 252 73.696 49.403 10.221 1.00 11.50 O ATOM 1784 CB ASN E 252 72.932 51.491 8.256 1.00 11.14 C ATOM 1785 CG ASN E 252 72.913 51.888 6.788 1.00 11.30 C ATOM 1786 OD1 ASN E 252 73.448 52.996 6.459 1.00 15.54 O ATOM 1787 ND2 ASN E 252 72.274 51.146 5.954 1.00 9.20 N ATOM 1788 N THR E 253 71.505 49.663 10.826 1.00 10.05 N ATOM 1789 CA THR E 253 71.747 49.304 12.228 1.00 10.24 C ATOM 1790 C THR E 253 70.856 48.144 12.721 1.00 10.17 C ATOM 1791 O THR E 253 70.803 47.911 13.930 1.00 11.37 O ATOM 1792 CB THR E 253 71.575 50.494 13.209 1.00 10.38 C ATOM 1793 OG1 THR E 253 70.225 50.967 13.126 1.00 10.59 O ATOM 1794 CG2 THR E 253 72.472 51.671 12.790 1.00 11.43 C ATOM 1795 N THR E 254 70.191 47.462 11.812 1.00 10.11 N ATOM 1796 CA THR E 254 69.438 46.294 12.214 1.00 11.00 C ATOM 1797 C THR E 254 70.326 45.228 12.837 1.00 10.99 C ATOM 1798 O THR E 254 71.551 45.134 12.584 1.00 11.27 O ATOM 1799 CB THR E 254 68.798 45.651 10.992 1.00 10.37 C ATOM 1800 OG1 THR E 254 69.860 45.445 10.015 1.00 12.51 O ATOM 1801 CG2 THR E 254 67.707 46.510 10.315 1.00 9.94 C ATOM 1802 N THR E 255 69.696 44.374 13.628 1.00 10.65 N ATOM 1803 CA THR E 255 70.284 43.107 14.008 1.00 12.16 C ATOM 1804 C THR E 255 69.965 42.109 12.918 1.00 12.03 C ATOM 1805 O THR E 255 68.785 41.762 12.702 1.00 11.82 O ATOM 1806 CB THR E 255 69.695 42.706 15.348 1.00 11.22 C ATOM 1807 OG1 THR E 255 70.160 43.621 16.368 1.00 13.06 O ATOM 1808 CG2 THR E 255 70.204 41.291 15.768 1.00 14.81 C ATOM 1809 N LYS E 256 70.987 41.654 12.185 1.00 14.15 N ATOM 1810 CA LYS E 256 70.758 40.770 11.046 1.00 13.79 C ATOM 1811 C LYS E 256 70.250 39.405 11.602 1.00 14.77 C ATOM 1812 O LYS E 256 70.678 38.917 12.667 1.00 16.84 O ATOM 1813 CB LYS E 256 72.034 40.621 10.148 1.00 15.99 C ATOM 1814 CG LYS E 256 72.432 41.962 9.428 1.00 16.72 C ATOM 1815 CD LYS E 256 71.985 41.959 7.973 1.00 16.79 C ATOM 1816 CE LYS E 256 72.147 43.379 7.341 1.00 16.08 C ATOM 1817 NZ LYS E 256 72.467 43.449 5.859 1.00 16.62 N ATOM 1818 N LEU E 257 69.289 38.878 10.873 1.00 15.75 N ATOM 1819 CA LEU E 257 68.609 37.645 11.275 1.00 18.12 C ATOM 1820 C LEU E 257 68.937 36.626 10.185 1.00 20.11 C ATOM 1821 O LEU E 257 70.119 36.376 9.944 1.00 24.37 O ATOM 1822 CB LEU E 257 67.120 37.883 11.537 1.00 16.30 C ATOM 1823 CG LEU E 257 66.818 38.913 12.649 1.00 15.81 C ATOM 1824 CD1 LEU E 257 65.304 39.210 12.755 1.00 15.64 C ATOM 1825 CD2 LEU E 257 67.425 38.529 13.992 1.00 18.60 C ATOM 1826 N GLY E 258 67.959 36.083 9.503 1.00 22.37 N ATOM 1827 CA GLY E 258 68.270 35.117 8.453 1.00 23.22 C ATOM 1828 C GLY E 258 68.525 35.704 7.080 1.00 23.31 C ATOM 1829 O GLY E 258 68.870 36.881 6.885 1.00 23.36 O ATOM 1830 N ASP E 259 68.328 34.849 6.079 1.00 22.72 N ATOM 1831 CA ASP E 259 68.391 35.277 4.698 1.00 21.63 C ATOM 1832 C ASP E 259 67.489 36.475 4.420 1.00 20.00 C ATOM 1833 O ASP E 259 66.339 36.509 4.863 1.00 17.83 O ATOM 1834 CB ASP E 259 68.022 34.110 3.777 1.00 23.48 C ATOM 1835 CG ASP E 259 68.280 34.442 2.342 1.00 25.98 C ATOM 1836 OD1 ASP E 259 69.398 34.119 1.867 1.00 36.91 O ATOM 1837 OD2 ASP E 259 67.503 35.076 1.609 1.00 26.75 O ATOM 1838 N SER E 260 68.001 37.437 3.663 1.00 18.84 N ATOM 1839 CA SER E 260 67.261 38.676 3.392 1.00 19.11 C ATOM 1840 C SER E 260 65.956 38.510 2.632 1.00 19.06 C ATOM 1841 O SER E 260 65.079 39.368 2.687 1.00 17.78 O ATOM 1842 CB SER E 260 68.154 39.695 2.693 1.00 19.88 C ATOM 1843 OG SER E 260 68.549 39.225 1.417 1.00 23.33 O ATOM 1844 N PHE E 261 65.791 37.396 1.910 1.00 18.79 N ATOM 1845 CA PHE E 261 64.526 37.139 1.267 1.00 16.79 C ATOM 1846 C PHE E 261 63.383 36.993 2.297 1.00 15.14 C ATOM 1847 O PHE E 261 62.249 37.356 2.025 1.00 16.14 O ATOM 1848 CB PHE E 261 64.669 35.819 0.453 1.00 18.42 C ATOM 1849 CG PHE E 261 63.507 35.513 -0.417 1.00 17.65 C ATOM 1850 CD1 PHE E 261 63.406 36.057 -1.699 1.00 20.65 C ATOM 1851 CD2 PHE E 261 62.493 34.638 0.044 1.00 18.71 C ATOM 1852 CE1 PHE E 261 62.287 35.761 -2.522 1.00 20.53 C ATOM 1853 CE2 PHE E 261 61.390 34.324 -0.787 1.00 20.79 C ATOM 1854 CZ PHE E 261 61.294 34.903 -2.066 1.00 20.68 C ATOM 1855 N TYR E 262 63.730 36.445 3.456 1.00 15.80 N ATOM 1856 CA TYR E 262 62.761 36.152 4.537 1.00 16.62 C ATOM 1857 C TYR E 262 62.776 37.189 5.665 1.00 15.72 C ATOM 1858 O TYR E 262 61.768 37.386 6.315 1.00 15.80 O ATOM 1859 CB TYR E 262 63.015 34.758 5.155 1.00 17.52 C ATOM 1860 CG TYR E 262 62.878 33.642 4.132 1.00 21.29 C ATOM 1861 CD1 TYR E 262 61.613 33.200 3.722 1.00 23.62 C ATOM 1862 CD2 TYR E 262 64.020 33.064 3.550 1.00 23.85 C ATOM 1863 CE1 TYR E 262 61.479 32.191 2.735 1.00 25.62 C ATOM 1864 CE2 TYR E 262 63.890 32.048 2.560 1.00 26.91 C ATOM 1865 CZ TYR E 262 62.630 31.639 2.171 1.00 27.93 C ATOM 1866 OH TYR E 262 62.505 30.650 1.210 1.00 27.27 O ATOM 1867 N TYR E 263 63.916 37.833 5.847 1.00 15.28 N ATOM 1868 CA TYR E 263 64.128 38.723 6.998 1.00 14.43 C ATOM 1869 C TYR E 263 64.550 40.135 6.610 1.00 14.57 C ATOM 1870 O TYR E 263 64.806 40.939 7.501 1.00 14.24 O ATOM 1871 CB TYR E 263 65.198 38.129 7.910 1.00 15.09 C ATOM 1872 CG TYR E 263 64.696 36.956 8.718 1.00 15.71 C ATOM 1873 CD1 TYR E 263 64.072 37.147 9.961 1.00 16.44 C ATOM 1874 CD2 TYR E 263 64.852 35.638 8.240 1.00 17.51 C ATOM 1875 CE1 TYR E 263 63.606 36.068 10.730 1.00 16.91 C ATOM 1876 CE2 TYR E 263 64.380 34.543 8.981 1.00 18.21 C ATOM 1877 CZ TYR E 263 63.747 34.759 10.226 1.00 17.79 C ATOM 1878 OH TYR E 263 63.261 33.713 11.005 1.00 19.38 O ATOM 1879 N GLY E 264 64.685 40.432 5.327 1.00 13.96 N ATOM 1880 CA GLY E 264 65.269 41.715 4.909 1.00 13.91 C ATOM 1881 C GLY E 264 66.596 41.908 5.618 1.00 13.94 C ATOM 1882 O GLY E 264 67.401 40.968 5.831 1.00 14.55 O ATOM 1883 N LYS E 265 66.857 43.153 6.049 1.00 12.73 N ATOM 1884 CA LYS E 265 68.059 43.427 6.821 1.00 12.18 C ATOM 1885 C LYS E 265 68.064 43.039 8.304 1.00 11.28 C ATOM 1886 O LYS E 265 69.096 43.134 8.984 1.00 12.82 O ATOM 1887 CB LYS E 265 68.410 44.927 6.688 1.00 12.51 C ATOM 1888 CG LYS E 265 68.615 45.301 5.206 1.00 14.69 C ATOM 1889 CD LYS E 265 68.567 46.794 5.015 1.00 15.99 C ATOM 1890 CE LYS E 265 68.786 47.169 3.555 1.00 18.59 C ATOM 1891 NZ LYS E 265 67.642 46.745 2.648 1.00 22.37 N ATOM 1892 N GLY E 266 66.927 42.514 8.787 1.00 11.40 N ATOM 1893 CA GLY E 266 66.863 42.069 10.166 1.00 10.86 C ATOM 1894 C GLY E 266 65.979 43.000 11.013 1.00 10.41 C ATOM 1895 O GLY E 266 65.233 43.806 10.478 1.00 11.68 O ATOM 1896 N LEU E 267 66.128 42.822 12.310 1.00 10.97 N ATOM 1897 CA LEU E 267 65.290 43.538 13.278 1.00 10.46 C ATOM 1898 C LEU E 267 65.821 44.952 13.476 1.00 10.82 C ATOM 1899 O LEU E 267 66.987 45.142 13.783 1.00 10.34 O ATOM 1900 CB LEU E 267 65.364 42.799 14.622 1.00 11.53 C ATOM 1901 CG LEU E 267 64.686 43.464 15.845 1.00 9.49 C ATOM 1902 CD1 LEU E 267 63.182 43.430 15.674 1.00 10.87 C ATOM 1903 CD2 LEU E 267 65.113 42.795 17.106 1.00 12.11 C ATOM 1904 N ILE E 268 64.918 45.941 13.441 1.00 9.53 N ATOM 1905 CA ILE E 268 65.389 47.310 13.765 1.00 9.81 C ATOM 1906 C ILE E 268 65.841 47.469 15.192 1.00 10.37 C ATOM 1907 O ILE E 268 65.377 46.776 16.109 1.00 9.62 O ATOM 1908 CB ILE E 268 64.303 48.333 13.436 1.00 9.31 C ATOM 1909 CG1 ILE E 268 63.008 48.129 14.236 1.00 9.93 C ATOM 1910 CG2 ILE E 268 64.032 48.399 11.921 1.00 10.83 C ATOM 1911 CD1 ILE E 268 62.291 49.504 14.515 1.00 10.90 C ATOM 1912 N ASN E 269 66.783 48.393 15.386 1.00 9.34 N ATOM 1913 CA ASN E 269 67.381 48.703 16.648 1.00 9.36 C ATOM 1914 C ASN E 269 67.465 50.227 16.653 1.00 9.95 C ATOM 1915 O ASN E 269 68.376 50.806 16.064 1.00 10.12 O ATOM 1916 CB ASN E 269 68.772 48.041 16.761 1.00 10.11 C ATOM 1917 CG ASN E 269 69.520 48.509 17.966 1.00 11.51 C ATOM 1918 OD1 ASN E 269 69.120 49.457 18.687 1.00 11.00 O ATOM 1919 ND2 ASN E 269 70.626 47.809 18.251 1.00 12.66 N ATOM 1920 N VAL E 270 66.505 50.865 17.303 1.00 9.24 N ATOM 1921 CA VAL E 270 66.415 52.329 17.239 1.00 9.69 C ATOM 1922 C VAL E 270 67.525 52.974 18.083 1.00 10.42 C ATOM 1923 O VAL E 270 67.926 54.105 17.759 1.00 10.88 O ATOM 1924 CB VAL E 270 64.989 52.824 17.612 1.00 9.90 C ATOM 1925 CG1 VAL E 270 64.678 52.603 19.061 1.00 11.98 C ATOM 1926 CG2 VAL E 270 64.831 54.288 17.188 1.00 11.99 C ATOM 1927 N GLN E 271 68.046 52.293 19.109 1.00 10.11 N ATOM 1928 CA GLN E 271 69.166 52.836 19.882 1.00 10.82 C ATOM 1929 C GLN E 271 70.347 53.033 18.934 1.00 11.16 C ATOM 1930 O GLN E 271 70.966 54.113 18.913 1.00 12.01 O ATOM 1931 CB GLN E 271 69.520 51.876 21.046 1.00 10.97 C ATOM 1932 CG GLN E 271 70.754 52.346 21.823 1.00 12.84 C ATOM 1933 CD GLN E 271 71.108 51.385 22.932 1.00 14.16 C ATOM 1934 OE1 GLN E 271 70.896 50.168 22.791 1.00 18.25 O ATOM 1935 NE2 GLN E 271 71.598 51.914 24.047 1.00 16.01 N ATOM 1936 N ALA E 272 70.715 51.989 18.223 1.00 9.92 N ATOM 1937 CA ALA E 272 71.844 52.060 17.272 1.00 9.92 C ATOM 1938 C ALA E 272 71.547 53.027 16.126 1.00 11.07 C ATOM 1939 O ALA E 272 72.461 53.792 15.704 1.00 11.79 O ATOM 1940 CB ALA E 272 72.151 50.675 16.775 1.00 10.61 C ATOM 1941 N ALA E 273 70.290 53.071 15.645 1.00 9.37 N ATOM 1942 CA ALA E 273 69.955 53.936 14.516 1.00 9.00 C ATOM 1943 C ALA E 273 70.168 55.404 14.910 1.00 10.14 C ATOM 1944 O ALA E 273 70.470 56.244 14.047 1.00 11.89 O ATOM 1945 CB ALA E 273 68.495 53.753 14.107 1.00 8.83 C ATOM 1946 N ALA E 274 69.903 55.725 16.176 1.00 10.54 N ATOM 1947 CA ALA E 274 69.897 57.147 16.570 1.00 10.75 C ATOM 1948 C ALA E 274 71.268 57.620 17.008 1.00 12.21 C ATOM 1949 O ALA E 274 71.381 58.755 17.487 1.00 12.82 O ATOM 1950 CB ALA E 274 68.812 57.409 17.648 1.00 11.82 C ATOM 1951 N GLN E 275 72.309 56.783 16.867 1.00 12.16 N ATOM 1952 CA GLN E 275 73.707 57.217 17.096 1.00 13.34 C ATOM 1953 C GLN E 275 74.200 57.902 15.843 1.00 13.82 C ATOM 1954 O GLN E 275 73.571 57.776 14.789 1.00 14.77 O ATOM 1955 CB GLN E 275 74.565 55.971 17.368 1.00 14.25 C ATOM 1956 CG GLN E 275 74.314 55.352 18.763 1.00 16.61 C ATOM 1957 CD GLN E 275 74.436 56.408 19.919 