Browse entries in the PDBbind-CN Database
HEADER HYDROLASE 10-JUN-04 1TM4 TITLE CRYSTAL STRUCTURE OF THE COMPLEX OF SUBTILSIN BPN'WITH CHYMOTRYPSIN TITLE 2 INHIBITOR 2 M59G MUTANT COMPND MOL_ID: 1; COMPND 2 MOLECULE: SUBTILISIN BPN' PRECURSOR; 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: PCI2M59G KEYWDS SERINE PROTEASE, INHIBITOR, HYDROLASE EXPDTA X-RAY DIFFRACTION AUTHOR E.S.RADISKY,G.KWAN,C.J.KAREN LU,D.E.KOSHLAND JR. REVDAT 4 29-NOV-17 1TM4 1 REMARK REVDAT 3 11-OCT-17 1TM4 1 REMARK REVDAT 2 24-FEB-09 1TM4 1 VERSN REVDAT 1 09-NOV-04 1TM4 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. 1.70 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) : 1.70 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 81.65 REMARK 3 DATA CUTOFF (SIGMA(F)) : -3.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.2 REMARK 3 NUMBER OF REFLECTIONS : 51323 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) : 0.159 REMARK 3 R VALUE (WORKING SET) : 0.158 REMARK 3 FREE R VALUE : 0.183 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 2697 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) : 1.70 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.74 REMARK 3 REFLECTION IN BIN (WORKING SET) : 3516 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 BIN R VALUE (WORKING SET) : 0.2530 REMARK 3 BIN FREE R VALUE SET COUNT : 176 REMARK 3 BIN FREE R VALUE : 0.2650 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2499 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 67 REMARK 3 SOLVENT ATOMS : 439 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 21.39 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.35000 REMARK 3 B22 (A**2) : 0.35000 REMARK 3 B33 (A**2) : -0.52000 REMARK 3 B12 (A**2) : 0.17000 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): 0.076 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.077 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.050 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 1.556 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.967 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.958 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2660 ; 0.020 ; 0.021 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3608 ; 1.731 ; 1.955 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 345 ; 5.739 ; 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): 406 ; 0.133 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1993 ; 0.007 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 1274 ; 0.212 ; 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): 298 ; 0.151 ; 0.200 REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): 8 ; 0.057 ; 0.200 REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): 33 ; 0.422 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 35 ; 0.131 ; 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): 1714 ; 0.887 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2763 ; 1.511 ; 2.000 REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 946 ; 2.696 ; 3.000 REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 844 ; 4.564 ; 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 1TM4 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_1000022762. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 10-JAN-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 : 5.0.1 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 : 54020 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.700 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 (%) : 99.4 REMARK 200 DATA REDUNDANCY : 17.60 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 0.11200 REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 19.7000 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 400, REMARK 280 PH 4.6, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 277K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 65 2 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+2/3 REMARK 290 3555 -X+Y,-X,Z+1/3 REMARK 290 4555 -X,-Y,Z+1/2 REMARK 290 5555 Y,-X+Y,Z+1/6 REMARK 290 6555 X-Y,X,Z+5/6 REMARK 290 7555 Y,X,-Z+2/3 REMARK 290 8555 X-Y,-Y,-Z REMARK 290 9555 -X,-X+Y,-Z+1/3 REMARK 290 10555 -Y,-X,-Z+1/6 REMARK 290 11555 -X+Y,Y,-Z+1/2 REMARK 290 12555 X,X-Y,-Z+5/6 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 124.53733 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 62.26867 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 93.40300 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 31.13433 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 155.67167 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 124.53733 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 62.26867 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 31.13433 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 93.40300 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 155.67167 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: 2740 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 13360 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -24.