1.00 23.56 C ATOM 1958 OE1 GLN E 275 73.445 57.055 20.332 1.00 30.86 O ATOM 1959 NE2 GLN E 275 75.653 56.604 20.406 1.00 31.68 N ATOM 1960 N AHIS E 276 75.323 58.616 15.885 0.50 14.40 N ATOM 1961 N BHIS E 276 75.347 58.596 15.999 0.50 14.44 N ATOM 1962 CA AHIS E 276 75.803 59.163 14.616 0.50 14.39 C ATOM 1963 CA BHIS E 276 76.058 59.269 14.906 0.50 15.24 C ATOM 1964 C AHIS E 276 76.419 58.083 13.730 0.50 15.88 C ATOM 1965 C BHIS E 276 76.596 58.280 13.862 0.50 16.13 C ATOM 1966 O AHIS E 276 76.184 58.047 12.514 0.50 17.74 O ATOM 1967 O BHIS E 276 76.519 58.539 12.667 0.50 17.16 O ATOM 1968 CB AHIS E 276 76.794 60.286 14.866 0.50 13.79 C ATOM 1969 CB BHIS E 276 77.271 60.078 15.455 0.50 13.86 C ATOM 1970 CG AHIS E 276 76.130 61.573 15.244 0.50 12.71 C ATOM 1971 CG BHIS E 276 76.923 61.154 16.448 0.50 14.29 C ATOM 1972 ND1AHIS E 276 76.214 62.113 16.510 0.50 11.95 N ATOM 1973 ND1BHIS E 276 75.976 62.128 16.205 0.50 13.99 N ATOM 1974 CD2AHIS E 276 75.372 62.426 14.518 0.50 11.59 C ATOM 1975 CD2BHIS E 276 77.407 61.401 17.691 0.50 14.27 C ATOM 1976 CE1AHIS E 276 75.526 63.243 16.546 0.50 13.13 C ATOM 1977 CE1BHIS E 276 75.901 62.936 17.251 0.50 15.74 C ATOM 1978 NE2AHIS E 276 75.004 63.453 15.355 0.50 8.68 N ATOM 1979 NE2BHIS E 276 76.753 62.518 18.167 0.50 14.99 N ATOM 1980 N HIS E 277 77.160 57.180 14.350 1.00 15.57 N ATOM 1981 CA HIS E 277 77.821 56.147 13.560 1.00 17.66 C ATOM 1982 C HIS E 277 77.051 54.857 13.607 1.00 15.49 C ATOM 1983 O HIS E 277 76.615 54.440 14.647 1.00 17.16 O ATOM 1984 CB HIS E 277 79.244 55.992 14.048 1.00 20.56 C ATOM 1985 CG HIS E 277 80.026 57.268 13.899 1.00 28.90 C ATOM 1986 ND1 HIS E 277 80.591 57.929 14.968 1.00 35.08 N ATOM 1987 CD2 HIS E 277 80.213 58.071 12.820 1.00 34.99 C ATOM 1988 CE1 HIS E 277 81.160 59.045 14.543 1.00 36.48 C ATOM 1989 NE2 HIS E 277 80.928 59.167 13.248 1.00 35.59 N ATOM 1990 N HIS E 278 76.840 54.312 12.434 1.00 14.64 N ATOM 1991 CA HIS E 278 75.915 53.189 12.296 1.00 13.37 C ATOM 1992 C HIS E 278 76.603 51.905 11.921 1.00 13.24 C ATOM 1993 O HIS E 278 77.437 51.869 11.011 1.00 14.25 O ATOM 1994 CB HIS E 278 74.888 53.487 11.223 1.00 13.19 C ATOM 1995 CG HIS E 278 74.063 54.705 11.546 1.00 11.70 C ATOM 1996 ND1 HIS E 278 73.788 55.683 10.630 1.00 15.64 N ATOM 1997 CD2 HIS E 278 73.482 55.097 12.712 1.00 13.95 C ATOM 1998 CE1 HIS E 278 73.068 56.644 11.209 1.00 16.07 C ATOM 1999 NE2 HIS E 278 72.836 56.288 12.458 1.00 15.16 N ATOM 2000 N HIS E 279 76.258 50.850 12.613 1.00 12.88 N ATOM 2001 CA HIS E 279 76.619 49.485 12.188 1.00 13.30 C ATOM 2002 C HIS E 279 75.604 48.515 12.739 1.00 13.15 C ATOM 2003 O HIS E 279 74.813 48.855 13.640 1.00 12.59 O ATOM 2004 CB HIS E 279 78.036 49.113 12.666 1.00 15.72 C ATOM 2005 CG HIS E 279 78.241 49.280 14.136 1.00 18.94 C ATOM 2006 ND1 HIS E 279 78.706 50.455 14.692 1.00 26.52 N ATOM 2007 CD2 HIS E 279 78.061 48.421 15.167 1.00 26.13 C ATOM 2008 CE1 HIS E 279 78.790 50.316 16.008 1.00 28.03 C ATOM 2009 NE2 HIS E 279 78.429 49.082 16.319 1.00 26.55 N ATOM 2010 N HIS E 280 75.642 47.302 12.196 1.00 11.97 N ATOM 2011 CA HIS E 280 74.743 46.232 12.630 1.00 13.43 C ATOM 2012 C HIS E 280 75.213 45.606 13.926 1.00 14.75 C ATOM 2013 O HIS E 280 76.422 45.522 14.205 1.00 14.15 O ATOM 2014 CB HIS E 280 74.650 45.158 11.571 1.00 13.38 C ATOM 2015 CG HIS E 280 74.093 45.648 10.280 1.00 13.33 C ATOM 2016 ND1 HIS E 280 72.747 45.954 10.127 1.00 11.37 N ATOM 2017 CD2 HIS E 280 74.682 45.896 9.078 1.00 12.79 C ATOM 2018 CE1 HIS E 280 72.537 46.362 8.887 1.00 10.25 C ATOM 2019 NE2 HIS E 280 73.691 46.323 8.227 1.00 11.68 N ATOM 2020 N HIS E 281 74.254 45.173 14.737 1.00 16.81 N ATOM 2021 CA HIS E 281 74.621 44.409 15.941 1.00 19.58 C ATOM 2022 C HIS E 281 74.113 43.021 15.780 1.00 19.78 C ATOM 2023 O HIS E 281 74.299 42.331 16.817 1.00 22.96 O ATOM 2024 CB HIS E 281 74.069 45.035 17.250 1.00 19.92 C ATOM 2025 CG HIS E 281 74.574 46.402 17.513 1.00 20.69 C ATOM 2026 ND1 HIS E 281 75.421 46.693 18.564 1.00 27.39 N ATOM 2027 CD2 HIS E 281 74.349 47.573 16.877 1.00 24.89 C ATOM 2028 CE1 HIS E 281 75.696 47.986 18.557 1.00 28.70 C ATOM 2029 NE2 HIS E 281 75.069 48.537 17.533 1.00 28.17 N ATOM 2030 OXT HIS E 281 73.621 42.600 14.717 1.00 20.42 O TER 2031 HIS E 281 ATOM 2032 C MET I 20 44.505 23.066 6.598 1.00 35.41 C ATOM 2033 O MET I 20 45.508 23.712 6.239 1.00 36.94 O ATOM 2034 N LYS I 21 43.409 22.952 5.849 1.00 34.76 N ATOM 2035 CA LYS I 21 43.239 23.763 4.626 1.00 32.94 C ATOM 2036 C LYS I 21 43.181 25.256 4.934 1.00 30.50 C ATOM 2037 O LYS I 21 42.283 25.689 5.662 1.00 31.43 O ATOM 2038 CB LYS I 21 41.984 23.354 3.854 1.00 33.92 C ATOM 2039 CG LYS I 21 41.981 23.935 2.439 1.00 32.92 C ATOM 2040 CD LYS I 21 41.091 23.182 1.487 1.00 35.12 C ATOM 2041 CE LYS I 21 41.382 23.586 0.058 1.00 35.53 C ATOM 2042 NZ LYS I 21 40.536 22.803 -0.880 1.00 40.70 N ATOM 2043 N THR I 22 44.121 26.034 4.385 1.00 27.37 N ATOM 2044 CA THR I 22 44.127 27.495 4.591 1.00 25.40 C ATOM 2045 C THR I 22 44.084 28.359 3.315 1.00 22.77 C ATOM 2046 O THR I 22 44.105 29.586 3.402 1.00 21.10 O ATOM 2047 CB THR I 22 45.328 27.970 5.454 1.00 26.14 C ATOM 2048 OG1 THR I 22 46.548 27.666 4.778 1.00 29.24 O ATOM 2049 CG2 THR I 22 45.425 27.192 6.781 1.00 29.09 C ATOM 2050 N GLU I 23 44.029 27.744 2.135 1.00 20.37 N ATOM 2051 CA GLU I 23 43.938 28.510 0.880 1.00 19.90 C ATOM 2052 C GLU I 23 43.027 27.700 -0.040 1.00 17.91 C ATOM 2053 O GLU I 23 43.027 26.440 0.039 1.00 17.05 O ATOM 2054 CB GLU I 23 45.296 28.594 0.168 1.00 22.07 C ATOM 2055 CG GLU I 23 46.363 29.473 0.819 1.00 29.87 C ATOM 2056 CD GLU I 23 47.559 29.610 -0.114 1.00 38.22 C ATOM 2057 OE1 GLU I 23 47.746 30.703 -0.690 1.00 43.86 O ATOM 2058 OE2 GLU I 23 48.281 28.604 -0.318 1.00 42.78 O ATOM 2059 N TRP I 24 42.294 28.394 -0.929 1.00 15.44 N ATOM 2060 CA TRP I 24 41.304 27.721 -1.787 1.00 15.80 C ATOM 2061 C TRP I 24 41.481 28.176 -3.237 1.00 16.19 C ATOM 2062 O TRP I 24 40.618 28.842 -3.823 1.00 15.17 O ATOM 2063 CB TRP I 24 39.877 28.021 -1.320 1.00 15.81 C ATOM 2064 CG TRP I 24 39.475 27.395 0.001 1.00 14.90 C ATOM 2065 CD1 TRP I 24 38.736 26.263 0.182 1.00 15.76 C ATOM 2066 CD2 TRP I 24 39.745 27.895 1.314 1.00 13.71 C ATOM 2067 NE1 TRP I 24 38.547 26.011 1.523 1.00 17.26 N ATOM 2068 CE2 TRP I 24 39.165 26.990 2.247 1.00 15.06 C ATOM 2069 CE3 TRP I 24 40.402 29.034 1.804 1.00 13.02 C ATOM 2070 CZ2 TRP I 24 39.236 27.180 3.644 1.00 16.52 C ATOM 2071 CZ3 TRP I 24 40.484 29.229 3.191 1.00 15.60 C ATOM 2072 CH2 TRP I 24 39.899 28.302 4.091 1.00 15.78 C ATOM 2073 N PRO I 25 42.581 27.813 -3.874 1.00 17.14 N ATOM 2074 CA PRO I 25 42.793 28.286 -5.255 1.00 16.99 C ATOM 2075 C PRO I 25 41.718 27.771 -6.253 1.00 17.14 C ATOM 2076 O PRO I 25 41.466 28.406 -7.267 1.00 17.82 O ATOM 2077 CB PRO I 25 44.195 27.752 -5.597 1.00 17.60 C ATOM 2078 CG PRO I 25 44.351 26.560 -4.691 1.00 17.83 C ATOM 2079 CD PRO I 25 43.664 26.931 -3.377 1.00 18.13 C ATOM 2080 N GLU I 26 41.076 26.673 -5.906 1.00 17.45 N ATOM 2081 CA GLU I 26 40.091 26.056 -6.784 1.00 19.17 C ATOM 2082 C GLU I 26 38.809 26.907 -6.840 1.00 18.56 C ATOM 2083 O GLU I 26 37.961 26.704 -7.714 1.00 19.12 O ATOM 2084 CB GLU I 26 39.802 24.636 -6.294 1.00 20.92 C ATOM 2085 CG GLU I 26 39.040 24.561 -4.977 1.00 22.23 C ATOM 2086 CD GLU I 26 39.901 24.582 -3.692 1.00 25.80 C ATOM 2087 OE1 GLU I 26 41.128 24.859 -3.727 1.00 25.12 O ATOM 2088 OE2 GLU I 26 39.322 24.298 -2.623 1.00 30.73 O ATOM 2089 N LEU I 27 38.704 27.896 -5.946 1.00 15.58 N ATOM 2090 CA LEU I 27 37.519 28.764 -5.905 1.00 14.66 C ATOM 2091 C LEU I 27 37.643 29.988 -6.810 1.00 13.80 C ATOM 2092 O LEU I 27 36.651 30.716 -7.014 1.00 14.01 O ATOM 2093 CB LEU I 27 37.197 29.182 -4.460 1.00 13.99 C ATOM 2094 CG LEU I 27 36.692 28.051 -3.555 1.00 16.40 C ATOM 2095 CD1 LEU I 27 36.443 28.611 -2.143 1.00 17.72 C ATOM 2096 CD2 LEU I 27 35.368 27.446 -4.086 1.00 18.50 C ATOM 2097 N VAL I 28 38.828 30.276 -7.349 1.00 15.31 N ATOM 2098 CA VAL I 28 38.957 31.466 -8.192 1.00 15.44 C ATOM 2099 C VAL I 28 38.069 31.263 -9.418 1.00 15.20 C ATOM 2100 O VAL I 28 38.080 30.180 -10.012 1.00 17.13 O ATOM 2101 CB VAL I 28 40.394 31.680 -8.655 1.00 15.90 C ATOM 2102 CG1 VAL I 28 40.465 32.850 -9.665 1.00 15.59 C ATOM 2103 CG2 VAL I 28 41.249 31.972 -7.420 1.00 17.27 C ATOM 2104 N GLY I 29 37.311 32.302 -9.768 1.00 14.52 N ATOM 2105 CA GLY I 29 36.398 32.202 -10.913 1.00 15.37 C ATOM 2106 C GLY I 29 35.023 31.623 -10.581 1.00 16.91 C ATOM 2107 O GLY I 29 34.118 31.661 -11.434 1.00 18.74 O ATOM 2108 N LYS I 30 34.836 31.102 -9.375 1.00 14.79 N ATOM 2109 CA LYS I 30 33.490 30.642 -8.916 1.00 13.07 C ATOM 2110 C LYS I 30 32.679 31.804 -8.375 1.00 13.27 C ATOM 2111 O LYS I 30 33.200 32.869 -8.080 1.00 12.48 O ATOM 2112 CB LYS I 30 33.614 29.558 -7.835 1.00 13.40 C ATOM 2113 CG LYS I 30 34.334 28.266 -8.289 1.00 18.97 C ATOM 2114 CD LYS I 30 33.780 27.735 -9.565 1.00 24.48 C ATOM 2115 CE LYS I 30 34.441 26.369 -9.924 1.00 31.55 C ATOM 2116 NZ LYS I 30 34.132 25.334 -8.906 1.00 36.03 N ATOM 2117 N SER I 31 31.374 31.617 -8.230 1.00 11.39 N ATOM 2118 CA SER I 31 30.547 32.634 -7.593 1.00 11.67 C ATOM 2119 C SER I 31 30.953 32.825 -6.126 1.00 11.48 C ATOM 2120 O SER I 31 31.420 31.895 -5.445 1.00 11.72 O ATOM 2121 CB SER I 31 29.071 32.202 -7.620 1.00 11.55 C ATOM 2122 OG SER I 31 28.865 30.994 -6.855 1.00 12.19 O ATOM 2123 N VAL I 32 30.654 33.992 -5.591 1.00 10.67 N ATOM 2124 CA VAL I 32 30.885 34.254 -4.177 1.00 11.93 C ATOM 2125 C VAL I 32 30.050 33.302 -3.308 1.00 11.89 C ATOM 2126 O VAL I 32 30.504 32.867 -2.270 1.00 12.44 O ATOM 2127 CB VAL I 32 30.636 35.762 -3.851 1.00 11.29 C ATOM 2128 CG1 VAL I 32 29.157 36.124 -3.957 1.00 13.64 C ATOM 2129 CG2 VAL I 32 31.174 36.100 -2.452 1.00 13.77 C ATOM 2130 N GLU I 33 28.855 32.914 -3.773 1.00 10.96 N ATOM 2131 CA GLU I 33 27.980 32.035 -3.013 1.00 11.10 C ATOM 2132 C GLU I 33 28.599 30.657 -2.883 1.00 11.00 C ATOM 2133 O GLU I 33 28.623 30.102 -1.795 1.00 11.15 O ATOM 2134 CB GLU I 33 26.635 31.888 -3.726 1.00 11.91 C ATOM 2135 CG GLU I 33 25.770 33.161 -3.720 1.00 13.00 C ATOM 2136 CD GLU I 33 26.079 34.187 -4.838 1.00 13.23 C ATOM 2137 OE1 GLU I 33 26.963 33.940 -5.715 1.00 11.82 O ATOM 2138 OE2 GLU I 33 25.387 35.285 -4.822 1.00 16.10 O ATOM 2139 N GLU I 34 29.084 30.112 -3.985 1.00 11.38 N ATOM 2140 CA GLU I 34 29.740 28.796 -3.866 1.00 12.19 C ATOM 2141 C GLU I 34 30.970 28.876 -2.981 1.00 12.39 C ATOM 2142 O GLU I 34 31.234 27.967 -2.189 1.00 11.92 O ATOM 2143 CB GLU I 34 30.152 28.270 -5.246 1.00 12.90 C ATOM 2144 CG GLU I 34 30.749 26.869 -5.149 1.00 15.87 C ATOM 2145 CD GLU I 34 30.942 26.184 -6.485 1.00 23.01 C ATOM 2146 OE1 GLU I 34 30.361 26.607 -7.513 1.00 20.02 O ATOM 2147 OE2 GLU I 34 31.680 25.170 -6.483 1.00 25.64 O ATOM 2148 N ALA I 35 31.770 29.924 -3.168 1.00 11.72 N ATOM 2149 CA ALA I 35 32.956 30.071 -2.316 1.00 11.65 C ATOM 2150 C ALA I 35 32.597 30.078 -0.836 1.00 12.13 C ATOM 2151 O ALA I 35 33.251 29.395 -0.020 1.00 11.70 O ATOM 2152 CB ALA I 35 33.744 31.358 -2.705 1.00 12.13 C ATOM 2153 N LYS I 36 31.583 30.854 -0.450 1.00 11.72 N ATOM 2154 CA LYS I 36 31.175 30.874 0.965 1.00 12.34 C ATOM 2155 C LYS I 36 30.789 29.459 1.439 1.00 12.46 C ATOM 2156 O LYS I 36 31.153 29.035 2.543 1.00 12.05 O ATOM 2157 CB LYS I 36 30.016 31.823 1.248 1.00 12.97 C ATOM 2158 CG LYS I 36 30.347 33.357 1.038 1.00 17.00 C ATOM 2159 CD LYS I 36 29.041 34.172 1.255 1.00 21.83 C ATOM 2160 CE LYS I 36 29.309 35.642 1.474 1.00 29.99 C ATOM 2161 NZ LYS I 36 28.039 36.463 1.570 1.00 33.26 N ATOM 2162 N LYS I 37 30.020 28.743 0.609 1.00 11.35 N ATOM 2163 CA LYS I 37 29.528 27.435 1.019 1.00 11.58 C ATOM 2164 C LYS I 37 30.714 26.514 1.258 1.00 11.70 C ATOM 2165 O LYS I 37 30.753 25.784 2.270 1.00 11.76 O ATOM 2166 CB LYS I 37 28.610 26.876 -0.060 1.00 11.79 C ATOM 2167 CG LYS I 37 28.161 25.473 0.330 1.00 14.10 C ATOM 2168 CD LYS I 37 27.114 24.972 -0.661 1.00 20.56 C ATOM 2169 CE LYS I 37 26.572 23.619 -0.146 1.00 24.85 C ATOM 2170 NZ LYS I 37 25.329 23.126 -0.916 1.00 28.57 N ATOM 2171 N VAL I 38 31.654 26.507 0.317 1.00 10.86 N ATOM 2172 CA VAL I 38 32.816 25.618 0.400 1.00 11.55 C ATOM 2173 C VAL I 38 33.708 25.966 1.583 1.00 12.02 C ATOM 2174 O VAL I 38 34.135 25.091 2.360 1.00 12.89 O ATOM 2175 CB VAL I 38 33.620 25.687 -0.908 1.00 12.74 C ATOM 2176 CG1 VAL I 38 34.987 24.961 -0.728 1.00 15.32 C ATOM 2177 CG2 VAL I 38 32.832 24.983 -2.025 1.00 15.31 C ATOM 2178 N ILE I 39 34.028 27.239 1.741 1.00 12.03 N ATOM 2179 CA ILE I 39 34.872 27.626 2.863 1.00 12.58 C ATOM 2180 C ILE I 39 34.214 27.246 4.213 1.00 11.59 C ATOM 2181 O ILE I 39 34.909 26.752 5.134 1.00 11.90 O ATOM 2182 CB ILE I 39 35.176 29.131 2.755 1.00 13.13 C ATOM 2183 CG1 ILE I 39 36.203 29.345 1.623 1.00 16.18 C ATOM 2184 CG2 ILE I 39 35.786 29.661 4.104 1.00 14.41 C ATOM 2185 CD1 ILE I 39 36.149 30.782 1.030 1.00 15.31 C ATOM 2186 N LEU I 40 32.917 27.458 4.377 1.00 12.20 N ATOM 2187 CA LEU I 40 32.231 27.120 5.616 1.00 12.10 C ATOM 2188 C LEU I 40 32.139 25.605 5.842 1.00 12.86 C ATOM 2189 O LEU I 40 31.994 25.176 6.992 1.00 13.73 O ATOM 2190 CB LEU I 40 30.854 27.773 5.677 1.00 12.09 C ATOM 2191 CG LEU I 40 30.890 29.328 5.798 1.00 13.47 C ATOM 2192 CD1 LEU I 40 29.504 29.881 5.631 1.00 18.69 C ATOM 2193 CD2 LEU I 40 31.422 29.681 7.185 1.00 14.89 C ATOM 2194 N GLN I 41 32.262 24.804 4.780 1.00 12.03 N ATOM 2195 CA GLN I 41 32.357 23.349 5.013 1.00 12.53 C ATOM 2196 C GLN I 41 33.710 23.019 5.599 1.00 13.17 C ATOM 2197 O GLN I 41 33.834 22.137 6.470 1.00 13.77 O ATOM 2198 CB GLN I 41 32.167 22.570 3.729 1.00 13.50 C ATOM 2199 CG GLN I 41 30.761 22.659 3.236 1.00 12.65 C ATOM 2200 CD GLN I 41 30.502 21.834 1.986 1.00 16.64 C ATOM 2201 OE1 GLN I 41 29.341 21.529 1.701 1.00 17.26 O ATOM 2202 NE2 GLN I 41 31.540 21.547 1.201 1.00 18.11 N ATOM 2203 N ASP I 42 34.757 23.670 5.102 1.00 12.52 N ATOM 2204 CA ASP I 42 36.116 23.368 5.575 1.00 13.84 C ATOM 2205 C ASP I 42 36.438 24.029 6.914 1.00 13.57 C ATOM 2206 O ASP I 42 37.276 23.525 7.670 1.00 15.11 O ATOM 2207 CB ASP I 42 37.160 23.839 4.546 1.00 12.90 C ATOM 2208 CG ASP I 42 37.112 23.065 3.249 1.00 18.28 C ATOM 2209 OD1 ASP I 42 36.597 21.901 3.263 1.00 22.69 O ATOM 2210 OD2 ASP I 42 37.509 23.563 2.164 1.00 17.70 O ATOM 2211 N LYS I 43 35.839 25.191 7.154 1.00 12.24 N ATOM 2212 CA LYS I 43 36.159 26.053 8.306 1.00 11.96 C ATOM 2213 C LYS I 43 34.858 26.640 8.788 1.00 13.55 C ATOM 2214 O LYS I 43 34.520 27.781 8.462 1.00 13.00 O ATOM 2215 CB LYS I 43 37.132 27.152 7.827 1.00 12.67 C ATOM 2216 CG LYS I 43 37.707 28.039 8.915 1.00 13.81 C ATOM 2217 CD LYS I 43 38.661 29.036 8.255 1.00 16.40 C ATOM 2218 CE LYS I 43 39.128 30.083 9.265 1.00 18.90 C ATOM 2219 NZ LYS I 43 40.011 29.470 10.315 1.00 21.51 N ATOM 2220 N PRO I 44 34.016 25.860 9.460 1.00 12.35 N ATOM 2221 CA PRO I 44 32.669 26.326 9.781 1.00 14.38 C ATOM 2222 C PRO I 44 32.563 27.550 10.667 1.00 14.77 C ATOM 2223 O PRO I 44 31.516 28.184 10.627 1.00 14.60 O ATOM 2224 CB PRO I 44 32.018 25.110 10.507 1.00 15.29 C ATOM 2225 CG PRO I 44 32.861 23.983 10.168 1.00 15.49 C ATOM 2226 CD PRO I 44 34.234 24.440 9.824 1.00 13.71 C ATOM 2227 N ALA I 45 33.602 27.868 11.439 1.00 15.35 N ATOM 2228 CA ALA I 45 33.582 29.070 12.269 1.00 17.11 C ATOM 2229 C ALA I 45 34.204 30.275 11.560 1.00 17.13 C ATOM 2230 O ALA I 45 34.433 31.310 12.199 1.00 18.41 O ATOM 2231 CB ALA I 45 34.310 28.784 13.615 1.00 17.72 C ATOM 2232 N ALA I 46 34.457 30.182 10.249 1.00 15.39 N ATOM 2233 CA ALA I 46 35.134 31.275 9.500 1.00 15.16 C ATOM 2234 C ALA I 46 34.313 32.556 9.555 1.00 15.92 C ATOM 2235 O ALA I 46 33.068 32.525 9.415 1.00 15.94 O ATOM 2236 CB ALA I 46 35.380 30.866 8.049 1.00 15.31 C ATOM 2237 N GLN I 47 35.002 33.693 9.735 1.00 15.64 N ATOM 2238 CA GLN I 47 34.389 35.008 9.626 1.00 16.61 C ATOM 2239 C GLN I 47 34.681 35.473 8.225 1.00 15.48 C ATOM 2240 O GLN I 47 35.834 35.828 7.897 1.00 16.97 O ATOM 2241 CB GLN I 47 34.997 35.931 10.681 1.00 17.27 C ATOM 2242 CG AGLN I 47 34.851 35.351 12.069 0.67 21.09 C ATOM 2243 CG BGLN I 47 34.334 35.800 12.048 0.33 19.99 C ATOM 2244 CD AGLN I 47 33.388 35.170 12.443 0.67 28.04 C ATOM 2245 CD BGLN I 47 35.280 36.088 13.217 0.33 21.10 C ATOM 2246 OE1AGLN I 47 32.623 36.144 12.477 0.67 31.70 O ATOM 2247 OE1BGLN I 47 35.179 35.460 14.276 0.33 22.20 O ATOM 2248 NE2AGLN I 47 32.985 33.922 12.689 0.67 30.92 N ATOM 2249 NE2BGLN I 47 36.205 37.023 13.022 0.33 23.81 N ATOM 2250 N ILE I 48 33.676 35.398 7.360 1.00 14.25 N ATOM 2251 CA ILE I 48 33.878 35.672 5.944 1.00 15.42 C ATOM 2252 C ILE I 48 33.493 37.095 5.650 1.00 16.93 C ATOM 2253 O ILE I 48 32.396 37.520 6.018 1.00 19.04 O ATOM 2254 CB ILE I 48 33.052 34.689 5.043 1.00 15.05 C ATOM 2255 CG1 ILE I 48 33.643 33.282 5.190 1.00 15.57 C ATOM 2256 CG2 ILE I 48 33.082 35.172 3.588 1.00 18.52 C ATOM 2257 CD1 ILE I 48 32.783 32.200 4.529 1.00 19.80 C ATOM 2258 N ILE I 49 34.396 37.846 5.008 1.00 16.29 N ATOM 2259 CA ILE I 49 34.032 39.196 4.579 1.00 16.93 C ATOM 2260 C ILE I 49 34.281 39.351 3.088 1.00 15.70 C ATOM 2261 O ILE I 49 35.347 38.981 2.595 1.00 15.57 O ATOM 2262 CB ILE I 49 34.789 40.272 5.413 1.00 18.81 C ATOM 2263 CG1AILE I 49 34.110 41.628 5.197 0.50 19.64 C ATOM 2264 CG1BILE I 49 34.477 40.132 6.912 0.50 20.45 C ATOM 2265 CG2AILE I 49 36.221 40.290 5.080 0.50 17.22 C ATOM 2266 CG2BILE I 49 34.494 41.658 4.873 0.50 19.14 C ATOM 2267 CD1AILE I 49 34.245 42.609 6.371 0.50 22.63 C ATOM 2268 CD1BILE I 49 35.638 39.704 7.725 0.50 25.96 C ATOM 2269 N VAL I 50 33.286 39.857 2.390 1.00 15.34 N ATOM 2270 CA VAL I 50 33.344 39.998 0.954 1.00 14.91 C ATOM 2271 C VAL I 50 33.730 41.449 0.644 1.00 16.27 C ATOM 2272 O VAL I 50 33.077 42.402 1.106 1.00 17.07 O ATOM 2273 CB VAL I 50 31.980 39.671 0.309 1.00 15.32 C ATOM 2274 CG1 VAL I 50 31.974 39.915 -1.157 1.00 15.61 C ATOM 2275 CG2 VAL I 50 31.581 38.200 0.639 1.00 15.46 C ATOM 2276 N LEU I 51 34.790 41.587 -0.137 1.00 15.53 N ATOM 2277 CA LEU I 51 35.362 42.909 -0.456 1.00 16.03 C ATOM 2278 C LEU I 51 35.585 42.977 -1.963 1.00 16.75 C ATOM 2279 O LEU I 51 35.835 41.977 -2.647 1.00 15.40 O ATOM 2280 CB LEU I 51 36.712 43.057 0.277 1.00 15.95 C ATOM 2281 CG LEU I 51 36.672 42.944 1.821 1.00 18.39 C ATOM 2282 CD1 LEU I 51 38.074 42.979 2.418 1.00 19.51 C ATOM 2283 CD2 LEU I 51 35.822 44.092 2.453 1.00 21.49 C ATOM 2284 N PRO I 52 35.581 44.176 -2.521 1.00 18.20 N ATOM 2285 CA PRO I 52 35.869 44.326 -3.948 1.00 17.57 C ATOM 2286 C PRO I 52 37.341 44.035 -4.254 1.00 18.41 C ATOM 2287 O PRO I 52 38.207 44.502 -3.499 1.00 18.68 O ATOM 2288 CB PRO I 52 35.557 45.822 -4.224 1.00 18.75 C ATOM 2289 CG PRO I 52 34.877 46.313 -3.042 1.00 19.38 C ATOM 2290 CD PRO I 52 35.295 45.457 -1.846 1.00 18.64 C ATOM 2291 N VAL I 53 37.623 43.275 -5.308 1.00 18.13 N ATOM 2292 CA VAL I 53 38.984 43.081 -5.776 1.00 19.96 C ATOM 2293 C VAL I 53 39.555 44.476 -6.150 1.00 19.12 C ATOM 2294 O VAL I 53 38.818 45.377 -6.556 1.00 21.82 O ATOM 2295 CB VAL I 53 39.039 42.057 -6.953 1.00 20.48 C ATOM 2296 CG1 VAL I 53 38.504 42.628 -8.252 1.00 20.88 C ATOM 2297 CG2 VAL I 53 40.475 41.451 -7.136 1.00 21.49 C ATOM 2298 N GLY I 54 40.852 44.648 -5.931 1.00 21.14 N ATOM 2299 CA GLY I 54 41.453 45.929 -6.261 1.00 21.01 C ATOM 2300 C GLY I 54 41.256 47.007 -5.196 1.00 22.45 C ATOM 2301 O GLY I 54 41.367 48.219 -5.489 1.00 24.63 O ATOM 2302 N THR I 55 40.939 46.601 -3.972 1.00 20.12 N ATOM 2303 CA THR I 55 40.942 47.563 -2.855 1.00 20.04 C ATOM 2304 C THR I 55 42.189 47.295 -2.045 1.00 18.48 C ATOM 2305 O THR I 55 42.847 46.278 -2.189 1.00 19.17 O ATOM 2306 CB THR I 55 39.714 47.462 -1.946 1.00 20.53 C ATOM 2307 OG1 THR I 55 39.453 46.096 -1.600 1.00 20.94 O ATOM 2308 CG2 THR I 55 38.489 47.952 -2.685 1.00 21.77 C ATOM 2309 N ILE I 56 42.509 48.261 -1.199 1.00 16.91 N ATOM 2310 CA ILE I 56 43.611 