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: E, I REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 7180 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 25740 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -54.0 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 141.15000 REMARK 350 BIOMT2 2 -0.866025 0.500000 0.000000 81.49299 REMARK 350 BIOMT3 2 0.000000 0.000000 -1.000000 62.26867 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 O6 CIT E 452 O6 CIT E 453 2.14 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 454 C13 1PE E 454 9765 1.88 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. = 6.1 DEGREES REMARK 500 ASP I 64 CB - CG - OD2 ANGL. DEV. = 5.5 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 LYS E 12 30.33 71.24 REMARK 500 ASP E 32 -151.11 -169.85 REMARK 500 ASP E 36 98.30 -69.97 REMARK 500 SER E 63 -22.52 109.40 REMARK 500 ALA E 73 24.74 -150.88 REMARK 500 ASN E 77 -158.84 -161.48 REMARK 500 SER E 159 67.97 -156.15 REMARK 500 LEU E 257 -124.46 -118.23 REMARK 500 REMARK 500 REMARK: NULL REMARK 610 REMARK 610 MISSING HETEROATOM REMARK 610 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 610 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 610 I=INSERTION CODE): REMARK 610 M RES C SSEQI REMARK 610 1PE E 454 REMARK 610 1PE E 456 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 450 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLN E 2 OE1 REMARK 620 2 ASP E 41 OD1 161.7 REMARK 620 3 LEU E 75 O 76.6 88.7 REMARK 620 4 ASN E 77 OD1 84.7 85.0 92.2 REMARK 620 5 ILE E 79 O 99.8 93.2 171.7 79.9 REMARK 620 6 VAL E 81 O 92.2 99.2 91.7 174.3 95.9 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 NA E 451 NA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLY E 169 O REMARK 620 2 TYR E 171 O 93.9 REMARK 620 3 VAL E 174 O 109.6 90.3 REMARK 620 4 HOH E 592 O 103.5 85.8 146.9 REMARK 620 5 HOH E 488 O 107.4 158.7 82.2 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 450 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NA E 451 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CIT E 452 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CIT E 453 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 1PE E 454 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 1PE E 455 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 1PE E 456 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: 1TM5 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 1TM4 E 1 275 UNP P00782 SUBT_BACAM 108 382 DBREF 1TM4 I 21 83 UNP Q40059 Q40059_HORVU 22 84 SEQADV 1TM4 HIS E 276 UNP P00782 EXPRESSION TAG SEQADV 1TM4 HIS E 277 UNP P00782 EXPRESSION TAG SEQADV 1TM4 HIS E 278 UNP P00782 EXPRESSION TAG SEQADV 1TM4 HIS E 279 UNP P00782 EXPRESSION TAG SEQADV 1TM4 HIS E 280 UNP P00782 EXPRESSION TAG SEQADV 1TM4 MET I 20 UNP Q40059 INITIATING METHIONINE SEQADV 1TM4 GLY 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 GLY 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 450 1 HET NA E 451 1 HET CIT E 452 13 HET CIT E 453 13 HET 1PE E 454 11 HET 1PE E 455 16 HET 1PE E 456 12 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 2(C6 H8 O7) FORMUL 7 1PE 3(C10 H22 O6) FORMUL 10 HOH *439(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 450 1555 1555 2.41 LINK OD1 ASP E 41 CA CA E 450 1555 1555 2.43 LINK O LEU E 75 CA CA E 450 1555 1555 2.36 LINK OD1 ASN E 77 CA CA E 450 1555 1555 2.38 LINK O ILE E 79 CA CA E 450 1555 1555 2.39 LINK O VAL E 81 CA CA E 450 1555 1555 2.41 LINK O GLY E 169 NA NA E 451 1555 1555 2.35 LINK O TYR E 171 NA NA E 451 1555 1555 2.33 LINK O VAL E 174 NA NA E 451 1555 1555 2.31 LINK NA NA E 451 O HOH E 592 1555 1555 2.46 LINK NA NA E 451 O HOH E 488 1555 1555 2.55 CISPEP 1 TYR E 167 PRO E 168 0 7.60 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 488 SITE 2 AC2 5 HOH E 592 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 453 SITE 3 AC3 13 HOH E 484 HOH E 539 HOH E 573 HOH E 778 SITE 4 AC3 13 HOH E 800 SITE 1 AC4 12 TRP E 241 GLN E 245 HIS E 276 CIT E 452 SITE 2 AC4 12 HOH E 516 HOH E 539 HOH E 674 HOH E 682 SITE 3 AC4 12 HOH E 760 HOH E 778 HOH E 800 HOH E 801 SITE 1 AC5 5 HIS E 17 THR E 22 ASN E 76 HOH E 530 SITE 2 AC5 5 HOH E 773 SITE 1 AC6 6 ILE E 115 ASN E 118 MET E 119 SER E 145 SITE 2 AC6 6 HOH E 617 HOH E 802 SITE 1 AC7 5 SER E 37 VAL E 44 ALA E 45 PHE E 58 SITE 2 AC7 5 HOH E 779 CRYST1 94.100 94.100 186.806 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 0.010627 0.006135 0.000000 0.00000 SCALE2 0.000000 0.012271 0.000000 0.00000 SCALE3 0.000000 0.000000 0.005353 0.00000 ATOM 1 N ALA E 1 49.120 51.314 36.846 1.00 15.68 N ATOM 2 CA ALA E 1 50.557 51.296 36.384 1.00 15.60 C ATOM 3 C ALA E 1 50.546 51.077 34.895 1.00 15.50 C ATOM 4 O ALA E 1 49.697 50.318 34.353 1.00 16.29 O ATOM 5 CB ALA E 1 51.313 50.120 37.059 1.00 15.04 C ATOM 6 N GLN E 2 51.511 51.699 34.235 1.00 13.71 N ATOM 7 CA GLN E 2 51.745 51.500 32.815 1.00 12.75 C ATOM 8 C GLN E 2 52.604 50.233 32.581 1.00 12.53 C ATOM 9 O GLN E 2 53.453 49.864 33.410 1.00 14.49 O ATOM 10 CB GLN E 2 52.490 52.746 32.313 1.00 11.83 C ATOM 11 CG GLN E 2 53.023 52.688 30.879 1.00 14.28 C ATOM 12 CD GLN E 2 53.507 54.056 30.491 1.00 14.58 C ATOM 13 OE1 GLN E 2 52.735 54.857 29.940 1.00 13.33 O ATOM 14 NE2 GLN E 2 54.786 54.361 30.833 1.00 11.98 N ATOM 15 N SER E 3 52.380 49.573 31.442 1.00 11.80 N ATOM 16 CA SER E 3 53.192 48.414 31.007 1.00 13.25 C ATOM 17 C SER E 3 53.899 48.779 29.711 1.00 13.27 C ATOM 18 O SER E 3 53.363 49.528 28.879 1.00 13.39 O ATOM 19 CB SER E 3 52.277 47.182 30.752 1.00 14.61 C ATOM 20 OG ASER E 3 51.148 47.510 30.002 0.33 13.33 O ATOM 21 OG BSER E 3 52.913 46.185 29.990 0.33 14.94 O ATOM 22 OG CSER E 3 51.502 46.847 31.876 0.33 13.94 O ATOM 23 N VAL E 4 55.108 48.275 29.548 1.00 13.02 N ATOM 24 CA VAL E 4 55.837 48.497 28.298 1.00 13.24 C ATOM 25 C VAL E 4 55.737 47.202 27.474 1.00 13.21 C ATOM 26 O VAL E 4 56.314 46.186 27.872 1.00 14.73 O ATOM 27 CB VAL E 4 57.303 48.787 28.607 1.00 13.38 C ATOM 28 CG1 VAL E 4 58.112 49.014 27.296 1.00 14.82 C ATOM 29 CG2 VAL E 4 57.373 50.047 29.512 1.00 13.30 C ATOM 30 N PRO E 5 55.004 47.216 26.357 1.00 12.01 N ATOM 31 CA PRO E 5 54.865 45.988 25.554 1.00 13.44 C ATOM 32 C PRO E 5 56.254 45.499 25.140 1.00 13.70 C ATOM 33 O PRO E 5 57.177 46.317 24.920 1.00 13.54 O ATOM 34 CB PRO E 5 54.061 46.461 24.344 1.00 14.78 C ATOM 35 CG PRO E 5 53.250 47.658 24.886 1.00 15.22 C ATOM 36 CD PRO E 5 54.258 48.367 25.771 1.00 13.72 C ATOM 37 N TYR E 6 56.415 44.182 25.026 1.00 13.16 N ATOM 38 CA TYR E 6 57.756 43.640 24.739 1.00 13.94 C ATOM 39 C TYR E 6 58.413 44.216 23.482 1.00 13.24 C ATOM 40 O TYR E 6 59.643 44.391 23.454 1.00 13.36 O ATOM 41 CB TYR E 6 57.726 42.090 24.651 1.00 14.12 C ATOM 42 CG TYR E 6 57.311 41.548 23.269 1.00 15.90 C ATOM 43 CD1 TYR E 6 58.273 41.333 