48.126 -0.262 1.00 17.49 C ATOM 2311 C ILE I 56 42.955 47.778 1.081 1.00 15.63 C ATOM 2312 O ILE I 56 41.871 48.278 1.367 1.00 15.73 O ATOM 2313 CB ILE I 56 44.318 49.498 -0.216 1.00 18.22 C ATOM 2314 CG1 ILE I 56 45.113 49.687 -1.531 1.00 21.45 C ATOM 2315 CG2 ILE I 56 45.142 49.634 1.085 1.00 20.21 C ATOM 2316 CD1AILE I 56 45.764 51.044 -1.750 0.67 24.19 C ATOM 2317 CD1BILE I 56 46.394 48.917 -1.642 0.33 17.88 C ATOM 2318 N VAL I 57 43.592 46.882 1.836 1.00 14.36 N ATOM 2319 CA VAL I 57 42.998 46.413 3.085 1.00 14.07 C ATOM 2320 C VAL I 57 44.004 46.432 4.237 1.00 12.91 C ATOM 2321 O VAL I 57 45.223 46.396 4.005 1.00 13.48 O ATOM 2322 CB VAL I 57 42.429 44.942 2.942 1.00 14.67 C ATOM 2323 CG1 VAL I 57 41.298 44.919 1.847 1.00 16.22 C ATOM 2324 CG2 VAL I 57 43.550 43.937 2.613 1.00 13.61 C ATOM 2325 N THR I 58 43.493 46.411 5.461 1.00 12.17 N ATOM 2326 CA THR I 58 44.353 46.300 6.665 1.00 12.55 C ATOM 2327 C THR I 58 45.233 45.065 6.604 1.00 13.96 C ATOM 2328 O THR I 58 44.854 43.962 6.096 1.00 14.04 O ATOM 2329 CB THR I 58 43.520 46.227 7.951 1.00 13.45 C ATOM 2330 OG1 THR I 58 42.585 45.112 7.847 1.00 14.10 O ATOM 2331 CG2 THR I 58 42.667 47.466 8.137 1.00 12.67 C ATOM 2332 N ALA I 59 46.452 45.216 7.099 1.00 11.85 N ATOM 2333 CA ALA I 59 47.421 44.125 7.092 1.00 12.00 C ATOM 2334 C ALA I 59 47.622 43.424 8.467 1.00 11.07 C ATOM 2335 O ALA I 59 48.727 42.992 8.850 1.00 12.17 O ATOM 2336 CB ALA I 59 48.773 44.662 6.561 1.00 11.58 C ATOM 2337 N GLU I 60 46.520 43.217 9.171 1.00 12.69 N ATOM 2338 CA GLU I 60 46.526 42.401 10.373 1.00 12.60 C ATOM 2339 C GLU I 60 46.171 40.955 9.981 1.00 13.23 C ATOM 2340 O GLU I 60 45.550 40.719 8.935 1.00 13.88 O ATOM 2341 CB GLU I 60 45.682 42.999 11.507 1.00 13.05 C ATOM 2342 CG GLU I 60 44.212 42.564 11.572 1.00 14.85 C ATOM 2343 CD GLU I 60 43.292 43.101 10.479 1.00 14.99 C ATOM 2344 OE1 GLU I 60 43.734 43.335 9.345 1.00 14.94 O ATOM 2345 OE2 GLU I 60 42.079 43.263 10.756 1.00 16.63 O ATOM 2346 N TYR I 61 46.634 40.030 10.790 1.00 13.32 N ATOM 2347 CA TYR I 61 46.430 38.608 10.525 1.00 14.93 C ATOM 2348 C TYR I 61 45.438 38.019 11.519 1.00 15.40 C ATOM 2349 O TYR I 61 45.645 38.034 12.740 1.00 14.80 O ATOM 2350 CB TYR I 61 47.768 37.893 10.580 1.00 15.80 C ATOM 2351 CG TYR I 61 47.658 36.410 10.330 1.00 18.84 C ATOM 2352 CD1 TYR I 61 47.554 35.931 9.028 1.00 18.63 C ATOM 2353 CD2 TYR I 61 47.683 35.526 11.392 1.00 23.41 C ATOM 2354 CE1 TYR I 61 47.458 34.542 8.780 1.00 25.83 C ATOM 2355 CE2 TYR I 61 47.569 34.154 11.164 1.00 28.37 C ATOM 2356 CZ TYR I 61 47.465 33.687 9.873 1.00 27.34 C ATOM 2357 OH TYR I 61 47.346 32.315 9.669 1.00 34.31 O ATOM 2358 N ARG I 62 44.324 37.521 10.979 1.00 15.50 N ATOM 2359 CA ARG I 62 43.205 37.014 11.768 1.00 16.69 C ATOM 2360 C ARG I 62 43.012 35.580 11.323 1.00 17.30 C ATOM 2361 O ARG I 62 42.532 35.324 10.200 1.00 16.44 O ATOM 2362 CB ARG I 62 41.930 37.830 11.496 1.00 16.22 C ATOM 2363 CG AARG I 62 41.956 39.193 12.123 0.50 17.95 C ATOM 2364 CG BARG I 62 41.860 39.206 12.277 0.50 16.35 C ATOM 2365 CD AARG I 62 41.486 39.116 13.529 0.50 18.04 C ATOM 2366 CD BARG I 62 40.577 40.037 12.052 0.50 14.08 C ATOM 2367 NE AARG I 62 40.182 38.462 13.626 0.50 24.39 N ATOM 2368 NE BARG I 62 40.576 41.365 12.687 0.50 19.04 N ATOM 2369 CZ AARG I 62 39.026 39.017 13.293 0.50 24.90 C ATOM 2370 CZ BARG I 62 40.006 41.633 13.856 0.50 20.43 C ATOM 2371 NH1AARG I 62 38.962 40.262 12.818 0.50 26.21 N ATOM 2372 NH1BARG I 62 39.402 40.661 14.529 0.50 23.63 N ATOM 2373 NH2AARG I 62 37.913 38.317 13.452 0.50 25.96 N ATOM 2374 NH2BARG I 62 40.056 42.868 14.366 0.50 21.24 N ATOM 2375 N ILE I 63 43.337 34.647 12.214 1.00 18.10 N ATOM 2376 CA ILE I 63 43.256 33.231 11.902 1.00 20.56 C ATOM 2377 C ILE I 63 41.812 32.752 11.633 1.00 19.14 C ATOM 2378 O ILE I 63 41.618 31.747 10.958 1.00 21.38 O ATOM 2379 CB ILE I 63 43.899 32.420 13.089 1.00 22.02 C ATOM 2380 CG1 ILE I 63 44.125 30.958 12.693 1.00 27.85 C ATOM 2381 CG2 ILE I 63 43.075 32.584 14.365 1.00 24.34 C ATOM 2382 CD1 ILE I 63 45.357 30.329 13.393 1.00 31.65 C ATOM 2383 N ASP I 64 40.834 33.467 12.136 1.00 18.67 N ATOM 2384 CA ASP I 64 39.426 33.095 11.991 1.00 19.89 C ATOM 2385 C ASP I 64 38.796 33.686 10.721 1.00 18.99 C ATOM 2386 O ASP I 64 37.654 33.381 10.373 1.00 19.00 O ATOM 2387 CB ASP I 64 38.641 33.600 13.203 1.00 21.44 C ATOM 2388 CG AASP I 64 38.749 35.127 13.366 0.67 23.90 C ATOM 2389 CG BASP I 64 39.087 32.974 14.526 0.33 22.41 C ATOM 2390 OD1AASP I 64 39.884 35.684 13.434 0.67 27.34 O ATOM 2391 OD1BASP I 64 39.173 31.728 14.615 0.33 25.62 O ATOM 2392 OD2AASP I 64 37.744 35.851 13.417 0.67 27.82 O ATOM 2393 OD2BASP I 64 39.345 33.654 15.548 0.33 23.99 O ATOM 2394 N ARG I 65 39.503 34.582 10.040 1.00 16.10 N ATOM 2395 CA ARG I 65 38.915 35.314 8.917 1.00 15.06 C ATOM 2396 C ARG I 65 39.316 34.751 7.563 1.00 14.26 C ATOM 2397 O ARG I 65 40.443 34.326 7.352 1.00 13.60 O ATOM 2398 CB ARG I 65 39.439 36.751 8.981 1.00 14.28 C ATOM 2399 CG ARG I 65 38.881 37.670 7.864 1.00 15.34 C ATOM 2400 CD ARG I 65 39.249 39.165 8.088 1.00 15.60 C ATOM 2401 NE ARG I 65 40.722 39.310 8.087 1.00 14.68 N ATOM 2402 CZ ARG I 65 41.348 40.436 8.508 1.00 13.58 C ATOM 2403 NH1 ARG I 65 40.639 41.489 8.867 1.00 14.23 N ATOM 2404 NH2 ARG I 65 42.678 40.487 8.458 1.00 14.16 N ATOM 2405 N VAL I 66 38.376 34.786 6.613 1.00 13.27 N ATOM 2406 CA VAL I 66 38.648 34.603 5.194 1.00 13.64 C ATOM 2407 C VAL I 66 38.017 35.730 4.415 1.00 13.50 C ATOM 2408 O VAL I 66 36.792 35.895 4.396 1.00 14.44 O ATOM 2409 CB VAL I 66 38.107 33.233 4.668 1.00 13.73 C ATOM 2410 CG1 VAL I 66 38.473 33.056 3.216 1.00 13.81 C ATOM 2411 CG2 VAL I 66 38.674 32.075 5.495 1.00 12.89 C ATOM 2412 N ARG I 67 38.861 36.592 3.841 1.00 12.64 N ATOM 2413 CA ARG I 67 38.359 37.639 2.979 1.00 12.47 C ATOM 2414 C ARG I 67 38.137 37.041 1.584 1.00 12.39 C ATOM 2415 O ARG I 67 38.994 36.300 1.069 1.00 14.83 O ATOM 2416 CB ARG I 67 39.381 38.767 2.881 1.00 14.23 C ATOM 2417 CG ARG I 67 39.530 39.578 4.155 1.00 13.12 C ATOM 2418 CD ARG I 67 40.669 40.607 4.074 1.00 19.91 C ATOM 2419 NE ARG I 67 40.449 41.684 5.035 1.00 20.00 N ATOM 2420 CZ ARG I 67 41.464 42.436 5.534 1.00 21.24 C ATOM 2421 NH1 ARG I 67 42.691 42.144 5.203 1.00 22.01 N ATOM 2422 NH2 ARG I 67 41.205 43.422 6.345 1.00 24.21 N ATOM 2423 N LEU I 68 37.000 37.388 0.966 1.00 12.27 N ATOM 2424 CA LEU I 68 36.721 36.966 -0.409 1.00 12.63 C ATOM 2425 C LEU I 68 36.706 38.202 -1.295 1.00 12.79 C ATOM 2426 O LEU I 68 35.866 39.083 -1.074 1.00 14.20 O ATOM 2427 CB LEU I 68 35.336 36.284 -0.488 1.00 12.81 C ATOM 2428 CG LEU I 68 35.258 34.973 0.283 1.00 13.80 C ATOM 2429 CD1 LEU I 68 33.831 34.401 0.162 1.00 14.02 C ATOM 2430 CD2 LEU I 68 36.313 34.004 -0.193 1.00 15.00 C ATOM 2431 N PHE I 69 37.644 38.275 -2.222 1.00 12.39 N ATOM 2432 CA PHE I 69 37.734 39.430 -3.114 1.00 13.50 C ATOM 2433 C PHE I 69 37.015 39.113 -4.398 1.00 13.88 C ATOM 2434 O PHE I 69 37.365 38.142 -5.073 1.00 14.42 O ATOM 2435 CB PHE I 69 39.215 39.753 -3.385 1.00 13.92 C ATOM 2436 CG PHE I 69 39.903 40.348 -2.176 1.00 14.00 C ATOM 2437 CD1 PHE I 69 39.794 41.720 -1.908 1.00 15.52 C ATOM 2438 CD2 PHE I 69 40.596 39.549 -1.294 1.00 14.58 C ATOM 2439 CE1 PHE I 69 40.400 42.277 -0.770 1.00 17.61 C ATOM 2440 CE2 PHE I 69 41.211 40.127 -0.108 1.00 15.02 C ATOM 2441 CZ PHE I 69 41.093 41.491 0.101 1.00 15.53 C ATOM 2442 N VAL I 70 35.976 39.898 -4.677 1.00 13.32 N ATOM 2443 CA VAL I 70 35.187 39.638 -5.871 1.00 14.97 C ATOM 2444 C VAL I 70 35.311 40.690 -6.950 1.00 16.13 C ATOM 2445 O VAL I 70 35.569 41.866 -6.664 1.00 17.28 O ATOM 2446 CB VAL I 70 33.696 39.555 -5.481 1.00 15.79 C ATOM 2447 CG1 VAL I 70 33.457 38.274 -4.623 1.00 17.11 C ATOM 2448 CG2 VAL I 70 33.235 40.779 -4.709 1.00 17.90 C ATOM 2449 N ASP I 71 35.139 40.248 -8.184 1.00 16.53 N ATOM 2450 CA ASP I 71 35.041 41.187 -9.302 1.00 17.82 C ATOM 2451 C ASP I 71 33.641 41.799 -9.370 1.00 18.01 C ATOM 2452 O ASP I 71 32.810 41.574 -8.489 1.00 18.21 O ATOM 2453 CB ASP I 71 35.504 40.543 -10.589 1.00 17.53 C ATOM 2454 CG ASP I 71 34.602 39.389 -11.055 1.00 19.81 C ATOM 2455 OD1 ASP I 71 33.404 39.362 -10.675 1.00 18.54 O ATOM 2456 OD2 ASP I 71 35.048 38.489 -11.783 1.00 22.75 O ATOM 2457 N ARG I 72 33.405 42.674 -10.374 1.00 20.00 N ATOM 2458 CA ARG I 72 32.138 43.405 -10.421 1.00 20.89 C ATOM 2459 C ARG I 72 30.948 42.503 -10.746 1.00 20.53 C ATOM 2460 O ARG I 72 29.819 42.948 -10.596 1.00 21.04 O ATOM 2461 CB ARG I 72 32.169 44.515 -11.487 1.00 21.86 C ATOM 2462 CG ARG I 72 32.462 43.958 -12.863 1.00 28.85 C ATOM 2463 CD ARG I 72 32.553 44.987 -14.029 1.00 38.79 C ATOM 2464 NE ARG I 72 31.848 44.486 -15.217 1.00 46.05 N ATOM 2465 CZ ARG I 72 32.246 43.457 -15.980 1.00 49.40 C ATOM 2466 NH1 ARG I 72 33.378 42.800 -15.720 1.00 51.85 N ATOM 2467 NH2 ARG I 72 31.511 43.088 -17.021 1.00 49.84 N ATOM 2468 N LEU I 73 31.221 41.250 -11.143 1.00 18.82 N ATOM 2469 CA LEU I 73 30.164 40.240 -11.414 1.00 17.38 C ATOM 2470 C LEU I 73 29.888 39.390 -10.166 1.00 17.34 C ATOM 2471 O LEU I 73 28.962 38.574 -10.209 1.00 16.70 O ATOM 2472 CB LEU I 73 30.562 39.334 -12.569 1.00 17.60 C ATOM 2473 CG LEU I 73 30.907 40.022 -13.909 1.00 20.32 C ATOM 2474 CD1 LEU I 73 31.277 39.026 -14.994 1.00 22.13 C ATOM 2475 CD2 LEU I 73 29.740 40.929 -14.334 1.00 21.51 C ATOM 2476 N ASP I 74 30.591 39.633 -9.053 1.00 16.09 N ATOM 2477 CA ASP I 74 30.464 38.823 -7.815 1.00 15.60 C ATOM 2478 C ASP I 74 31.049 37.411 -7.955 1.00 13.80 C ATOM 2479 O ASP I 74 30.601 36.483 -7.270 1.00 13.23 O ATOM 2480 CB ASP I 74 29.000 38.744 -7.321 1.00 16.50 C ATOM 2481 CG ASP I 74 28.805 39.374 -5.961 1.00 18.46 C ATOM 2482 OD1 ASP I 74 29.778 39.995 -5.426 1.00 24.49 O ATOM 2483 OD2 ASP I 74 27.704 39.383 -5.336 1.00 18.67 O ATOM 2484 N ASN I 75 32.049 37.272 -8.799 1.00 13.88 N ATOM 2485 CA ASN I 75 32.841 36.060 -8.862 1.00 13.97 C ATOM 2486 C ASN I 75 34.170 36.269 -8.138 1.00 13.93 C ATOM 2487 O ASN I 75 34.687 37.414 -8.085 1.00 13.77 O ATOM 2488 CB ASN I 75 33.089 35.661 -10.309 1.00 13.53 C ATOM 2489 CG ASN I 75 31.804 35.334 -11.047 1.00 14.77 C ATOM 2490 OD1 ASN I 75 30.896 34.761 -10.461 1.00 13.63 O ATOM 2491 ND2 ASN I 75 31.720 35.748 -12.305 1.00 14.16 N ATOM 2492 N ILE I 76 34.747 35.185 -7.624 1.00 13.47 N ATOM 2493 CA ILE I 76 35.995 35.297 -6.859 1.00 12.51 C ATOM 2494 C ILE I 76 37.131 35.604 -7.813 1.00 13.27 C ATOM 2495 O ILE I 76 37.319 34.918 -8.831 1.00 14.59 O ATOM 2496 CB ILE I 76 36.296 33.932 -6.163 1.00 12.44 C ATOM 2497 CG1 ILE I 76 35.190 33.551 -5.169 1.00 10.97 C ATOM 2498 CG2 ILE I 76 37.698 33.945 -5.482 1.00 13.00 C ATOM 2499 CD1 ILE I 76 34.930 34.646 -4.087 1.00 14.15 C ATOM 2500 N ALA I 77 37.921 36.627 -7.478 1.00 13.75 N ATOM 2501 CA ALA I 77 38.946 37.160 -8.387 1.00 16.08 C ATOM 2502 C ALA I 77 40.354 37.011 -7.839 1.00 17.87 C ATOM 2503 O ALA I 77 41.322 37.365 -8.543 1.00 20.68 O ATOM 2504 CB ALA I 77 38.695 38.631 -8.627 1.00 16.84 C ATOM 2505 N GLN I 78 40.482 36.472 -6.627 1.00 16.47 N ATOM 2506 CA GLN I 78 41.805 36.251 -6.007 1.00 17.01 C ATOM 2507 C GLN I 78 41.699 34.980 -5.161 1.00 16.10 C ATOM 2508 O GLN I 78 40.612 34.699 -4.650 1.00 15.80 O ATOM 2509 CB GLN I 78 42.089 37.460 -5.127 1.00 18.65 C ATOM 2510 CG GLN I 78 43.386 37.543 -4.401 1.00 22.71 C ATOM 2511 CD GLN I 78 43.486 38.923 -3.758 1.00 29.48 C ATOM 2512 OE1 GLN I 78 43.303 39.935 -4.446 1.00 27.11 O ATOM 2513 NE2 GLN I 78 43.687 38.969 -2.443 1.00 27.65 N ATOM 2514 N VAL I 79 42.792 34.234 -4.982 1.00 15.11 N ATOM 2515 CA VAL I 79 42.731 33.011 -4.190 1.00 15.72 C ATOM 2516 C VAL I 79 42.338 33.347 -2.749 1.00 14.67 C ATOM 2517 O VAL I 79 43.050 34.101 -2.053 1.00 15.62 O ATOM 2518 CB VAL I 79 44.127 32.290 -4.143 1.00 15.69 C ATOM 2519 CG1 VAL I 79 44.115 31.104 -3.209 1.00 16.39 C ATOM 2520 CG2 VAL I 79 44.551 31.868 -5.555 1.00 17.32 C ATOM 2521 N PRO I 80 41.205 32.830 -2.263 1.00 13.18 N ATOM 2522 CA PRO I 80 40.879 33.004 -0.841 1.00 13.74 C ATOM 2523 C PRO I 80 41.892 32.306 0.072 1.00 14.13 C ATOM 2524 O PRO I 80 42.323 31.184 -0.196 1.00 13.41 O ATOM 2525 CB PRO I 80 39.508 32.313 -0.706 1.00 13.66 C ATOM 2526 CG PRO I 80 38.963 32.304 -2.154 1.00 13.83 C ATOM 2527 CD PRO I 80 40.172 32.058 -3.014 1.00 12.76 C ATOM 2528 N ARG I 81 42.256 32.992 1.142 1.00 14.58 N ATOM 2529 CA ARG I 81 43.171 32.414 2.128 1.00 15.10 C ATOM 2530 C ARG I 81 42.735 32.867 3.513 1.00 14.78 C ATOM 2531 O ARG I 81 42.109 33.914 3.696 1.00 15.66 O ATOM 2532 CB ARG I 81 44.615 32.862 1.851 1.00 17.91 C ATOM 2533 CG ARG I 81 44.856 34.308 2.231 1.00 23.02 C ATOM 2534 CD ARG I 81 46.247 34.910 1.874 1.00 32.67 C ATOM 2535 NE ARG I 81 47.379 34.204 2.475 1.00 37.61 N ATOM 2536 CZ ARG I 81 48.091 33.256 1.850 1.00 41.09 C ATOM 2537 NH1 ARG I 81 47.783 32.899 0.604 1.00 43.17 N ATOM 2538 NH2 ARG I 81 49.109 32.667 2.470 1.00 40.50 N ATOM 2539 N VAL I 82 43.100 32.072 4.514 1.00 14.35 N ATOM 2540 CA VAL I 82 42.877 32.490 5.899 1.00 14.92 C ATOM 2541 C VAL I 82 43.799 33.661 6.218 1.00 15.69 C ATOM 2542 O VAL I 82 44.957 33.684 5.781 1.00 16.21 O ATOM 2543 CB VAL I 82 43.199 31.337 6.856 1.00 15.74 C ATOM 2544 CG1 VAL I 82 43.263 31.799 8.313 1.00 20.32 C ATOM 2545 CG2 VAL I 82 42.158 30.199 6.690 1.00 15.63 C ATOM 2546 N GLY I 83 43.264 34.629 6.947 1.00 14.72 N ATOM 2547 CA GLY I 83 44.101 35.681 7.505 1.00 16.13 C ATOM 2548 C GLY I 83 43.376 36.989 7.552 1.00 16.40 C ATOM 2549 O GLY I 83 43.892 37.944 8.204 1.00 16.15 O ATOM 2550 OXT GLY I 83 42.259 37.204 7.007 1.00 15.55 O TER 2551 GLY I 83 HETATM 2552 CA CA E 490 50.356 54.723 28.733 1.00 12.48 CA HETATM 2553 NA NA E 491 59.683 49.165 -0.555 1.00 14.47 NA HETATM 2554 C1 CIT E 492 73.978 68.083 9.181 1.00 17.54 C HETATM 2555 O1 CIT E 492 75.118 67.623 9.060 1.00 16.96 O HETATM 2556 O2 CIT E 492 73.411 68.658 8.210 1.00 19.41 O HETATM 2557 C2 CIT E 492 73.248 67.989 10.489 1.00 14.02 C HETATM 2558 C3 CIT E 492 73.971 67.266 11.670 1.00 19.61 C HETATM 2559 O7 CIT E 492 75.447 67.578 12.151 1.00 15.37 O HETATM 2560 C4 CIT E 492 72.753 67.016 12.655 1.00 13.78 C HETATM 2561 C5 CIT E 492 72.841 65.818 13.596 1.00 15.61 C HETATM 2562 O3 CIT E 492 73.939 65.292 13.785 1.00 15.80 O HETATM 2563 O4 CIT E 492 71.820 65.440 14.214 1.00 13.40 O HETATM 2564 C6 CIT E 492 74.359 66.037 11.178 1.00 26.49 C HETATM 2565 O5 CIT E 492 75.611 65.769 11.351 1.00 14.02 O HETATM 2566 O6 CIT E 492 73.374 65.469 10.664 1.00 15.20 O HETATM 2567 C1 CIT E 493 74.182 62.572 6.978 1.00 37.23 C HETATM 2568 O1 CIT E 493 74.838 61.871 6.156 1.00 38.85 O HETATM 2569 O2 CIT E 493 73.653 63.652 6.585 1.00 35.83 O HETATM 2570 C2 CIT E 493 74.012 62.088 8.420 1.00 33.39 C HETATM 2571 C3 CIT E 493 75.199 62.335 9.360 1.00 32.36 C HETATM 2572 O7 CIT E 493 75.124 61.615 10.653 1.00 29.62 O HETATM 2573 C4 CIT E 493 76.536 62.662 8.648 1.00 26.95 C HETATM 2574 C5 CIT E 493 77.551 63.437 9.507 1.00 28.51 C HETATM 2575 O3 CIT E 493 77.803 63.173 10.708 1.00 23.61 O HETATM 2576 O4 CIT E 493 78.196 64.412 9.020 1.00 30.92 O HETATM 2577 C6 CIT E 493 74.919 63.563 10.007 1.00 31.59 C HETATM 2578 O5 CIT E 493 74.699 63.449 11.258 1.00 16.73 O HETATM 2579 O6 CIT E 493 75.012 64.573 9.261 1.00 19.93 O HETATM 2580 C1 CIT E 494 32.740 50.272 29.541 1.00 44.89 C HETATM 2581 O1 CIT E 494 32.806 50.712 30.712 1.00 41.23 O HETATM 2582 O2 CIT E 494 33.242 49.153 29.242 1.00 43.74 O HETATM 2583 C2 CIT E 494 32.081 51.114 28.477 1.00 44.36 C HETATM 2584 C3 CIT E 494 33.159 51.982 27.821 1.00 46.25 C HETATM 2585 O7 CIT E 494 34.076 51.104 27.091 1.00 44.04 O HETATM 2586 C4 CIT E 494 32.434 52.899 26.826 1.00 46.09 C HETATM 2587 C5 CIT E 494 33.359 53.922 26.217 1.00 47.71 C HETATM 2588 O3 CIT E 494 34.609 53.820 26.372 1.00 46.16 O HETATM 2589 O4 CIT E 494 32.870 54.877 25.553 1.00 47.66 O HETATM 2590 C6 CIT E 494 33.961 52.809 28.858 1.00 47.12 C HETATM 2591 O5 CIT E 494 35.040 52.355 29.356 1.00 47.25 O HETATM 2592 O6 CIT E 494 33.571 53.965 29.211 1.00 45.92 O HETATM 2593 C13 1PE E 495 60.514 57.932 30.108 1.00 15.74 C HETATM 2594 OH4 1PE E 495 60.668 59.336 29.966 1.00 15.46 O HETATM 2595 C14 1PE E 495 61.518 60.970 28.517 1.00 18.23 C HETATM 2596 C24 1PE E 495 60.820 59.617 28.599 1.00 15.62 C HETATM 2597 OH5 1PE E 495 60.539 61.955 28.861 1.00 20.01 O HETATM 2598 C15 1PE E 495 60.237 64.282 29.530 1.00 32.14 C HETATM 2599 C25 1PE E 495 61.199 63.245 28.971 1.00 26.03 C HETATM 2600 OH6 1PE E 495 59.139 64.410 28.601 1.00 39.14 O HETATM 2601 C16 1PE E 495 58.130 65.547 26.718 1.00 43.74 C HETATM 2602 C26 1PE E 495 59.346 65.443 27.629 1.00 41.90 C HETATM 2603 OH7 1PE E 495 56.989 65.803 27.533 1.00 46.49 O HETATM 2604 OH2 1PE E 496 61.414 69.441 1.740 1.00 49.87 O HETATM 2605 C12 1PE E 496 61.291 70.472 0.751 1.00 49.16 C HETATM 2606 C22 1PE E 496 60.042 70.214 -0.084 1.00 47.34 C HETATM 2607 OH3 1PE E 496 58.951 70.281 0.830 1.00 46.06 O HETATM 2608 C13 1PE E 496 56.637 70.269 1.309 1.00 40.17 C HETATM 2609 C23 1PE E 496 57.679 70.438 0.212 1.00 43.11 C HETATM 2610 OH4 1PE E 496 56.899 69.061 2.031 1.00 34.70 O HETATM 2611 C14 1PE E 496 56.097 67.386 3.582 1.00 32.54 C HETATM 2612 C24 1PE E 496 55.781 68.653 2.820 1.00 33.85 C HETATM 2613 OH5 1PE E 496 57.100 67.722 4.524 1.00 31.19 O HETATM 2614 C15 1PE E 496 58.807 67.113 6.038 1.00 33.80 C HETATM 2615 C25 1PE E 496 57.764 66.602 5.086 1.00 32.36 C HETATM 2616 OH6 1PE E 496 59.974 67.432 5.316 1.00 35.70 O HETATM 2617 C16 1PE E 496 61.519 69.192 5.897 1.00 44.04 C HETATM 2618 C26 1PE E 496 61.016 67.786 6.222 1.00 39.24 C HETATM 2619 OH7 1PE E 496 61.823 69.258 4.500 1.00 46.74 O HETATM 2620 OH3 1PE E 497 39.596 67.779 11.953 1.00 56.92 O HETATM 2621 C13 1PE E 497 40.827 69.345 13.303 1.00 57.11 C HETATM 2622 C23 1PE E 497 39.465 68.719 13.020 1.00 56.88 C HETATM 2623 OH4 1PE E 497 41.450 68.708 14.420 1.00 57.19 O HETATM 2624 C14 1PE E 497 42.454 69.003 16.622 1.00 55.73 C HETATM 2625 C24 1PE E 497 41.404 69.502 15.616 1.00 57.06 C HETATM 2626 OH5 1PE E 497 41.902 68.132 17.618 1.00 53.39 O HETATM 2627 C15 1PE E 497 41.340 65.893 18.237 1.00 49.75 C HETATM 2628 C25 1PE E 497 41.839 66.795 17.136 1.00 49.30 C HETATM 2629 OH6 1PE E 497 40.127 65.279 17.845 1.00 47.53 O HETATM 2630 C16 1PE E 497 37.798 65.466 18.395 1.00 50.66 C HETATM 2631 C26 1PE E 497 39.208 65.282 18.932 1.00 49.09 C HETATM 2632 OH7 1PE E 497 36.982 65.937 19.456 1.00 51.60 O HETATM 2633 O HOH E 498 52.743 42.810 23.247 1.00 10.52 O HETATM 2634 O HOH E 499 49.968 47.792 16.071 1.00 10.14 O HETATM 2635 O HOH E 500 52.341 48.223 20.922 1.00 9.97 O HETATM 2636 O HOH E 501 54.708 44.079 21.759 1.00 10.69 O HETATM 2637 O HOH E 502 49.652 63.660 19.448 1.00 14.30 O HETATM 2638 O HOH E 503 61.241 63.944 22.303 1.00 11.25 O HETATM 2639 O HOH E 504 48.404 52.589 9.087 1.00 11.53 O HETATM 2640 O HOH E 505 66.617 45.815 18.442 1.00 11.76 O HETATM 2641 O HOH E 506 67.718 49.747 13.056 1.00 10.92 O HETATM 2642 O HOH E 507 60.696 63.239 7.622 1.00 14.32 O HETATM 2643 O HOH E 508 52.354 50.496 22.469 1.00 10.10 O HETATM 2644 O HOH E 509 49.292 59.696 21.533 1.00 11.64 O HETATM 2645 O HOH E 510 53.324 60.810 26.229 1.00 11.40 O HETATM 2646 O HOH E 511 66.490 49.720 25.291 1.00 17.04 O HETATM 2647 O HOH E 512 58.689 45.210 27.782 1.00 14.57 O HETATM 2648 O HOH E 513 71.361 46.097 15.882 1.00 12.74 O HETATM 2649 O HOH E 514 54.737 46.682 20.974 1.00 9.56 O HETATM 2650 O HOH E 515 51.451 61.542 21.701 1.00 12.93 O HETATM 2651 O HOH E 516 68.554 43.827 18.517 1.00 17.26 O HETATM 2652 O HOH E 517 60.870 53.562 28.352 1.00 14.36 O HETATM 2653 O HOH E 518 54.533 66.305 19.493 1.00 13.82 O HETATM 2654 O HOH E 519 42.791 52.895 30.096 1.00 13.98 O HETATM 2655 O HOH E 520 43.826 56.268 10.865 1.00 13.89 O HETATM 2656 O HOH E 521 56.181 46.699 31.552 1.00 15.96 O HETATM 2657 O HOH E 522 70.804 51.603 3.747 1.00 