22.256 1.00 15.67 C ATOM 44 CD2 TYR E 6 55.969 41.232 22.975 1.00 16.99 C ATOM 45 CE1 TYR E 6 57.893 40.855 20.969 1.00 15.44 C ATOM 46 CE2 TYR E 6 55.597 40.730 21.708 1.00 13.40 C ATOM 47 CZ TYR E 6 56.578 40.537 20.727 1.00 16.73 C ATOM 48 OH TYR E 6 56.267 40.060 19.469 1.00 19.87 O ATOM 49 N GLY E 7 57.602 44.521 22.475 1.00 12.60 N ATOM 50 CA GLY E 7 58.125 44.976 21.188 1.00 12.16 C ATOM 51 C GLY E 7 58.808 46.344 21.301 1.00 12.58 C ATOM 52 O GLY E 7 59.815 46.611 20.620 1.00 12.52 O ATOM 53 N VAL E 8 58.291 47.186 22.196 1.00 12.31 N ATOM 54 CA VAL E 8 58.907 48.522 22.418 1.00 11.94 C ATOM 55 C VAL E 8 60.316 48.325 23.016 1.00 12.29 C ATOM 56 O VAL E 8 61.306 48.976 22.582 1.00 11.79 O ATOM 57 CB VAL E 8 58.013 49.366 23.372 1.00 11.89 C ATOM 58 CG1 VAL E 8 58.709 50.719 23.752 1.00 12.67 C ATOM 59 CG2 VAL E 8 56.674 49.630 22.655 1.00 12.68 C ATOM 60 N SER E 9 60.439 47.394 23.965 1.00 11.53 N ATOM 61 CA SER E 9 61.751 47.065 24.535 1.00 12.98 C ATOM 62 C SER E 9 62.666 46.402 23.528 1.00 12.51 C ATOM 63 O SER E 9 63.888 46.662 23.517 1.00 13.65 O ATOM 64 CB SER E 9 61.594 46.173 25.798 1.00 13.28 C ATOM 65 OG SER E 9 60.775 46.876 26.746 1.00 16.20 O ATOM 66 N GLN E 10 62.085 45.542 22.689 1.00 12.52 N ATOM 67 CA GLN E 10 62.891 44.726 21.766 1.00 12.98 C ATOM 68 C GLN E 10 63.630 45.582 20.709 1.00 14.59 C ATOM 69 O GLN E 10 64.771 45.228 20.299 1.00 15.08 O ATOM 70 CB GLN E 10 61.990 43.696 21.080 1.00 12.47 C ATOM 71 CG GLN E 10 62.762 42.711 20.195 1.00 14.86 C ATOM 72 CD GLN E 10 61.876 41.496 19.851 1.00 18.75 C ATOM 73 OE1 GLN E 10 60.968 41.189 20.603 1.00 22.89 O ATOM 74 NE2 GLN E 10 62.126 40.846 18.704 1.00 15.31 N ATOM 75 N ILE E 11 63.014 46.696 20.297 1.00 13.22 N ATOM 76 CA ILE E 11 63.670 47.587 19.302 1.00 12.82 C ATOM 77 C ILE E 11 64.567 48.645 19.983 1.00 13.89 C ATOM 78 O ILE E 11 65.165 49.470 19.276 1.00 12.91 O ATOM 79 CB ILE E 11 62.615 48.291 18.394 1.00 12.37 C ATOM 80 CG1 ILE E 11 61.791 49.334 19.193 1.00 12.20 C ATOM 81 CG2 ILE E 11 61.805 47.228 17.593 1.00 13.84 C ATOM 82 CD1 ILE E 11 61.034 50.315 18.258 1.00 12.18 C ATOM 83 N LYS E 12 64.652 48.572 21.312 1.00 13.09 N ATOM 84 CA LYS E 12 65.534 49.397 22.179 1.00 13.78 C ATOM 85 C LYS E 12 65.043 50.838 22.239 1.00 12.86 C ATOM 86 O LYS E 12 65.846 51.774 22.434 1.00 13.69 O ATOM 87 CB LYS E 12 67.002 49.291 21.720 1.00 13.89 C ATOM 88 CG LYS E 12 67.521 47.803 21.748 1.00 18.61 C ATOM 89 CD LYS E 12 69.008 47.734 21.553 1.00 25.39 C ATOM 90 CE LYS E 12 69.512 46.284 21.456 1.00 28.94 C ATOM 91 NZ LYS E 12 68.968 45.385 22.541 1.00 33.61 N ATOM 92 N ALA E 13 63.732 51.030 22.113 1.00 13.12 N ATOM 93 CA ALA E 13 63.165 52.383 22.331 1.00 12.53 C ATOM 94 C ALA E 13 63.444 52.958 23.743 1.00 13.40 C ATOM 95 O ALA E 13 63.700 54.175 23.860 1.00 13.49 O ATOM 96 CB ALA E 13 61.629 52.444 22.017 1.00 12.37 C ATOM 97 N PRO E 14 63.431 52.147 24.814 1.00 13.68 N ATOM 98 CA PRO E 14 63.719 52.722 26.146 1.00 13.37 C ATOM 99 C PRO E 14 65.097 53.392 26.201 1.00 13.70 C ATOM 100 O PRO E 14 65.249 54.321 27.005 1.00 13.34 O ATOM 101 CB PRO E 14 63.643 51.505 27.076 1.00 14.28 C ATOM 102 CG PRO E 14 62.482 50.650 26.354 1.00 14.67 C ATOM 103 CD PRO E 14 63.019 50.710 24.904 1.00 12.89 C ATOM 104 N ALA E 15 66.076 52.959 25.394 1.00 13.82 N ATOM 105 CA ALA E 15 67.379 53.683 25.386 1.00 14.20 C ATOM 106 C ALA E 15 67.241 55.133 24.909 1.00 15.28 C ATOM 107 O ALA E 15 67.907 56.015 25.445 1.00 15.10 O ATOM 108 CB ALA E 15 68.418 52.958 24.553 1.00 15.08 C ATOM 109 N LEU E 16 66.388 55.383 23.924 1.00 13.16 N ATOM 110 CA LEU E 16 66.115 56.760 23.498 1.00 13.62 C ATOM 111 C LEU E 16 65.378 57.518 24.597 1.00 13.75 C ATOM 112 O LEU E 16 65.684 58.703 24.874 1.00 12.77 O ATOM 113 CB LEU E 16 65.287 56.810 22.190 1.00 14.33 C ATOM 114 CG LEU E 16 66.093 56.830 20.871 1.00 16.22 C ATOM 115 CD1 LEU E 16 66.755 58.238 20.675 1.00 15.12 C ATOM 116 CD2 LEU E 16 67.171 55.727 20.920 1.00 15.99 C ATOM 117 N HIS E 17 64.353 56.875 25.193 1.00 12.85 N ATOM 118 CA HIS E 17 63.576 57.525 26.241 1.00 12.76 C ATOM 119 C HIS E 17 64.497 57.966 27.393 1.00 12.69 C ATOM 120 O HIS E 17 64.328 59.087 27.916 1.00 14.00 O ATOM 121 CB HIS E 17 62.498 56.566 26.805 1.00 12.32 C ATOM 122 CG HIS E 17 61.496 56.136 25.766 1.00 12.71 C ATOM 123 ND1 HIS E 17 60.600 55.108 25.984 1.00 13.51 N ATOM 124 CD2 HIS E 17 61.271 56.577 24.504 1.00 11.10 C ATOM 125 CE1 HIS E 17 59.866 54.939 24.890 1.00 15.01 C ATOM 126 NE2 HIS E 17 60.263 55.810 23.971 1.00 11.94 N ATOM 127 N SER E 18 65.487 57.133 27.740 1.00 12.43 N ATOM 128 CA SER E 18 66.351 57.483 28.881 1.00 12.56 C ATOM 129 C SER E 18 67.307 58.618 28.533 1.00 12.52 C ATOM 130 O SER E 18 67.794 59.311 29.417 1.00 12.89 O ATOM 131 CB SER E 18 67.162 56.300 29.435 1.00 12.32 C ATOM 132 OG ASER E 18 66.358 55.195 29.717 0.50 14.02 O ATOM 133 OG BSER E 18 68.075 55.796 28.496 0.50 11.29 O ATOM 134 N GLN E 19 67.603 58.764 27.238 1.00 12.44 N ATOM 135 CA GLN E 19 68.427 59.913 26.775 1.00 11.38 C ATOM 136 C GLN E 19 67.614 61.199 26.770 1.00 12.65 C ATOM 137 O GLN E 19 68.196 62.290 26.622 1.00 12.88 O ATOM 138 CB GLN E 19 68.929 59.673 25.345 1.00 11.42 C ATOM 139 CG GLN E 19 69.972 58.537 25.218 1.00 13.83 C ATOM 140 CD GLN E 19 70.288 58.254 23.727 1.00 19.79 C ATOM 141 OE1 GLN E 19 70.525 59.184 22.985 1.00 25.11 O ATOM 142 NE2 GLN E 19 70.259 56.976 23.296 1.00 20.75 N ATOM 143 N GLY E 20 66.282 61.072 26.888 1.00 13.03 N ATOM 144 CA GLY E 20 65.369 62.214 26.925 1.00 12.73 C ATOM 145 C GLY E 20 64.598 62.461 25.629 1.00 14.58 C ATOM 146 O GLY E 20 63.997 63.533 25.458 1.00 14.99 O ATOM 147 N TYR E 21 64.575 61.462 24.731 1.00 12.91 N ATOM 148 CA TYR E 21 63.979 61.663 23.398 1.00 12.57 C ATOM 149 C TYR E 21 62.789 60.723 23.216 1.00 13.57 C ATOM 150 O TYR E 21 62.893 59.486 23.474 1.00 14.49 O ATOM 151 CB TYR E 21 65.039 61.449 22.280 1.00 13.61 C ATOM 152 CG TYR E 21 66.110 62.506 22.371 1.00 12.27 C ATOM 153 CD1 