14.65 O HETATM 2658 O HOH E 523 60.216 55.844 2.960 1.00 14.67 O HETATM 2659 O HOH E 524 67.530 63.764 1.239 1.00 15.63 O HETATM 2660 O HOH E 525 69.722 67.239 14.210 1.00 15.03 O HETATM 2661 O HOH E 526 52.025 47.527 1.826 1.00 15.44 O HETATM 2662 O HOH E 527 53.877 42.441 25.802 1.00 14.75 O HETATM 2663 O HOH E 528 62.136 57.427 4.259 1.00 16.40 O HETATM 2664 O HOH E 529 61.125 48.046 1.081 1.00 14.81 O HETATM 2665 O HOH E 530 42.867 50.969 31.925 1.00 19.47 O HETATM 2666 O HOH E 531 64.580 60.183 0.532 1.00 21.40 O HETATM 2667 O HOH E 532 33.195 55.116 31.486 1.00 19.97 O HETATM 2668 O HOH E 533 71.060 56.405 20.428 1.00 16.46 O HETATM 2669 O HOH E 534 36.526 44.010 27.036 1.00 16.14 O HETATM 2670 O HOH E 535 74.495 55.361 8.002 1.00 20.12 O HETATM 2671 O HOH E 536 40.183 43.843 24.384 1.00 16.48 O HETATM 2672 O HOH E 537 70.413 41.795 4.811 1.00 20.25 O HETATM 2673 O HOH E 538 36.614 52.914 10.718 1.00 20.99 O HETATM 2674 O HOH E 539 66.125 54.205 32.488 1.00 18.92 O HETATM 2675 O HOH E 540 56.151 61.067 26.249 1.00 19.09 O HETATM 2676 O HOH E 541 56.070 48.841 33.229 1.00 16.43 O HETATM 2677 O HOH E 542 75.049 52.385 15.460 1.00 18.98 O HETATM 2678 O HOH E 543 68.500 39.526 8.169 1.00 17.06 O HETATM 2679 O HOH E 544 51.402 44.767 1.435 1.00 21.95 O HETATM 2680 O HOH E 545 49.435 67.093 -1.439 1.00 22.23 O HETATM 2681 O HOH E 546 68.194 55.913 2.368 1.00 19.35 O HETATM 2682 O HOH E 547 71.601 53.812 2.492 1.00 20.77 O HETATM 2683 O HOH E 548 63.129 64.999 5.267 1.00 13.37 O HETATM 2684 O HOH E 549 70.456 62.788 3.565 1.00 23.04 O HETATM 2685 O HOH E 550 59.145 53.897 -5.603 1.00 19.15 O HETATM 2686 O HOH E 551 55.350 61.570 -7.866 1.00 21.68 O HETATM 2687 O HOH E 552 73.163 39.453 13.494 1.00 20.69 O HETATM 2688 O HOH E 553 72.186 48.873 20.580 1.00 20.13 O HETATM 2689 O HOH E 554 38.250 55.014 23.938 1.00 20.92 O HETATM 2690 O HOH E 555 36.228 55.020 17.773 1.00 20.57 O HETATM 2691 O HOH E 556 63.812 58.108 2.068 1.00 20.32 O HETATM 2692 O HOH E 557 72.077 64.872 4.299 1.00 24.18 O HETATM 2693 O HOH E 558 33.234 49.091 32.655 1.00 19.90 O HETATM 2694 O HOH E 559 37.380 57.348 27.135 1.00 24.56 O HETATM 2695 O HOH E 560 40.060 44.828 9.282 1.00 19.98 O HETATM 2696 O HOH E 561 53.095 47.341 34.765 1.00 25.29 O HETATM 2697 O HOH E 562 63.614 62.116 -1.111 1.00 24.04 O HETATM 2698 O HOH E 563 60.594 59.613 -4.342 1.00 21.27 O HETATM 2699 O HOH E 564 77.965 53.943 17.113 1.00 44.45 O HETATM 2700 O HOH E 565 48.063 58.415 33.983 1.00 25.12 O HETATM 2701 O HOH E 566 67.595 41.325 19.178 1.00 21.87 O HETATM 2702 O HOH E 567 58.943 37.662 6.201 1.00 16.47 O HETATM 2703 O HOH E 568 46.679 52.947 36.546 1.00 27.47 O HETATM 2704 O HOH E 569 46.349 37.601 3.876 1.00 38.03 O HETATM 2705 O HOH E 570 50.440 62.017 -6.252 1.00 27.15 O HETATM 2706 O HOH E 571 60.976 63.688 25.397 1.00 19.86 O HETATM 2707 O HOH E 572 65.139 41.555 1.209 1.00 24.32 O HETATM 2708 O HOH E 573 73.808 41.965 12.427 1.00 19.69 O HETATM 2709 O HOH E 574 58.102 33.123 -1.655 1.00 23.89 O HETATM 2710 O HOH E 575 45.837 50.584 32.667 1.00 26.11 O HETATM 2711 O HOH E 576 55.018 43.934 29.058 1.00 26.77 O HETATM 2712 O HOH E 577 70.039 55.152 26.781 1.00 29.47 O HETATM 2713 O HOH E 578 66.078 43.090 21.354 1.00 27.54 O HETATM 2714 O HOH E 579 61.203 42.505 24.724 1.00 21.79 O HETATM 2715 O HOH E 580 72.106 65.438 8.163 1.00 28.89 O HETATM 2716 O HOH E 581 47.628 60.673 30.140 0.67 17.26 O HETATM 2717 O HOH E 582 55.956 36.969 20.335 1.00 25.28 O HETATM 2718 O HOH E 583 69.244 48.993 24.887 1.00 24.44 O HETATM 2719 O HOH E 584 35.476 52.423 32.107 1.00 24.35 O HETATM 2720 O HOH E 585 51.431 45.281 27.523 1.00 30.05 O HETATM 2721 O HOH E 586 57.161 68.700 9.178 1.00 22.48 O HETATM 2722 O HOH E 587 63.616 56.437 31.119 1.00 20.40 O HETATM 2723 O HOH E 588 63.836 48.119 0.633 1.00 24.17 O HETATM 2724 O HOH E 589 47.096 54.877 -12.003 1.00 25.51 O HETATM 2725 O HOH E 590 67.127 50.525 27.862 1.00 26.35 O HETATM 2726 O HOH E 591 64.984 47.547 25.582 1.00 22.03 O HETATM 2727 O HOH E 592 40.173 54.223 -6.696 1.00 26.79 O HETATM 2728 O HOH E 593 35.674 44.400 24.363 1.00 22.78 O HETATM 2729 O HOH E 594 56.131 57.533 -9.648 1.00 25.16 O HETATM 2730 O HOH E 595 62.864 65.934 21.294 1.00 21.77 O HETATM 2731 O HOH E 596 44.622 68.426 11.425 1.00 21.97 O HETATM 2732 O HOH E 597 44.987 54.116 -8.582 1.00 26.90 O HETATM 2733 O HOH E 598 48.213 36.733 20.648 1.00 39.75 O HETATM 2734 O HOH E 599 48.940 60.218 -7.644 1.00 21.84 O HETATM 2735 O HOH E 600 59.163 68.787 3.158 1.00 16.12 O HETATM 2736 O HOH E 601 44.779 45.475 -4.718 1.00 37.64 O HETATM 2737 O HOH E 602 71.874 60.400 4.437 1.00 32.65 O HETATM 2738 O HOH E 603 42.933 62.666 21.643 1.00 26.63 O HETATM 2739 O HOH E 604 66.182 49.689 1.132 1.00 28.48 O HETATM 2740 O HOH E 605 71.528 54.706 24.718 1.00 29.76 O HETATM 2741 O HOH E 606 64.429 63.920 0.895 1.00 26.48 O HETATM 2742 O HOH E 607 33.062 49.540 5.467 1.00 24.79 O HETATM 2743 O HOH E 608 38.416 60.284 -0.860 1.00 25.24 O HETATM 2744 O HOH E 609 57.594 55.321 31.360 1.00 15.37 O HETATM 2745 O HOH E 610 53.859 56.488 -11.126 1.00 22.80 O HETATM 2746 O HOH E 611 73.898 54.405 3.935 1.00 17.50 O HETATM 2747 O HOH E 612 64.966 45.715 0.502 1.00 31.43 O HETATM 2748 O HOH E 613 78.220 68.212 12.496 1.00 23.19 O HETATM 2749 O HOH E 614 35.068 55.158 21.800 1.00 32.39 O HETATM 2750 O HOH E 615 40.401 50.868 -5.645 1.00 25.75 O HETATM 2751 O HOH E 616 32.931 47.185 30.728 1.00 25.30 O HETATM 2752 O HOH E 617 58.592 45.638 30.678 1.00 22.23 O HETATM 2753 O HOH E 618 38.172 44.617 22.865 1.00 24.34 O HETATM 2754 O HOH E 619 37.877 65.163 7.278 1.00 24.56 O HETATM 2755 O HOH E 620 73.860 51.019 20.072 1.00 29.29 O HETATM 2756 O HOH E 621 75.553 51.138 17.718 1.00 28.84 O HETATM 2757 O HOH E 622 35.101 61.795 4.253 1.00 29.34 O HETATM 2758 O HOH E 623 43.612 65.072 -0.035 1.00 31.63 O HETATM 2759 O HOH E 624 67.685 52.743 29.056 1.00 22.08 O HETATM 2760 O HOH E 625 32.284 52.163 5.646 1.00 30.91 O HETATM 2761 O HOH E 626 49.521 66.311 20.300 1.00 29.92 O HETATM 2762 O HOH E 627 38.438 43.077 6.296 1.00 30.64 O HETATM 2763 O HOH E 628 45.016 61.036 28.351 1.00 30.70 O HETATM 2764 O HOH E 629 35.831 57.730 18.898 1.00 26.42 O HETATM 2765 O HOH E 630 37.407 47.658 21.181 1.00 32.50 O HETATM 2766 O HOH E 631 60.764 47.941 -2.319 1.00 18.03 O HETATM 2767 O HOH E 632 44.806 69.988 3.896 1.00 30.69 O HETATM 2768 O HOH E 633 33.005 58.185 10.627 1.00 32.86 O HETATM 2769 O HOH E 634 52.396 50.251 -9.782 1.00 27.79 O HETATM 2770 O HOH E 635 66.684 32.364 6.738 1.00 32.70 O HETATM 2771 O HOH E 636 69.655 68.806 6.986 1.00 30.86 O HETATM 2772 O HOH E 637 35.292 64.944 7.135 1.00 30.78 O HETATM 2773 O HOH E 638 35.332 50.510 3.100 1.00 26.20 O HETATM 2774 O HOH E 639 76.249 59.047 18.577 1.00 29.08 O HETATM 2775 O HOH E 640 61.610 67.231 16.858 1.00 35.07 O HETATM 2776 O HOH E 641 40.624 45.028 12.845 1.00 35.77 O HETATM 2777 O HOH E 642 35.213 46.567 30.868 1.00 34.66 O HETATM 2778 O HOH E 643 49.378 43.025 1.352 1.00 32.10 O HETATM 2779 O HOH E 644 61.493 48.231 28.677 1.00 21.96 O HETATM 2780 O HOH E 645 46.077 37.766 19.386 1.00 35.28 O HETATM 2781 O HOH E 646 32.582 55.023 1.829 1.00 26.96 O HETATM 2782 O HOH E 647 49.080 41.746 -1.204 1.00 32.11 O HETATM 2783 O HOH E 648 55.812 60.217 -10.081 1.00 28.76 O HETATM 2784 O HOH E 649 36.217 62.476 23.853 1.00 30.77 O HETATM 2785 O HOH E 650 30.795 48.149 7.016 1.00 40.49 O HETATM 2786 O HOH E 651 51.943 39.280 24.188 1.00 30.43 O HETATM 2787 O HOH E 652 48.675 40.847 2.914 1.00 24.47 O HETATM 2788 O HOH E 653 54.531 54.187 -12.520 1.00 32.40 O HETATM 2789 O HOH E 654 66.872 43.797 2.502 1.00 35.84 O HETATM 2790 O HOH E 655 69.654 43.014 2.489 1.00 35.32 O HETATM 2791 O HOH E 656 38.827 43.860 18.607 1.00 34.18 O HETATM 2792 O HOH E 657 62.291 67.602 -0.144 1.00 33.22 O HETATM 2793 O HOH E 658 61.120 65.468 9.196 1.00 24.65 O HETATM 2794 O HOH E 659 51.003 69.431 -1.310 1.00 37.21 O HETATM 2795 O HOH E 660 61.431 40.346 23.337 1.00 30.39 O HETATM 2796 O HOH E 661 57.700 40.615 -8.242 1.00 38.81 O HETATM 2797 O HOH E 662 51.856 61.718 28.600 0.50 17.91 O HETATM 2798 O HOH E 663 56.181 28.477 -0.451 1.00 37.66 O HETATM 2799 O HOH E 664 59.595 58.466 -8.902 1.00 33.92 O HETATM 2800 O HOH E 665 63.451 65.598 8.020 1.00 26.57 O HETATM 2801 O HOH E 666 54.140 60.771 -12.061 1.00 30.55 O HETATM 2802 O HOH E 667 50.829 68.136 18.765 1.00 38.14 O HETATM 2803 O HOH E 668 60.853 46.951 30.968 1.00 28.58 O HETATM 2804 O HOH E 669 57.486 68.385 12.753 1.00 29.75 O HETATM 2805 O HOH E 670 51.112 32.000 5.453 1.00 34.21 O HETATM 2806 O HOH E 671 60.249 40.741 -6.855 1.00 34.36 O HETATM 2807 O HOH E 672 49.409 39.435 25.171 1.00 40.86 O HETATM 2808 O HOH E 673 59.763 42.619 27.383 1.00 36.41 O HETATM 2809 O HOH E 674 33.399 52.580 3.077 1.00 25.92 O HETATM 2810 O HOH E 675 63.642 43.250 25.091 1.00 36.08 O HETATM 2811 O HOH E 676 51.244 40.484 -2.222 1.00 28.13 O HETATM 2812 O HOH E 677 33.752 47.328 0.854 1.00 32.07 O HETATM 2813 O HOH E 678 54.705 39.847 26.592 1.00 41.51 O HETATM 2814 O HOH E 679 70.792 37.303 2.992 1.00 30.85 O HETATM 2815 O HOH E 680 36.665 50.167 28.963 1.00 22.37 O HETATM 2816 O HOH E 681 56.193 30.377 6.310 1.00 31.73 O HETATM 2817 O HOH E 682 70.254 63.959 7.181 1.00 17.54 O HETATM 2818 O HOH E 683 55.642 32.955 17.851 1.00 38.82 O HETATM 2819 O HOH E 684 34.988 63.176 17.324 1.00 38.01 O HETATM 2820 O HOH E 685 80.233 52.554 13.154 1.00 45.72 O HETATM 2821 O HOH E 686 71.030 52.896 27.400 1.00 38.77 O HETATM 2822 O HOH E 687 46.309 60.613 -8.067 1.00 32.68 O HETATM 2823 O HOH E 688 61.981 66.793 11.844 1.00 32.71 O HETATM 2824 O HOH E 689 46.833 39.971 -1.172 1.00 45.22 O HETATM 2825 O HOH E 690 49.985 69.898 10.462 1.00 33.22 O HETATM 2826 O HOH E 691 52.749 58.351 -12.746 1.00 32.78 O HETATM 2827 O HOH E 692 49.488 60.643 -10.332 1.00 32.08 O