TYR E 21 65.786 63.830 22.067 1.00 13.09 C ATOM 154 CD2 TYR E 21 67.414 62.180 22.768 1.00 14.36 C ATOM 155 CE1 TYR E 21 66.754 64.858 22.171 1.00 16.32 C ATOM 156 CE2 TYR E 21 68.414 63.220 22.895 1.00 15.12 C ATOM 157 CZ TYR E 21 68.034 64.536 22.591 1.00 16.89 C ATOM 158 OH TYR E 21 68.921 65.577 22.655 1.00 19.67 O ATOM 159 N THR E 22 61.635 61.312 22.861 1.00 12.34 N ATOM 160 CA THR E 22 60.349 60.598 22.860 1.00 13.18 C ATOM 161 C THR E 22 59.508 60.985 21.628 1.00 12.47 C ATOM 162 O THR E 22 58.314 60.683 21.593 1.00 12.00 O ATOM 163 CB THR E 22 59.517 60.939 24.122 1.00 13.77 C ATOM 164 OG1 THR E 22 59.479 62.385 24.272 1.00 15.12 O ATOM 165 CG2 THR E 22 60.177 60.385 25.411 1.00 15.39 C ATOM 166 N GLY E 23 60.101 61.640 20.635 1.00 12.30 N ATOM 167 CA GLY E 23 59.351 61.998 19.427 1.00 13.10 C ATOM 168 C GLY E 23 58.691 63.370 19.513 1.00 13.55 C ATOM 169 O GLY E 23 57.868 63.706 18.648 1.00 13.44 O ATOM 170 N SER E 24 59.093 64.197 20.494 1.00 13.86 N ATOM 171 CA SER E 24 58.450 65.523 20.637 1.00 14.93 C ATOM 172 C SER E 24 58.551 66.355 19.354 1.00 15.64 C ATOM 173 O SER E 24 59.606 66.410 18.720 1.00 15.96 O ATOM 174 CB SER E 24 59.122 66.337 21.753 1.00 15.53 C ATOM 175 OG ASER E 24 58.975 65.742 23.006 0.67 14.85 O ATOM 176 OG BSER E 24 58.297 67.464 22.062 0.33 14.92 O ATOM 177 N ASN E 25 57.431 66.957 18.965 1.00 17.25 N ATOM 178 CA ASN E 25 57.352 67.877 17.826 1.00 19.52 C ATOM 179 C ASN E 25 57.465 67.173 16.473 1.00 18.74 C ATOM 180 O ASN E 25 57.537 67.847 15.448 1.00 22.15 O ATOM 181 CB ASN E 25 58.415 68.978 17.899 1.00 20.41 C ATOM 182 CG ASN E 25 58.277 69.828 19.131 1.00 28.76 C ATOM 183 OD1 ASN E 25 57.176 70.267 19.478 1.00 32.91 O ATOM 184 ND2 ASN E 25 59.392 70.034 19.832 1.00 34.46 N ATOM 185 N VAL E 26 57.468 65.839 16.451 1.00 15.11 N ATOM 186 CA VAL E 26 57.499 65.141 15.186 1.00 14.52 C ATOM 187 C VAL E 26 56.069 64.766 14.803 1.00 14.11 C ATOM 188 O VAL E 26 55.344 64.171 15.601 1.00 14.82 O ATOM 189 CB VAL E 26 58.358 63.843 15.279 1.00 13.22 C ATOM 190 CG1 VAL E 26 58.399 63.109 13.892 1.00 15.00 C ATOM 191 CG2 VAL E 26 59.785 64.221 15.772 1.00 15.06 C ATOM 192 N LYS E 27 55.690 65.094 13.578 1.00 14.61 N ATOM 193 CA LYS E 27 54.320 64.859 13.117 1.00 14.59 C ATOM 194 C LYS E 27 54.239 63.508 12.383 1.00 14.29 C ATOM 195 O LYS E 27 54.892 63.320 11.345 1.00 14.58 O ATOM 196 CB LYS E 27 53.888 65.996 12.164 1.00 14.00 C ATOM 197 CG LYS E 27 53.819 67.381 12.888 1.00 15.16 C ATOM 198 CD LYS E 27 53.202 68.460 11.927 1.00 21.77 C ATOM 199 CE LYS E 27 53.107 69.818 12.637 1.00 28.02 C ATOM 200 NZ LYS E 27 54.507 70.335 12.617 1.00 33.93 N ATOM 201 N VAL E 28 53.408 62.606 12.919 1.00 13.68 N ATOM 202 CA VAL E 28 53.256 61.260 12.347 1.00 13.93 C ATOM 203 C VAL E 28 51.797 61.045 11.928 1.00 13.49 C ATOM 204 O VAL E 28 50.872 61.159 12.760 1.00 14.75 O ATOM 205 CB VAL E 28 53.644 60.158 13.367 1.00 13.99 C ATOM 206 CG1 VAL E 28 53.533 58.766 12.703 1.00 15.45 C ATOM 207 CG2 VAL E 28 55.085 60.418 13.899 1.00 13.51 C ATOM 208 N ALA E 29 51.603 60.787 10.635 1.00 14.18 N ATOM 209 CA ALA E 29 50.256 60.487 10.129 1.00 14.32 C ATOM 210 C ALA E 29 50.075 58.973 10.147 1.00 14.07 C ATOM 211 O ALA E 29 50.825 58.274 9.477 1.00 15.09 O ATOM 212 CB ALA E 29 50.089 61.012 8.677 1.00 15.74 C ATOM 213 N VAL E 30 49.054 58.494 10.845 1.00 14.75 N ATOM 214 CA VAL E 30 48.622 57.094 10.775 1.00 14.32 C ATOM 215 C VAL E 30 47.500 57.040 9.709 1.00 13.90 C ATOM 216 O VAL E 30 46.369 57.492 9.937 1.00 16.06 O ATOM 217 CB VAL E 30 48.158 56.621 12.163 1.00 14.99 C ATOM 218 CG1 VAL E 30 47.575 55.227 12.093 1.00 14.50 C ATOM 219 CG2 VAL E 30 49.373 56.605 13.152 1.00 15.66 C ATOM 220 N ILE E 31 47.854 56.512 8.534 1.00 15.73 N ATOM 221 CA ILE E 31 46.956 56.504 7.371 1.00 14.75 C ATOM 222 C ILE E 31 46.300 55.138 7.449 1.00 14.85 C ATOM 223 O ILE E 31 46.957 54.115 7.220 1.00 14.83 O ATOM 224 CB ILE E 31 47.756 56.717 6.065 1.00 15.63 C ATOM 225 CG1 ILE E 31 48.396 58.133 6.070 1.00 16.59 C ATOM 226 CG2 ILE E 31 46.818 56.508 4.838 1.00 15.43 C ATOM 227 CD1 ILE E 31 49.021 58.560 4.698 1.00 15.04 C ATOM 228 N ASP E 32 45.031 55.117 7.865 1.00 14.91 N ATOM 229 CA ASP E 32 44.470 53.867 8.379 1.00 15.58 C ATOM 230 C ASP E 32 42.933 54.013 8.558 1.00 16.42 C ATOM 231 O ASP E 32 42.296 54.794 7.843 1.00 16.62 O ATOM 232 CB ASP E 32 45.162 53.547 9.725 1.00 15.63 C ATOM 233 CG ASP E 32 45.293 52.054 9.977 1.00 17.66 C ATOM 234 OD1 ASP E 32 44.208 51.417 10.124 1.00 16.13 O ATOM 235 OD2 ASP E 32 46.414 51.472 10.052 1.00 18.12 O ATOM 236 N SER E 33 42.355 53.281 9.505 1.00 16.07 N ATOM 237 CA SER E 33 40.895 53.317 9.736 1.00 15.82 C ATOM 238 C SER E 33 40.378 54.393 10.672 1.00 17.04 C ATOM 239 O SER E 33 39.218 54.300 11.116 1.00 16.70 O ATOM 240 CB SER E 33 40.428 51.913 10.235 1.00 16.65 C ATOM 241 OG SER E 33 40.831 51.653 11.614 1.00 15.42 O ATOM 242 N GLY E 34 41.203 55.409 10.992 1.00 15.78 N ATOM 243 CA GLY E 34 40.800 56.391 11.993 1.00 16.15 C ATOM 244 C GLY E 34 41.581 56.136 13.286 1.00 16.35 C ATOM 245 O GLY E 34 42.326 55.148 13.381 1.00 16.79 O ATOM 246 N ILE E 35 41.448 57.039 14.252 1.00 15.70 N ATOM 247 CA ILE E 35 41.999 56.800 15.594 1.00 15.76 C ATOM 248 C ILE E 35 40.982 57.243 16.618 1.00 16.99 C ATOM 249 O ILE E 35 40.486 58.378 16.532 1.00 17.24 O ATOM 250 CB ILE E 35 43.328 57.628 15.848 1.00 15.26 C ATOM 251 CG1 ILE E 35 44.423 57.354 14.772 1.00 15.52 C ATOM 252 CG2 ILE E 35 43.859 57.314 17.263 1.00 14.18 C ATOM 253 CD1 ILE E 35 45.682 58.297 14.923 1.00 15.84 C ATOM 254 N ASP E 36 40.667 56.397 17.597 1.00 16.96 N ATOM 255 CA ASP E 36 39.742 56.800 18.655 1.00 17.54 C ATOM 256 C ASP E 36 40.378 57.858 19.582 1.00 19.01 C ATOM 257 O ASP E 36 41.102 57.510 20.517 1.00 17.72 O ATOM 258 CB ASP E 36 39.300 55.581 19.486 1.00 19.34 C ATOM 259 CG ASP E 36 38.303 55.956 20.586 1.00 21.89 C ATOM 260 OD1 ASP E 36 37.937 57.160 20.739 1.00 23.19 O ATOM 261 OD2 ASP E 36 37.848 55.089 21.350 1.00 26.19 O ATOM 262 N SER E 37 40.065 59.132 19.346 1.00 19.80 N ATOM 263 CA SER E 37 40.695 60.247 20.084 1.00 20.70 C ATOM 264 C SER E 37 40.231 60.339 21.531 1.00 20.57 C ATOM 265 O SER E 37 40.880 61.035 22.306 1.00 23.41 O ATOM 266 CB SER E 37 40.419 61.613 19.396 1.00 21.11 C ATOM 267 OG SER E 37 39.011 61.848 19.340 1.00 23.19 O ATOM 268 N SER E 38 39.146 59.646 21.898 1.00 18.76 N ATOM 269 CA SER E 38 38.687 59.625 23.305 1.00 18.84 C ATOM 270 C SER E 38 39.509 58.683 24.195 1.00 18.56 C ATOM 271 O SER E 38 39.281 58.648 25.407 1.00 18.16 O ATOM 272 CB SER E 38 37.198 59.237 23.425 1.00 19.32 C ATOM 273 OG ASER E 38 37.011 57.884 23.077 0.50 19.08 O ATOM 274 OG BSER E 38 36.386 60.303 22.999 0.50 19.60 O ATOM 275 N HIS E 39 40.402 57.866 23.591 1.00 15.39 N ATOM 276 CA HIS E 39 41.165 56.921 24.412 1.00 15.65 C ATOM 277 C HIS E 39 42.095 57.713 25.355 1.00 14.51 C ATOM 278 O HIS E 39 42.835 58.570 24.878 1.00 15.92 O ATOM 279 CB HIS E 39 42.017 55.986 23.517 1.00 14.81 C ATOM 280 CG HIS E 39 42.425 54.725 24.214 1.00 16.06 C ATOM 281 ND1 HIS E 39 43.281 54.731 25.290 1.00 14.44 N ATOM 282 CD2 HIS E 39 42.093 53.430 23.999 1.00 13.82 C ATOM 283 CE1 HIS E 39 43.435 53.492 25.736 1.00 13.57 C ATOM 284 NE2 HIS E 39 42.757 52.676 24.943 1.00 13.34 N ATOM 285 N PRO E 40 42.068 57.433 26.655 1.00 15.29 N ATOM 286 CA PRO E 40 42.907 58.189 27.594 1.00 15.36 C ATOM 287 C PRO E 40 44.402 57.926 27.457 1.00 15.57 C ATOM 288 O PRO E 40 45.170 58.745 27.978 1.00 16.20 O ATOM 289 CB PRO E 40 42.421 57.746 28.974 1.00 16.19 C ATOM 290 CG PRO E 40 41.905 56.338 28.763 1.00 15.81 C ATOM 291 CD PRO E 40 41.227 56.423 27.351 1.00 15.40 C ATOM 292 N ASP E 41 44.791 56.892 26.730 1.00 14.04 N ATOM 293 CA ASP E 41 46.232 56.645 26.503 1.00 14.35 C ATOM 294 C ASP E 41 46.694 57.111 25.122 1.00 13.28 C ATOM 295 O ASP E 41 47.797 56.715 24.688 1.00 13.74 O ATOM 296 CB ASP E 41 46.523 55.147 26.697 1.00 14.12 C ATOM 297 CG ASP E 41 47.957 54.862 27.175 1.00 14.86 C ATOM 298 OD1 ASP E 41 48.522 55.722 27.861 1.00 14.68 O ATOM 299 OD2 ASP E 41 48.522 53.783 26.920 1.00 18.01 O ATOM 300 N LEU E 42 45.903 57.960 24.446 1.00 13.48 N ATOM 301 CA LEU E 42 46.314 58.561 23.157 1.00 14.61 C ATOM 302 C LEU E 42 46.021 60.043 23.192 1.00 16.15 C ATOM 303 O LEU E 42 45.052 60.492 23.862 1.00 16.88 O ATOM 304 CB LEU E 42 45.523 57.951 21.964 1.00 14.13 C ATOM 305 CG LEU E 42 45.738 56.447 21.704 1.00 12.93 C ATOM 306 CD1 LEU E 42 44.801 55.940 20.573 1.00 14.42 C ATOM 307 CD2 LEU E 42 47.194 56.114 21.309 1.00 15.21 C ATOM 308 N LYS E 43 46.860 60.799 22.507 1.00 15.25 N ATOM 309 CA LYS E 43 46.545 62.211 22.239 1.00 17.57 C ATOM 310 C LYS E 43 46.612 62.428 20.755 1.00 17.50 C ATOM 311 O LYS E 43 47.674 62.339 20.156 1.00 18.68 O ATOM 312 CB LYS E 43 47.558 63.131 22.948 1.00 17.30 C ATOM 313 CG LYS E 43 47.268 64.658 22.720 1.00 21.52 C ATOM 314 CD LYS E 43 48.352 65.460 23.489 1.00 29.98 C ATOM 315 CE LYS E 43 48.098 66.960 23.528 1.00 36.03 C ATOM 316 NZ LYS E 43 49.273 67.622 24.219 1.00 37.76 N ATOM 317 N VAL E 44 45.482 62.689 20.127 1.00 16.10 N ATOM 318 CA VAL E 44 45.475 62.941 18.688 1.00 16.51 C ATOM 319 C VAL E 44 45.507 64.463 18.410 1.00 18.18 C ATOM 320 O VAL E 44 44.639 65.204 18.917 1.00 18.29 O ATOM 321 CB VAL E 44 44.204 62.330 18.056 1.00 16.74 C ATOM 322 CG1 VAL E 44 44.159 62.597 16.552 1.00 18.53 C ATOM 323 CG2 VAL E 44 44.155 60.823 18.325 1.00 17.08 C ATOM 324 N ALA E 45 46.459 64.896 17.589 1.00 17.26 N ATOM 325 CA ALA E 45 46.718 66.318 17.375 1.00 18.70 C ATOM 326 C ALA E 45 45.865 66.876 16.230 1.00 19.45 C ATOM 327 O ALA E 45 45.665 68.094 16.150 1.00 21.20 O ATOM 328 CB ALA E 45 48.221 66.554 17.046 1.00 18.09 C ATOM 329 N GLY E 46 45.423 66.027 15.312 1.00 18.70 N ATOM 330 CA GLY E 46 44.713 66.513 14.126 1.00 18.75 C ATOM 331 C GLY E 46 44.408 65.360 13.195 1.00 18.64 C ATOM 332 O GLY E 46 44.613 64.187 13.546 1.00 18.58 O ATOM 333 N GLY E 47 43.910 65.676 12.004 1.00 18.59 N ATOM 334 CA GLY E 47 43.619 64.619 11.045 1.00 18.28 C ATOM 335 C GLY E 47 42.533 65.025 10.062 1.00 19.17 C ATOM 336 O GLY E 47 42.106 66.178 10.051 1.00 20.27 O ATOM 337 N ALA E 48 42.145 64.087 9.219 1.00 18.97 N ATOM 338 CA ALA E 48 41.152 64.337 8.169 1.00 19.25 C ATOM 339 C ALA E 48 40.674 62.984 7.717 1.00 19.76 C ATOM 340 O ALA E 48 41.427 62.012 7.766 1.00 19.14 O ATOM 341 CB ALA E 48 41.814 65.070 6.985 1.00 19.24 C ATOM 342 N SER E 49 39.418 62.906 7.251 1.00 19.50 N ATOM 343 CA SER E 49 38.937 61.651 6.665 1.00 20.41 C ATOM 344 C SER E 49 38.728 61.754 5.154 1.00 20.69 C ATOM 345 O SER E 49 38.140 62.741 4.679 1.00 21.77 O ATOM 346 CB SER E 49 37.607 61.228 7.303 1.00 20.92 C ATOM 347 OG SER E 49 37.088 60.127 6.550 1.00 22.26 O ATOM 348 N MET E 50 39.195 60.754 4.426 1.00 19.90 N ATOM 349 CA MET E 50 39.028 60.615 2.960 1.00 20.72 C ATOM 350 C MET E 50 37.966 59.543 2.610 1.00 21.75 C ATOM 351 O MET E 50 37.823 59.169 1.438 1.00 23.01 O ATOM 352 CB MET E 50 40.356 60.182 2.328 1.00 20.33 C ATOM 353 CG MET E 50 41.535 61.014 2.786 1.00 21.95 C ATOM 354 SD MET E 50 41.291 62.777 2.373 1.00 25.78 S ATOM 355 CE MET E 50 42.173 63.583 3.682 1.00 26.52 C ATOM 356 N VAL E 51 37.292 59.015 3.622 1.00 21.54 N ATOM 357 CA VAL E 51 36.247 57.992 3.426 1.00 23.90 C ATOM 358 C VAL E 51 34.870 58.683 3.278 1.00 25.12 C ATOM 359 O VAL E 51 34.359 59.261 4.234 1.00 25.15 O ATOM 360 CB VAL E 51 36.237 56.963 4.595 1.00 24.20 C ATOM 361 CG1 VAL E 51 35.081 55.907 4.415 1.00 23.94 C ATOM 362 CG2 VAL E 51 37.605 56.273 4.678 1.00 21.56 C ATOM 363 N PRO E 52 34.289 58.625 2.072 1.00 26.60 N ATOM 364 CA PRO E 52 33.058 59.386 1.772 1.00 27.83 C ATOM 365 C PRO E 52 31.919 59.170 2.785 1.00 27.85 C ATOM 366 O PRO E 52 31.265 60.134 3.201 1.00 28.70 O ATOM 367 CB PRO E 52 32.684 58.907 0.358 1.00 28.02 C ATOM 368 CG PRO E 52 34.022 58.489 -0.266 1.00 28.04 C ATOM 369 CD PRO E 52 34.799 57.885 0.905 1.00 26.25 C ATOM 370 N SER E 53 31.704 