HETATM 2828 O HOH E 693 54.924 34.320 20.307 1.00 39.48 O HETATM 2829 O HOH E 694 57.135 38.101 25.413 1.00 37.05 O HETATM 2830 O HOH E 695 47.322 69.724 10.039 1.00 39.48 O HETATM 2831 O HOH E 696 58.659 47.350 -6.964 1.00 33.78 O HETATM 2832 O HOH E 697 50.054 58.597 -12.044 1.00 31.16 O HETATM 2833 O HOH E 698 63.097 65.453 26.845 1.00 35.24 O HETATM 2834 O HOH E 699 48.407 52.031 -13.181 1.00 33.56 O HETATM 2835 O HOH E 700 72.369 42.163 18.755 1.00 36.28 O HETATM 2836 O HOH E 701 63.202 31.489 9.608 1.00 33.34 O HETATM 2837 O HOH E 702 53.578 51.994 -11.746 1.00 37.98 O HETATM 2838 O HOH E 703 60.949 67.655 14.243 1.00 34.53 O HETATM 2839 O HOH E 704 34.922 50.558 17.124 1.00 34.31 O HETATM 2840 O HOH E 705 51.284 33.627 -1.106 1.00 40.22 O HETATM 2841 O HOH E 706 66.220 33.998 13.664 1.00 46.25 O HETATM 2842 O HOH E 707 34.035 57.160 24.560 1.00 34.78 O HETATM 2843 O HOH E 708 48.446 70.202 14.127 1.00 34.15 O HETATM 2844 O HOH E 709 64.044 47.592 28.061 1.00 33.50 O HETATM 2845 O HOH E 710 44.973 62.525 25.735 1.00 39.56 O HETATM 2846 O HOH E 711 36.197 50.027 -0.083 0.50 26.77 O HETATM 2847 O HOH E 712 53.912 68.916 16.073 1.00 40.78 O HETATM 2848 O HOH E 713 54.757 40.801 -4.688 1.00 34.86 O HETATM 2849 O HOH E 714 47.779 48.576 36.973 1.00 33.49 O HETATM 2850 O HOH E 715 54.556 32.029 13.049 1.00 34.07 O HETATM 2851 O HOH E 716 53.617 42.962 -8.832 1.00 40.36 O HETATM 2852 O HOH E 717 70.665 39.318 6.012 1.00 40.44 O HETATM 2853 O HOH E 718 66.786 40.058 -0.590 1.00 38.80 O HETATM 2854 O HOH E 719 45.982 59.182 32.633 1.00 47.86 O HETATM 2855 O HOH E 720 59.668 31.345 17.703 1.00 34.58 O HETATM 2856 O HOH E 721 58.168 49.576 -8.469 1.00 41.70 O HETATM 2857 O HOH E 722 74.195 61.590 3.614 1.00 41.07 O HETATM 2858 O HOH E 723 52.312 34.570 20.998 1.00 34.75 O HETATM 2859 O HOH E 724 63.796 66.199 24.054 1.00 34.53 O HETATM 2860 O HOH E 725 60.440 31.274 8.433 1.00 32.73 O HETATM 2861 O HOH E 726 61.200 53.739 -7.952 1.00 38.51 O HETATM 2862 O HOH E 727 64.476 66.658 3.579 1.00 30.50 O HETATM 2863 O HOH E 728 71.039 40.415 0.590 1.00 42.72 O HETATM 2864 O HOH E 729 45.734 58.394 35.683 1.00 37.54 O HETATM 2865 O HOH E 730 71.126 44.186 19.802 1.00 41.43 O HETATM 2866 O HOH E 731 63.832 67.445 18.926 1.00 40.25 O HETATM 2867 O HOH E 732 35.442 48.567 -0.215 0.50 25.31 O HETATM 2868 O HOH E 733 45.362 69.671 14.017 1.00 30.05 O HETATM 2869 O HOH E 734 53.051 63.114 -8.254 1.00 37.89 O HETATM 2870 O HOH E 735 47.207 63.998 26.613 1.00 41.97 O HETATM 2871 O HOH E 736 41.233 68.167 8.693 1.00 40.08 O HETATM 2872 O HOH E 737 57.988 70.341 7.093 1.00 33.95 O HETATM 2873 O HOH E 738 50.269 46.895 34.883 1.00 43.88 O HETATM 2874 O HOH E 739 51.090 69.339 -4.313 1.00 40.18 O HETATM 2875 O HOH E 740 72.617 37.122 9.063 1.00 48.45 O HETATM 2876 O HOH E 741 44.438 70.753 7.446 1.00 36.23 O HETATM 2877 O HOH E 742 71.854 50.729 26.988 1.00 39.60 O HETATM 2878 O HOH E 743 51.660 31.460 1.617 1.00 42.61 O HETATM 2879 O HOH E 744 62.814 45.082 31.163 1.00 35.77 O HETATM 2880 O HOH E 745 60.056 30.182 0.127 1.00 37.21 O HETATM 2881 O HOH E 746 34.294 53.068 18.084 1.00 41.78 O HETATM 2882 O HOH E 747 63.145 47.659 -3.159 1.00 36.23 O HETATM 2883 O HOH E 748 46.271 69.443 18.058 1.00 38.14 O HETATM 2884 O HOH E 749 55.345 68.570 -2.324 1.00 34.25 O HETATM 2885 O HOH E 750 45.217 67.504 0.431 1.00 38.42 O HETATM 2886 O HOH E 751 29.910 59.873 8.123 1.00 32.31 O HETATM 2887 O HOH E 752 52.846 47.226 37.655 1.00 37.78 O HETATM 2888 O HOH E 753 51.948 62.209 -11.023 1.00 36.50 O HETATM 2889 O HOH E 754 46.501 68.335 -1.701 1.00 37.93 O HETATM 2890 O HOH E 755 43.736 58.872 -7.603 1.00 39.35 O HETATM 2891 O HOH E 756 54.323 45.200 33.141 1.00 39.29 O HETATM 2892 O HOH E 757 43.429 51.404 -8.965 1.00 51.26 O HETATM 2893 O HOH E 758 47.710 57.221 -13.272 1.00 36.46 O HETATM 2894 O HOH E 759 48.853 60.969 29.731 0.33 15.39 O HETATM 2895 O HOH E 760 49.825 72.692 2.043 1.00 41.70 O HETATM 2896 O HOH E 761 42.847 60.315 -5.650 1.00 38.22 O HETATM 2897 O HOH E 762 49.570 35.028 18.058 1.00 46.77 O HETATM 2898 O HOH E 763 57.361 32.720 14.302 1.00 38.55 O HETATM 2899 O HOH E 764 72.733 46.102 20.955 1.00 44.08 O HETATM 2900 O HOH E 765 68.291 36.864 17.364 1.00 36.64 O HETATM 2901 O HOH E 766 46.725 62.945 -6.257 1.00 38.91 O HETATM 2902 O HOH E 767 51.876 41.284 -4.561 1.00 44.94 O HETATM 2903 O HOH E 768 50.159 34.907 15.039 1.00 44.04 O HETATM 2904 O HOH E 769 36.162 55.553 25.266 1.00 32.00 O HETATM 2905 O HOH E 770 66.849 42.985 -1.800 1.00 46.91 O HETATM 2906 O HOH E 771 78.466 45.200 16.554 1.00 44.61 O HETATM 2907 O HOH E 772 50.551 31.435 8.636 1.00 41.32 O HETATM 2908 O HOH E 773 52.548 43.631 27.672 1.00 36.23 O HETATM 2909 O HOH E 774 47.623 33.911 14.428 1.00 48.45 O HETATM 2910 O HOH E 775 33.368 58.025 19.510 1.00 38.78 O HETATM 2911 O HOH E 776 42.629 60.572 24.108 0.50 11.52 O HETATM 2912 O HOH E 777 31.777 54.634 -0.796 1.00 38.68 O HETATM 2913 O HOH E 778 35.482 48.807 -6.336 1.00 45.77 O HETATM 2914 O HOH E 779 43.413 56.201 -8.109 1.00 41.77 O HETATM 2915 O HOH E 780 58.780 42.976 31.733 1.00 36.47 O HETATM 2916 O HOH E 781 63.353 54.241 29.367 1.00 15.80 O HETATM 2917 O HOH E 782 76.454 42.370 18.360 1.00 35.07 O HETATM 2918 O HOH E 783 56.194 46.441 -8.999 1.00 44.40 O HETATM 2919 O HOH E 784 74.073 57.754 6.632 1.00 32.38 O HETATM 2920 O HOH E 785 59.180 37.970 -7.478 1.00 48.33 O HETATM 2921 O HOH E 786 60.142 44.794 -7.181 1.00 33.91 O HETATM 2922 O HOH E 787 58.464 29.530 -7.192 1.00 44.14 O HETATM 2923 O HOH E 788 32.396 44.168 3.640 1.00 50.83 O HETATM 2924 O HOH E 789 78.085 57.138 17.178 1.00 29.75 O HETATM 2925 O HOH E 790 51.972 62.853 27.418 0.50 21.04 O HETATM 2926 O HOH E 791 56.542 66.991 23.830 1.00 37.54 O HETATM 2927 O HOH E 792 65.709 32.627 16.212 1.00 45.93 O HETATM 2928 O HOH E 793 53.599 54.214 -15.269 1.00 41.46 O HETATM 2929 O HOH E 794 42.970 63.073 24.173 1.00 46.36 O HETATM 2930 O HOH E 795 73.654 39.741 16.313 1.00 23.09 O HETATM 2931 O HOH E 796 34.887 56.633 -3.972 1.00 40.26 O HETATM 2932 O HOH E 797 75.035 58.886 10.024 1.00 36.30 O HETATM 2933 O HOH E 798 48.893 48.399 31.927 1.00 21.42 O HETATM 2934 O HOH E 799 32.902 46.253 28.438 1.00 40.53 O HETATM 2935 O HOH E 800 65.377 52.576 30.311 1.00 44.79 O HETATM 2936 O HOH E 801 31.278 62.640 2.008 1.00 39.95 O HETATM 2937 O HOH E 802 36.739 60.300 -2.910 1.00 46.80 O HETATM 2938 O HOH E 803 60.570 50.921 -9.417 1.00 39.06 O HETATM 2939 O HOH E 804 49.458 70.009 17.092 1.00 50.34 O HETATM 2940 O HOH E 805 42.979 69.887 9.565 1.00 43.68 O HETATM 2941 O HOH E 806 55.619 69.859 15.062 1.00 39.42 O HETATM 2942 O HOH E 807 43.423 66.083 21.264 1.00 45.63 O HETATM 2943 O HOH E 808 73.793 60.167 21.921 1.00 44.87 O HETATM 2944 O HOH E 809 57.589 61.408 28.462 1.00 19.83 O HETATM 2945 O HOH E 810 44.811 54.687 -11.309 1.00 39.84 O HETATM 2946 O HOH E 811 74.534 52.651 25.762 1.00 46.80 O HETATM 2947 O HOH E 812 76.963 66.447 8.208 1.00 41.94 O HETATM 2948 O HOH E 813 38.661 67.930 16.253 1.00 42.29 O HETATM 2949 O HOH E 814 64.884 50.025 30.301 0.50 23.23 O HETATM 2950 O HOH E 815 80.133 61.647 16.683 1.00 55.06 O HETATM 2951 O HOH E 816 43.731 48.694 -8.427 1.00 51.40 O HETATM 2952 O HOH E 817 53.225 71.330 2.055 1.00 43.97 O HETATM 2953 O HOH E 818 80.029 59.101 17.628 1.00 47.93 O HETATM 2954 O HOH E 819 41.330 61.107 25.077 0.50 21.53 O HETATM 2955 O HOH E 820 58.654 70.615 4.444 1.00 44.84 O HETATM 2956 O HOH E 821 69.849 34.200 12.626 1.00 44.59 O HETATM 2957 O HOH E 822 49.435 71.866 -0.660 1.00 48.19 O HETATM 2958 O HOH E 823 61.426 37.282 -6.302 1.00 43.33 O HETATM 2959 O HOH E 824 30.299 52.393 9.441 1.00 49.48 O HETATM 2960 O HOH E 825 68.080 36.415 -1.136 1.00 45.52 O HETATM 2961 O HOH E 826 38.957 61.799 -5.100 1.00 47.05 O HETATM 2962 O HOH E 827 60.055 31.464 11.126 1.00 37.82 O HETATM 2963 O HOH E 828 36.202 48.352 17.951 1.00 47.74 O HETATM 2964 O HOH E 829 34.922 49.077 23.909 1.00 44.58 O HETATM 2965 O HOH E 830 49.851 59.507 34.729 1.00 46.09 O HETATM 2966 O HOH E 831 74.905 44.916 21.131 1.00 44.46 O HETATM 2967 O HOH E 832 37.915 55.315 -6.274 1.00 50.55 O HETATM 2968 O HOH E 833 73.442 50.048 25.634 1.00 45.66 O HETATM 2969 O HOH E 834 55.091 65.373 25.709 1.00 57.92 O HETATM 2970 O HOH E 835 54.184 33.574 14.816 1.00 43.16 O HETATM 2971 O HOH E 836 46.771 44.612 28.136 1.00 45.24 O HETATM 2972 O HOH E 837 48.871 45.193 28.385 1.00 46.27 O HETATM 2973 O HOH E 838 53.284 35.941 -5.347 1.00 47.45 O HETATM 2974 O HOH E 839 65.392 71.333 12.318 1.00 43.23 O HETATM 2975 O HOH E 840 55.828 63.361 29.870 1.00 43.73 O HETATM 2976 O HOH E 841 58.487 34.018 20.629 1.00 43.59 O HETATM 2977 O HOH E 842 63.951 71.662 14.317 1.00 38.01 O HETATM 2978 O HOH E 843 47.243 47.064 29.130 1.00 40.80 O HETATM 2979 O HOH E 844 62.096 67.101 28.274 1.00 45.55 O HETATM 2980 O HOH E 845 58.128 55.328 -11.574 1.00 48.36 O HETATM 2981 O HOH E 846 48.206 42.387 29.023 1.00 42.88 O HETATM 2982 O HOH E 847 79.326 59.889 7.818 1.00 60.98 O HETATM 2983 O HOH E 848 78.494 59.263 19.740 1.00 60.22 O HETATM 2984 O HOH E 849 36.453 61.128 19.226 1.00 42.50 O HETATM 2985 O HOH E 850 54.933 31.292 -6.676 1.00 46.40 O HETATM 2986 O HOH E 851 35.023 44.519 29.206 1.00 34.44 O HETATM 2987 O HOH E 852 67.276 72.678 8.713 1.00 43.68 O HETATM 2988 O HOH E 853 55.383 36.805 23.222 1.00 54.24 O HETATM 2989 O HOH E 854 34.504 46.723 23.798 1.00 44.07 O HETATM 2990 O HOH E 855 34.644 50.397 -2.130 1.00 44.63 O HETATM 2991 O HOH E 856 68.193 47.346 -0.020 1.00 49.61 O HETATM 2992 O HOH E 857 71.244 35.667 14.197 1.00 48.30 O HETATM 2993 O HOH E 858 68.341 34.809 15.022 1.00 52.81 O HETATM 2994 O HOH E 859 30.498 47.146 30.675 1.00 42.30 O HETATM 2995 O HOH E 860 32.201 50.583 16.196 1.00 48.06 O HETATM 2996 O HOH E 861 39.238 63.493 24.104 1.00 42.55 O HETATM 2997 O HOH E 862 40.742 68.384 5.145 1.00 54.25 O HETATM 2998 O HOH E 863 69.716 39.605 19.133 1.00 42.90 O HETATM 2999 O HOH E 864 56.764 41.448 28.280 1.00 49.89 O HETATM 3000 O HOH E 865 29.728 52.524 5.001 1.00 42.21 O HETATM 3001 O HOH E 866 32.439 49.131 -2.955 1.00 45.34 O HETATM 3002 O HOH E 867 78.534 48.566 19.509 1.00 52.05 O HETATM 3003 O HOH E 868 50.654 37.935 -3.334 1.00 49.89 O HETATM 3004 O HOH E 869 56.081 49.811 -10.184 1.00 49.77 O HETATM 3005 O HOH E 870 44.442 63.883 -3.940 1.00 47.14 O HETATM 3006 O HOH E 871 70.203 42.709 22.373 1.00 45.27 O HETATM 3007 O HOH E 872 81.041 61.396 11.063 1.00 53.41 O HETATM 3008 O HOH E 873 77.618 62.362 12.640 1.00 39.66 O HETATM 3009 O HOH E 874 74.662 62.615 14.038 0.50 13.91 O HETATM 3010 O HOH E 875 76.939 61.294 18.976 0.50 22.89 O HETATM 3011 O HOH E 876 50.451 64.352 25.916 1.00 40.51 O HETATM 3012 O HOH E 877 51.389 63.942 23.441 1.00 30.62 O HETATM 3013 O HOH E 878 51.676 66.060 22.289 1.00 43.14 O HETATM 3014 O HOH I 84 29.948 29.032 -8.432 1.00 14.30 O HETATM 3015 O HOH I 85 27.379 22.794 3.284 1.00 12.49 O HETATM 3016 O HOH I 86 28.563 25.342 3.898 1.00 13.82 O HETATM 3017 O HOH I 87 26.610 30.495 0.040 1.00 15.65 O HETATM 3018 O HOH I 88 41.737 36.449 4.503 1.00 13.85 O HETATM 3019 O HOH I 89 39.486 36.045 -2.499 1.00 15.56 O HETATM 3020 O HOH I 90 41.595 35.904 1.211 1.00 17.69 O HETATM 3021 O HOH I 91 31.131 30.947 10.545 1.00 19.03 O HETATM 3022 O HOH I 92 30.823 25.506 -9.993 1.00 18.81 O HETATM 3023 O HOH I 93 46.233 38.808 6.716 1.00 21.37 O HETATM 3024 O HOH I 94 42.126 36.548 -1.449 1.00 20.52 O HETATM 3025 O HOH I 95 34.047 36.945 -13.526 1.00 22.25 O HETATM 3026 O HOH I 96 47.010 32.301 5.755 1.00 31.96 O HETATM 3027 O HOH I 97 45.123 35.328 -6.325 1.00 25.72 O HETATM 3028 O HOH I 98 27.178 30.088 2.800 1.00 27.25 O HETATM 3029 O HOH I 99 30.854 40.631 3.753 1.00 25.95 O HETATM 3030 O HOH I 100 25.084 22.265 1.741 1.00 19.00 O HETATM 3031 O HOH I 101 43.031 41.527 14.929 1.00 25.66 O HETATM 3032 O HOH I 102 25.587 20.671 -0.384 1.00 27.42 O HETATM 3033 O HOH I 103 43.424 37.890 3.023 1.00 32.94 O HETATM 3034 O HOH I 104 31.123 34.230 8.218 1.00 24.19 O HETATM 3035 O HOH I 105 37.595 42.125 9.126 1.00 27.55 O HETATM 3036 O HOH I 106 24.824 23.279 -3.483 1.00 29.52 O HETATM 3037 O HOH I 107 43.751 43.834 -1.174 1.00 44.62 O HETATM 3038 O HOH I 108 23.194 24.789 -0.320 1.00 32.60 O HETATM 3039 O HOH I 109 44.566 41.140 -0.563 1.00 29.20 O HETATM 3040 O HOH I 110 30.595 42.590 -6.894 1.00 29.50 O HETATM 3041 O HOH I 111 24.585 36.334 -2.377 1.00 29.82 O HETATM 3042 O HOH I 112 34.374 44.360 -7.216 1.00 28.10 O HETATM 3043 O HOH I 113 37.925 35.491 -11.608 1.00 35.61 O HETATM 3044 O HOH I 114 27.228 32.247 4.409 1.00 32.36 O HETATM 3045 O HOH I 115 34.476 21.843 1.118 1.00 31.49 O HETATM 3046 O HOH I 116 49.480 33.994 4.731 1.00 28.33 O HETATM 3047 O HOH I 117 28.992 27.254 10.176 1.00 27.40 O HETATM 3048 O HOH I 118 37.810 29.178 12.157 1.00 33.32 O HETATM 3049 O HOH I 119 29.659 41.945 -3.378 1.00 31.58 O HETATM 3050 O HOH I 120 37.618 38.190 -12.214 1.00 33.20 O HETATM 3051 O HOH I 121 25.457 32.854 0.160 1.00 37.00 O HETATM 3052 O HOH I 122 29.276 33.823 5.222 1.00 40.28 O HETATM 3053 O HOH I 123 38.577 21.033 7.323 1.00 30.61 O HETATM 3054 O HOH I 124 38.128 24.905 11.272 1.00 30.63 O HETATM 3055 O HOH I 125 23.832 30.929 -1.258 1.00 31.48 O HETATM 3056 O HOH I 126 45.177 35.689 14.460 1.00 28.62 O HETATM 3057 O HOH I 127 43.573 29.404 -8.695 1.00 30.12 O HETATM 3058 O HOH I 128 35.716 43.758 -11.762 1.00 31.73 O HETATM 3059 O HOH I 129 27.807 42.445 -8.218 1.00 39.85 O HETATM 3060 O HOH I 130 28.451 31.564 9.368 1.00 37.88 O HETATM 3061 O HOH I 131 42.524 42.696 -4.255 1.00 29.79 O HETATM 3062 O HOH I 132 44.031 40.450 2.309 1.00 37.11 O HETATM 3063 O HOH I 133 31.804 43.865 -2.880 1.00 40.11 O HETATM 3064 O HOH I 134 34.777 32.767 -13.880 1.00 34.16 O HETATM 3065 O HOH I 135 45.622 41.300 6.135 1.00 24.84 O HETATM 3066 O HOH I 136 28.285 19.917 -0.270 1.00 34.76 O HETATM 3067 O HOH I 137 45.550 34.925 -1.882 1.00 34.38 O HETATM 3068 O HOH I 138 27.292 24.180 -4.238 1.00 25.57 O HETATM 3069 O HOH I 139 37.602 22.327 -0.192 1.00 29.43 O HETATM 3070 O HOH I 140 36.339 45.885 -7.710 1.00 33.31 O HETATM 3071 O HOH I 141 32.010 44.549 -0.391 1.00 39.75 O HETATM 3072 O HOH I 142 30.885 23.026 -4.390 1.00 37.61 O HETATM 3073 O HOH I 143 31.662 20.739 -1.636 1.00 39.48 O HETATM 3074 O HOH I 144 29.081 22.804 -2.698 1.00 47.85 O HETATM 3075 O HOH I 145 44.407 34.103 17.579 1.00 45.25 O HETATM 3076 O HOH I 146 27.411 39.369 -2.724 1.00 42.86 O HETATM 3077 O HOH I 147 26.424 35.532 -0.525 1.00 45.09 O HETATM 3078 O HOH I 148 37.220 22.961 -2.582 1.00 37.22 O HETATM 3079 O HOH I 149 39.817 24.758 8.922 1.00 34.29 O HETATM 3080 O HOH I 150 44.829 24.301 -0.304 1.00 42.79 O HETATM 3081 O HOH I 151 38.989 40.755 -11.683 1.00 39.79 O HETATM 3082 O HOH I 152 27.813 43.591 -12.510 1.00 29.82 O HETATM 3083 O HOH I 153 38.960 41.245 17.174 1.00 38.55 O HETATM 3084 O HOH I 154 28.548 43.138 -17.341 1.00 39.62 O HETATM 3085 O HOH I 155 40.201 28.350 -9.917 1.00 41.16 O HETATM 3086 O HOH I 156 38.317 48.279 -6.530 1.00 49.28 O HETATM 3087 O HOH I 157 29.339 36.415 4.862 1.00 47.71 O HETATM 3088 O HOH I 158 41.469 39.974 16.631 1.00 38.78 O HETATM 3089 O HOH I 159 30.559 32.123 12.872 1.00 39.33 O HETATM 3090 O HOH I 160 45.319 39.880 14.836 1.00 18.62 O HETATM 3091 O HOH I 161 36.586 28.435 -11.907 1.00 41.69 O HETATM 3092 O HOH I 162 42.551 36.291 15.804 1.00 41.75 O HETATM 3093 O HOH I 163 35.275 32.179 14.673 1.00 38.75 O HETATM 3094 O HOH I 164 35.957 24.650 -7.203 1.00 44.79 O HETATM 3095 O HOH I 165 36.285 26.558 11.829 1.00 22.63 O HETATM 3096 O HOH I 166 45.833 24.949 2.452 1.00 36.59 O HETATM 3097 O HOH I 167 29.389 45.227 -14.028 1.00 49.22 O HETATM 3098 O HOH I 168 47.695 29.999 4.083 1.00 45.61 O HETATM 3099 O HOH I 169 44.054 40.342 -6.949 1.00 31.60 O HETATM 3100 O HOH I 170 41.047 42.580 13.044 0.50 18.63 O HETATM 3101 O HOH I 171 47.059 28.644 -3.012 1.00 40.61 O HETATM 3102 O HOH I 172 47.073 43.973 3.419 1.00 29.85 O HETATM 3103 O HOH I 173 41.862 27.703 9.596 1.00 40.38 O HETATM 3104 O HOH I 174 36.360 39.268 10.803 1.00 47.67 O HETATM 3105 O HOH I 175 47.733 25.050 5.386 1.00 52.36 O HETATM 3106 O HOH I 176 40.616 35.685 14.349 0.33 12.32 O HETATM 3107 O HOH I 177 32.180 44.681 -5.453 1.00 42.25 O HETATM 3108 O HOH I 178 28.408 39.158 1.715 1.00 48.19 O HETATM 3109 O HOH I 179 44.749 28.375 10.235 1.00 48.43 O HETATM 3110 O HOH I 180 35.701 23.177 -4.305 1.00 46.92 O HETATM 3111 O HOH I 181 40.812 26.407 7.580 1.00 51.23 O HETATM 3112 O HOH I 182 38.417 19.765 2.910 1.00 43.79 O HETATM 3113 O HOH I 183 30.614 40.272 6.560 1.00 50.19 O HETATM 3114 O HOH I 184 38.219 25.308 -10.168 1.00 47.28 O HETATM 3115 O HOH I 185 46.529 41.353 4.031 1.00 47.24 O CONECT 13 2552 CONECT 298 2552 CONECT 531 2552 CONECT 550 2552 CONECT 561 2552 CONECT 573 2552 CONECT 1176 2553 CONECT 1189 2553 CONECT 1214 2553 CONECT 2552 13 298 531 550 CONECT 2552 561 573 CONECT 2553 1176 1189 1214 2664 CONECT 2553 2766 CONECT 2554 2555 2556 2557 CONECT 2555 2554 CONECT 2556 2554 CONECT 2557 2554 2558 CONECT 2558 2557 2559 2560 2564 CONECT 2559 2558 CONECT 2560 2558 2561 CONECT 2561 2560 2562 2563 CONECT 2562 2561 CONECT 2563 2561 CONECT 2564 2558 2565 2566 CONECT 2565 2564 CONECT 2566 2564 CONECT 2567 2568 2569 2570 CONECT 2568 2567 CONECT 2569 2567 CONECT 2570 2567 2571 CONECT 2571 2570 2572 2573 2577 CONECT 2572 2571 CONECT 2573 2571 2574 CONECT 2574 2573 2575 2576 CONECT 2575 2574 CONECT 2576 2574 CONECT 2577 2571 2578 2579 CONECT 2578 2577 CONECT 2579 2577 CONECT 2580 2581 2582 2583 CONECT 2581 2580 CONECT 2582 2580 CONECT 2583 2580 2584 CONECT 2584 2583 2585 2586 2590 CONECT 2585 2584 CONECT 2586 2584 2587 CONECT 2587 2586 2588 2589 CONECT 2588 2587 CONECT 2589 2587 CONECT 2590 2584 2591 2592 CONECT 2591 2590 CONECT 2592 2590 CONECT 2593 2594 CONECT 2594 2593 2596 CONECT 2595 2596 2597 CONECT 2596 2594 2595 CONECT 2597 2595 2599 CONECT 2598 2599 2600 CONECT 2599 2597 2598 CONECT 2600 2598 2602 CONECT 2601 2602 2603 CONECT 2602 2600 2601 CONECT 2603 2601 CONECT 2604 2605 CONECT 2605 2604 2606 CONECT 2606 2605 2607 CONECT 2607 2606 2609 CONECT 2608 2609 2610 CONECT 2609 2607 2608 CONECT 2610 2608 2612 CONECT 2611 2612 2613 CONECT 2612 2610 2611 CONECT 2613 2611 2615 CONECT 2614 2615 2616 CONECT 2615 2613 2614 CONECT 2616 2614 2618 CONECT 2617 2618 2619 CONECT 2618 2616 2617 CONECT 2619 2617 CONECT 2620 2622 CONECT 2621 2622 2623 CONECT 2622 2620 2621 CONECT 2623 2621 2625 CONECT 2624 2625 2626 CONECT 2625 2623 2624 CONECT 2626 2624 2628 CONECT 2627 2628 2629 CONECT 2628 2626 2627 CONECT 2629 2627 2631 CONECT 2630 2631 2632 CONECT 2631 2629 2630 CONECT 2632 2630 CONECT 2664 2553 CONECT 2766 2553 MASTER 446 0 8 11 15 0 21 6 3064 2 94 27 END
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Related entries of code: 1tm5
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Protein Sequence Similarity
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RCSB PDB
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1tm1
RCSB PDB
PDBbind
64-mer
1tm3
RCSB PDB
PDBbind
64-mer
1tm4
RCSB PDB
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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RCSB PDB
PDBbind
64-mer
1y33
RCSB PDB
PDBbind
64-mer
1y34
RCSB PDB
PDBbind
64-mer
1y3b
RCSB PDB
PDBbind
64-mer
1y3c
RCSB PDB
PDBbind
64-mer
1y3d
RCSB PDB
PDBbind
64-mer
1y48
RCSB PDB
PDBbind
64-mer
Entry Information
PDB ID
1tm5
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
1.45(Å)
Affinity (Kd/Ki/IC50)
Ki=0.017nM
Release Year
2004
Protein/NA Sequence
Check fasta file
Primary Reference
Biochemistry v43 pp. 13648-56, 2004
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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