57.937 3.232 1.00 28.79 N ATOM 371 CA SER E 53 30.595 57.680 4.152 1.00 30.36 C ATOM 372 C SER E 53 30.958 57.666 5.663 1.00 30.33 C ATOM 373 O SER E 53 30.099 57.389 6.525 1.00 29.64 O ATOM 374 CB SER E 53 29.858 56.400 3.750 1.00 31.46 C ATOM 375 OG SER E 53 30.645 55.285 4.082 1.00 36.46 O ATOM 376 N GLU E 54 32.226 57.964 5.985 1.00 28.64 N ATOM 377 CA GLU E 54 32.659 58.036 7.385 1.00 28.03 C ATOM 378 C GLU E 54 33.521 59.287 7.550 1.00 27.85 C ATOM 379 O GLU E 54 34.741 59.224 7.417 1.00 28.40 O ATOM 380 CB GLU E 54 33.471 56.800 7.767 1.00 27.63 C ATOM 381 CG GLU E 54 32.701 55.495 7.784 1.00 29.06 C ATOM 382 CD GLU E 54 33.530 54.323 8.308 1.00 31.40 C ATOM 383 OE1 GLU E 54 34.487 54.550 9.098 1.00 32.62 O ATOM 384 OE2 GLU E 54 33.221 53.169 7.946 1.00 30.84 O ATOM 385 N THR E 55 32.880 60.409 7.836 1.00 26.65 N ATOM 386 CA THR E 55 33.553 61.696 7.709 1.00 27.09 C ATOM 387 C THR E 55 34.344 62.102 8.933 1.00 25.32 C ATOM 388 O THR E 55 35.015 63.132 8.884 1.00 25.97 O ATOM 389 CB THR E 55 32.555 62.840 7.383 1.00 27.21 C ATOM 390 OG1 THR E 55 31.601 62.941 8.448 1.00 29.46 O ATOM 391 CG2 THR E 55 31.726 62.501 6.133 1.00 29.19 C ATOM 392 N ASN E 56 34.258 61.326 10.019 1.00 24.25 N ATOM 393 CA ASN E 56 34.963 61.678 11.248 1.00 23.19 C ATOM 394 C ASN E 56 36.250 60.830 11.399 1.00 21.89 C ATOM 395 O ASN E 56 36.148 59.625 11.650 1.00 21.90 O ATOM 396 CB ASN E 56 34.048 61.491 12.472 1.00 24.25 C ATOM 397 CG ASN E 56 34.687 62.039 13.759 1.00 24.35 C ATOM 398 OD1 ASN E 56 35.871 62.393 13.776 1.00 23.26 O ATOM 399 ND2 ASN E 56 33.914 62.123 14.822 1.00 27.88 N ATOM 400 N PRO E 57 37.441 61.414 11.244 1.00 20.53 N ATOM 401 CA PRO E 57 38.679 60.602 11.381 1.00 20.19 C ATOM 402 C PRO E 57 38.975 60.186 12.833 1.00 20.08 C ATOM 403 O PRO E 57 39.872 59.343 13.045 1.00 19.05 O ATOM 404 CB PRO E 57 39.787 61.538 10.878 1.00 19.66 C ATOM 405 CG PRO E 57 39.256 62.940 11.200 1.00 20.31 C ATOM 406 CD PRO E 57 37.750 62.840 10.989 1.00 19.71 C ATOM 407 N PHE E 58 38.249 60.774 13.794 1.00 19.44 N ATOM 408 CA PHE E 58 38.467 60.510 15.226 1.00 20.11 C ATOM 409 C PHE E 58 37.529 59.457 15.779 1.00 19.54 C ATOM 410 O PHE E 58 37.475 59.217 16.979 1.00 20.81 O ATOM 411 CB PHE E 58 38.398 61.825 15.986 1.00 19.34 C ATOM 412 CG PHE E 58 39.238 62.916 15.357 1.00 22.11 C ATOM 413 CD1 PHE E 58 40.615 62.725 15.129 1.00 19.62 C ATOM 414 CD2 PHE E 58 38.653 64.122 14.936 1.00 23.04 C ATOM 415 CE1 PHE E 58 41.401 63.726 14.545 1.00 21.37 C ATOM 416 CE2 PHE E 58 39.422 65.128 14.326 1.00 24.40 C ATOM 417 CZ PHE E 58 40.814 64.937 14.143 1.00 23.90 C ATOM 418 N GLN E 59 36.792 58.831 14.874 1.00 19.95 N ATOM 419 CA GLN E 59 35.957 57.694 15.171 1.00 21.28 C ATOM 420 C GLN E 59 36.536 56.522 14.405 1.00 21.23 C ATOM 421 O GLN E 59 36.600 56.537 13.160 1.00 22.06 O ATOM 422 CB GLN E 59 34.489 57.956 14.768 1.00 23.20 C ATOM 423 CG GLN E 59 33.611 56.736 15.067 1.00 27.39 C ATOM 424 CD GLN E 59 32.132 57.056 15.018 1.00 38.03 C ATOM 425 OE1 GLN E 59 31.663 57.983 15.700 1.00 43.22 O ATOM 426 NE2 GLN E 59 31.384 56.295 14.215 1.00 41.40 N ATOM 427 N ASP E 60 36.968 55.503 15.145 1.00 18.73 N ATOM 428 CA ASP E 60 37.537 54.343 14.508 1.00 18.55 C ATOM 429 C ASP E 60 36.559 53.178 14.647 1.00 18.84 C ATOM 430 O ASP E 60 36.495 52.544 15.692 1.00 19.47 O ATOM 431 CB ASP E 60 38.922 54.018 15.142 1.00 17.12 C ATOM 432 CG ASP E 60 39.509 52.701 14.649 1.00 17.84 C ATOM 433 OD1 ASP E 60 39.014 52.102 13.650 1.00 17.73 O ATOM 434 OD2 ASP E 60 40.520 52.188 15.204 1.00 16.48 O ATOM 435 N ASN E 61 35.801 52.908 13.574 1.00 20.44 N ATOM 436 CA ASN E 61 34.797 51.839 13.561 1.00 22.01 C ATOM 437 C ASN E 61 35.336 50.440 13.262 1.00 21.58 C ATOM 438 O ASN E 61 34.572 49.460 13.213 1.00 22.68 O ATOM 439 CB ASN E 61 33.692 52.213 12.542 1.00 23.15 C ATOM 440 CG ASN E 61 33.008 53.501 12.896 1.00 25.52 C ATOM 441 OD1 ASN E 61 32.500 53.651 14.017 1.00 30.56 O ATOM 442 ND2 ASN E 61 32.992 54.452 11.957 1.00 30.01 N ATOM 443 N ASN E 62 36.646 50.320 13.069 1.00 18.87 N ATOM 444 CA ASN E 62 37.239 49.014 12.800 1.00 18.18 C ATOM 445 C ASN E 62 38.042 48.495 14.008 1.00 17.94 C ATOM 446 O ASN E 62 37.866 47.340 14.445 1.00 17.58 O ATOM 447 CB ASN E 62 38.139 49.141 11.560 1.00 17.21 C ATOM 448 CG ASN E 62 38.903 47.883 11.252 1.00 19.25 C ATOM 449 OD1 ASN E 62 39.866 47.557 11.929 1.00 18.36 O ATOM 450 ND2 ASN E 62 38.467 47.139 10.219 1.00 22.76 N ATOM 451 N SER E 63 38.881 49.399 14.542 1.00 16.58 N ATOM 452 CA SER E 63 39.820 49.192 15.705 1.00 16.30 C ATOM 453 C SER E 63 41.294 49.161 15.304 1.00 15.34 C ATOM 454 O SER E 63 42.190 49.422 16.132 1.00 15.94 O ATOM 455 CB SER E 63 39.525 47.919 16.529 1.00 15.78 C ATOM 456 OG SER E 63 40.021 46.765 15.882 1.00 20.00 O ATOM 457 N HIS E 64 41.537 48.854 14.047 1.00 14.74 N ATOM 458 CA HIS E 64 42.897 48.662 13.552 1.00 14.49 C ATOM 459 C HIS E 64 43.724 49.964 13.659 1.00 14.51 C ATOM 460 O HIS E 64 44.871 49.897 14.174 1.00 14.04 O ATOM 461 CB HIS E 64 42.828 48.148 12.109 1.00 14.60 C ATOM 462 CG HIS E 64 44.159 47.889 11.471 1.00 14.38 C ATOM 463 ND1 HIS E 64 44.830 48.849 10.739 1.00 15.25 N ATOM 464 CD2 HIS E 64 44.913 46.762 11.403 1.00 14.53 C ATOM 465 CE1 HIS E 64 45.941 48.316 10.243 1.00 14.05 C ATOM 466 NE2 HIS E 64 46.015 47.055 10.629 1.00 15.81 N ATOM 467 N GLY E 65 43.202 51.105 13.209 1.00 14.21 N ATOM 468 CA GLY E 65 44.003 52.339 13.242 1.00 14.85 C ATOM 469 C GLY E 65 44.370 52.764 14.665 1.00 14.51 C ATOM 470 O GLY E 65 45.426 53.371 14.916 1.00 14.99 O ATOM 471 N THR E 66 43.453 52.515 15.594 1.00 14.31 N ATOM 472 CA THR E 66 43.689 52.805 17.013 1.00 14.01 C ATOM 473 C THR E 66 44.825 51.944 17.600 1.00 14.16 C ATOM 474 O THR E 66 45.664 52.447 18.381 1.00 13.47 O ATOM 475 CB THR E 66 42.358 52.605 17.795 1.00 14.21 C ATOM 476 OG1 THR E 66 41.417 53.605 17.347 1.00 16.54 O ATOM 477 CG2 THR E 66 42.571 52.904 19.315 1.00 14.30 C ATOM 478 N HIS E 67 44.864 50.664 17.226 1.00 13.33 N ATOM 479 CA HIS E 67 45.915 49.756 17.716 1.00 13.16 C ATOM 480 C HIS E 67 47.289 50.215 17.136 1.00 13.40 C ATOM 481 O HIS E 67 48.292 50.346 17.872 1.00 12.89 O ATOM 482 CB HIS E 67 45.561 48.313 17.309 1.00 12.96 C ATOM 483 CG HIS E 67 46.405 47.281 17.984 1.00 11.98 C ATOM 484 ND1 HIS E 67 47.686 46.988 17.568 1.00 13.26 N ATOM 485 CD2 HIS E 67 46.173 46.517 19.085 1.00 12.02 C ATOM 486 CE1 HIS E 67 48.202 46.073 18.372 1.00 11.38 C ATOM 487 NE2 HIS E 67 47.299 45.756 19.288 1.00 14.18 N ATOM 488 N VAL E 68 47.316 50.453 15.824 1.00 13.13 N ATOM 489 CA VAL E 68 48.535 50.929 15.158 1.00 12.10 C ATOM 490 C VAL E 68 48.994 52.244 15.810 1.00 12.79 C ATOM 491 O VAL E 68 50.211 52.403 16.087 1.00 12.44 O ATOM 492 CB VAL E 68 48.281 51.108 13.627 1.00 13.80 C ATOM 493 CG1 VAL E 68 49.461 51.847 12.906 1.00 13.34 C ATOM 494 CG2 VAL E 68 48.042 49.707 12.977 1.00 12.63 C ATOM 495 N ALA E 69 48.060 53.172 16.038 1.00 12.87 N ATOM 496 CA ALA E 69 48.441 54.454 16.661 1.00 13.12 C ATOM 497 C ALA E 69 49.100 54.270 18.037 1.00 13.62 C ATOM 498 O ALA E 69 50.038 54.990 18.376 1.00 13.17 O ATOM 499 CB ALA E 69 47.214 55.404 16.762 1.00 14.08 C ATOM 500 N GLY E 70 48.558 53.359 18.852 1.00 12.35 N ATOM 501 CA GLY E 70 49.111 53.101 20.175 1.00 12.23 C ATOM 502 C GLY E 70 50.520 52.567 20.141 1.00 12.94 C ATOM 503 O GLY E 70 51.352 52.850 21.030 1.00 12.98 O ATOM 504 N THR E 71 50.840 51.778 19.122 1.00 11.92 N ATOM 505 CA THR E 71 52.239 51.321 19.020 1.00 11.85 C ATOM 506 C THR E 71 53.170 52.499 18.651 1.00 12.36 C ATOM 507 O THR E 71 54.272 52.649 19.217 1.00 11.68 O ATOM 508 CB THR E 71 52.336 50.235 17.969 1.00 11.41 C ATOM 509 OG1 THR E 71 51.588 49.086 18.419 1.00 13.33 O ATOM 510 CG2 THR E 71 53.791 49.759 17.821 1.00 11.09 C ATOM 511 N VAL E 72 52.708 53.381 17.763 1.00 11.72 N ATOM 512 CA VAL E 72 53.506 54.587 17.459 1.00 12.09 C ATOM 513 C VAL E 72 53.691 55.460 18.699 1.00 12.30 C ATOM 514 O VAL E 72 54.807 55.940 18.968 1.00 13.13 O ATOM 515 CB VAL E 72 52.853 55.453 16.376 1.00 11.52 C ATOM 516 CG1 VAL E 72 53.760 56.685 16.045 1.00 13.55 C ATOM 517 CG2 VAL E 72 52.622 54.636 15.101 1.00 12.30 C ATOM 518 N ALA E 73 52.596 55.753 19.399 1.00 11.93 N ATOM 519 CA ALA E 73 52.606 56.937 20.275 1.00 12.85 C ATOM 520 C ALA E 73 51.697 56.861 21.507 1.00 13.16 C ATOM 521 O ALA E 73 51.339 57.911 22.079 1.00 12.95 O ATOM 522 CB ALA E 73 52.245 58.190 19.445 1.00 14.25 C ATOM 523 N ALA E 74 51.363 55.659 22.004 1.00 12.69 N ATOM 524 CA ALA E 74 50.613 55.625 23.285 1.00 12.70 C ATOM 525 C ALA E 74 51.367 56.437 24.357 1.00 13.08 C ATOM 526 O ALA E 74 52.612 56.399 24.469 1.00 12.61 O ATOM 527 CB ALA E 74 50.384 54.181 23.789 1.00 11.86 C ATOM 528 N LEU E 75 50.609 57.168 25.149 1.00 12.47 N ATOM 529 CA LEU E 75 51.224 58.200 26.025 1.00 13.23 C ATOM 530 C LEU E 75 52.050 57.603 27.199 1.00 12.83 C ATOM 531 O LEU E 75 51.772 56.514 27.691 1.00 13.27 O ATOM 532 CB LEU E 75 50.106 59.058 26.632 1.00 12.69 C ATOM 533 CG LEU E 75 49.264 59.853 25.615 1.00 13.77 C ATOM 534 CD1 LEU E 75 48.078 60.450 26.384 1.00 13.84 C ATOM 535 CD2 LEU E 75 50.153 60.957 25.013 1.00 14.79 C ATOM 536 N ASN E 76 53.071 58.362 27.612 1.00 13.05 N ATOM 537 CA ASN E 76 53.864 58.027 28.777 1.00 13.04 C ATOM 538 C ASN E 76 53.227 58.597 30.043 1.00 14.24 C ATOM 539 O ASN E 76 53.230 59.827 30.276 1.00 14.54 O ATOM 540 CB ASN E 76 55.275 58.594 28.580 1.00 12.76 C ATOM 541 CG ASN E 76 56.215 58.201 29.711 1.00 15.04 C ATOM 542 OD1 ASN E 76 56.023 57.169 30.345 1.00 13.97 O ATOM 543 ND2 ASN E 76 57.249 59.032 29.969 1.00 15.13 N ATOM 544 N ASN E 77 52.647 57.707 30.837 1.00 13.80 N ATOM 545 CA ASN E 77 51.837 58.100 32.004 1.00 13.12 C ATOM 546 C ASN E 77 51.746 56.867 32.899 1.00 14.09 C ATOM 547 O ASN E 77 52.622 55.979 32.828 1.00 13.47 O ATOM 548 CB ASN E 77 50.457 58.650 31.560 1.00 13.59 C ATOM 549 CG ASN E 77 49.723 57.676 30.638 1.00 13.37 C ATOM 550 OD1 ASN E 77 50.037 56.485 30.633 1.00 13.44 O ATOM 551 ND2 ASN E 77 48.768 58.184 29.831 1.00 13.96 N ATOM 552 N SER E 78 50.739 56.818 33.777 1.00 13.92 N ATOM 553 CA SER E 78 50.621 55.685 34.688 1.00 14.60 C ATOM 554 C SER E 78 49.540 54.674 34.247 1.00 14.91 C ATOM 555 O SER E 78 49.063 53.855 35.049 1.00 15.05 O ATOM 556 CB SER E 78 50.419 56.182 36.140 1.00 16.37 C ATOM 557 OG SER E 78 49.189 56.888 36.266 1.00 17.49 O ATOM 558 N ILE E 79 49.174 54.697 32.973 1.00 15.28 N ATOM 559 CA ILE E 79 48.137 53.778 32.499 1.00 16.08 C ATOM 560 C ILE E 79 48.512 53.051 31.226 1.00 16.53 C ATOM 561 O ILE E 79 49.362 53.503 30.439 1.00 14.40 O ATOM 562 CB ILE E 79 46.774 54.505 32.272 1.00 17.25 C ATOM 563 CG1 ILE E 79 46.909 55.528 31.170 1.00 16.27 C ATOM 564 CG2 ILE E 79 46.284 55.176 33.576 1.00 17.21 C ATOM 565 CD1 ILE E 79 45.509 55.975 30.528 1.00 19.24 C ATOM 566 N GLY E 80 47.820 51.932 31.014 1.00 15.07 N ATOM 567 CA GLY E 80 47.863 51.292 29.714 1.00 13.84 C ATOM 568 C GLY E 80 49.238 50.855 29.250 1.00 14.22 C ATOM 569 O GLY E 80 49.992 50.226 29.994 1.00 14.92 O ATOM 570 N VAL E 81 49.526 51.170 27.992 1.00 14.47 N ATOM 571 CA VAL E 81 50.793 50.781 27.379 1.00 14.28 C ATOM 572 C VAL E 81 51.631 52.046 27.180 1.00 14.55 C ATOM 573 O VAL E 81 51.133 53.167 27.364 1.00 16.62 O ATOM 574 CB VAL E 81 50.567 50.016 26.038 1.00 14.15 C ATOM 575 CG1 VAL E 81 49.964 48.611 26.302 1.00 14.86 C ATOM 576 CG2 VAL E 81 49.672 50.845 25.029 1.00 13.45 C ATOM 577 N LEU E 82 52.873 51.875 26.766 1.00 15.27 N ATOM 578 CA LEU E 82 53.784 52.971 26.393 1.00 14.09 C ATOM 579 C LEU E 82 54.070 52.811 24.915 1.00 14.14 C ATOM 580 O LEU E 82 54.398 51.686 24.462 1.00 15.15 O ATOM 581 CB LEU E 82 55.096 52.798 27.161 1.00 12.68 C ATOM 582 CG LEU E 82 56.223 53.836 26.895 1.00 12.80 C ATOM 583 CD1 LEU E 82 55.718 55.293 27.247 1.00 11.46 C ATOM 584 CD2 LEU E 82 57.530 53.416 27.679 1.00 14.58 C ATOM 585 N GLY E 83 53.954 53.899 24.161 1.00 13.67 N ATOM 586 CA GLY E 83 54.276 53.891 22.738 1.00 13.11 C ATOM 587 C GLY E 83 55.780 54.005 22.468 1.00 12.44 C ATOM 588 O GLY E 83 56.559 54.358 23.354 1.00 12.54 O ATOM 589 N VAL E 84 56.173 53.699 21.243 1.00 11.77 N ATOM 590 CA VAL E 84 57.572 53.903 20.837 1.00 11.80 C ATOM 591 C VAL E 84 57.999 55.373 20.945 1.00 11.70 C ATOM 592 O VAL E 84 59.093 55.661 21.432 1.00 12.23 O ATOM 593 CB VAL E 84 57.812 53.392 19.408 1.00 11.82 C ATOM 594 CG1 VAL E 84 59.266 53.633 18.949 1.00 10.38 C ATOM 595 CG2 VAL E 84 57.623 51.802 19.376 1.00 12.18 C ATOM 596 N ALA E 85 57.129 56.281 20.484 1.00 11.75 N ATOM 597 CA ALA E 85 57.435 57.727 20.453 1.00 11.85 C ATOM 598 C ALA E 85 56.260 58.449 21.150 1.00 11.38 C ATOM 599 O ALA E 85 55.398 59.031 20.472 1.00 11.38 O ATOM 600 CB ALA E 85 57.574 58.201 18.937 1.00 12.36 C ATOM 601 N PRO E 86 56.214 58.346 22.478 1.00 11.92 N ATOM 602 CA PRO E 86 55.022 58.754 23.242 1.00 12.82 C ATOM 603 C PRO E 86 54.746 60.254 23.215 1.00 13.66 C ATOM 604 O PRO E 86 53.638 60.641 23.584 1.00 14.28 O ATOM 605 CB PRO E 86 55.337 58.287 24.678 1.00 14.20 C ATOM 606 CG PRO E 86 56.866 58.201 24.733 1.00 13.61 C ATOM 607 CD PRO E 86 57.226 57.710 23.361 1.00 11.43 C ATOM 608 N SER E 87 55.697 61.074 22.778 1.00 13.59 N ATOM 609 CA SER E 87 55.420 62.523 22.627 1.00 13.49 C ATOM 610 C SER E 87 55.130 62.961 21.180 1.00 14.09 C ATOM 611 O SER E 87 54.981 64.170 20.888 1.00 14.48 O ATOM 612 CB SER E 87 56.598 63.380 23.170 1.00 13.50 C ATOM 613 OG SER E 87 56.831 63.090 24.533 1.00 14.47 O ATOM 614 N ALA E 88 55.026 62.013 20.259 1.00 13.53 N ATOM 615 CA ALA E 88 54.841 62.401 18.859 1.00 13.97 C ATOM 616 C ALA E 88 53.509 63.097 18.681 1.00 14.81 C ATOM 617 O ALA E 88 52.576 62.844 19.441 1.00 15.95 O ATOM 618 CB ALA E 88 54.884 61.175 17.947 1.00 15.20 C ATOM 619 N SER E 89 53.434 63.971 17.674 1.00 14.45 N ATOM 620 CA SER E 89 52.168 64.645 17.311 1.00 14.82 C ATOM 621 C SER E 89 51.470 63.692 16.354 1.00 14.33 C ATOM 622 O SER E 89 51.946 63.445 15.241 1.00 14.46 O ATOM 623 CB SER E 89 52.470 65.995 16.613 1.00 15.73 C ATOM 624 OG SER E 89 52.978 66.901 17.600 1.00 17.39 O ATOM 625 N LEU E 90 50.370 63.107 16.814 1.00 14.75 N ATOM 626 CA LEU E 90 49.738 61.997 16.103 1.00 15.35 C ATOM 627 C LEU E 90 48.556 62.490 15.255 1.00 15.84 C ATOM 628 O LEU E 90 47.681 63.151 15.801 1.00 16.22 O ATOM 629 CB LEU E 90 49.246 61.017 17.193 1.00 16.04 C ATOM 630 CG LEU E 90 48.566 59.710 16.889 1.00 20.55 C ATOM 631 CD1 LEU E 90 49.560 58.781 16.092 1.00 21.25 C ATOM 632 CD2 LEU E 90 48.161 59.015 18.210 1.00 19.74 C ATOM 633 N TYR E 91 48.512 62.149 13.963 1.00 15.55 N ATOM 634 CA TYR E 91 47.428 62.586 13.074 1.00 15.59 C ATOM 635 C TYR E 91 46.635 61.392 12.559 1.00 15.37 C ATOM 636 O TYR E 91 47.213 60.413 12.070 1.00 15.35 O ATOM 637 CB TYR E 91 48.007 63.389 11.907 1.00 15.68 C ATOM 638 CG TYR E 91 48.556 64.708 12.419 1.00 14.78 C ATOM 639 CD1 TYR E 91 49.814 64.761 13.036 1.00 14.71 C ATOM 640 CD2 TYR E 91 47.772 65.869 12.386 1.00 18.01 C ATOM 641 CE1 TYR E 91 50.323 65.946 13.553 1.00 18.12 C ATOM 642 CE2 TYR E 91 48.272 67.083 12.925 1.00 17.60 C ATOM 643 CZ TYR E 91 49.562 67.099 13.476 1.00 21.73 C ATOM 644 OH TYR E 91 50.121 68.249 14.013 1.00 23.48 O ATOM 645 N ALA E 92 45.312 61.452 12.722 1.00 15.18 N ATOM 646 CA ALA E 92 44.440 60.388 12.215 1.00 15.73 C ATOM 647 C ALA E 92 44.034 60.718 10.763 1.00 16.94 C ATOM 648 O ALA E 92 43.227 61.633 10.532 1.00 17.53 O ATOM 649 CB ALA E 92 43.171 60.269 13.091 1.00 15.32 C ATOM 650 N VAL E 93 44.576 59.965 9.811 1.00 16.24 N ATOM 651 CA VAL E 93 44.249 60.179 8.387 1.00 17.45 C ATOM 652 C VAL E 93 43.459 58.973 7.939 1.00 16.94 C ATOM 653 O VAL E 93 44.036 57.932 7.579 1.00 17.55 O ATOM 654 CB VAL E 93 45.529 60.394 7.539 1.00 17.78 C ATOM 655 CG1 VAL E 93 45.175 60.651 6.052 1.00 17.76 C ATOM 656 CG2 VAL E 93 46.333 61.595 8.098 1.00 16.75 C ATOM 657 N LYS E 94 42.128 59.115 7.994 1.00 17.87 N ATOM 658 CA LYS E 94 41.227 57.978 7.827 1.00 16.85 C ATOM 659 C LYS E 94 41.024 57.749 6.329 1.00 18.66 C ATOM 660 O LYS E 94 40.481 58.629 5.646 1.00 19.16 O ATOM 661 CB LYS E 94 39.869 58.242 8.535 1.00 17.68 C ATOM 662 CG LYS E 94 38.915 57.016 8.353 1.00 18.66 C ATOM 663 CD LYS E 94 37.474 57.307 8.792 1.00 25.02 C ATOM 664 CE LYS E 94 37.244 56.882 10.172 1.00 27.75 C ATOM 665 NZ LYS E 94 35.774 56.717 10.590 1.00 24.36 N ATOM 666 N VAL E 95 41.488 56.598 5.843 1.00 17.20 N ATOM 667 CA VAL E 95 41.321 56.205 4.437 1.00 17.61 C ATOM 668 C VAL E 95 40.689 54.835 4.256 1.00 17.76 C ATOM 669 O VAL E 95 40.538 54.379 3.098 1.00 18.12 O ATOM 670 CB VAL E 95 42.674 56.221 3.668 1.00 16.47 C ATOM 671 CG1 VAL E 95 43.322 57.642 3.769 1.00 15.86 C ATOM 672 CG2 VAL E 95 43.656 55.065 4.153 1.00 17.15 C ATOM 673 N LEU E 96 40.405 54.163 5.380 1.00 18.37 N ATOM 674 CA LEU E 96 39.767 52.829 5.392 1.00 19.52 C ATOM 675 C LEU E 96 38.477 52.930 6.186 1.00 19.53 C ATOM 676 O LEU E 96 38.419 53.623 7.230 1.00 19.12 O ATOM 677 CB LEU E 96 40.673 51.754 6.048 1.00 18.13 C ATOM 678 CG LEU E 96 42.110 51.662 5.518 1.00 18.50 C ATOM 679 CD1 LEU E 96 42.977 50.640 6.279 1.00 17.44 C ATOM 680 CD2 LEU E 96 42.085 51.270 3.985 1.00 18.06 C ATOM 681 N GLY E 97 37.415 52.258 5.697 1.00 21.32 N ATOM 682 CA GLY E 97 36.177 52.219 6.453 1.00 21.72 C ATOM 683 C GLY E 97 36.150 51.130 7.510 1.00 23.72 C ATOM 684 O GLY E 97 37.152 50.397 7.726 1.00 23.84 O ATOM 685 N ALA E 98 34.987 51.004 8.151 1.00 22.67 N ATOM 686 CA ALA E 98 34.737 49.987 9.180 1.00 22.54 C ATOM 687 C ALA E 98 35.167 48.575 8.768 1.00 22.29 C ATOM 688 O ALA E 98 35.682 47.801 9.600 1.00 21.21 O ATOM 689 CB ALA E 98 33.241 49.984 9.579 1.00 22.39 C ATOM 690 N ASP E 99 34.981 48.233 7.495 1.00 22.19 N ATOM 691 CA ASP E 99 35.337 46.887 7.049 1.00 22.76 C ATOM 692 C ASP E 99 36.819 46.675 6.747 1.00 22.08 C ATOM 693 O ASP E 99 37.210 45.621 6.269 1.00 21.82 O ATOM 694 CB ASP E 99 34.444 46.398 5.881 1.00 23.57 C ATOM 695 CG ASP E 99 34.709 47.104 4.578 1.00 26.53 C ATOM 696 OD1 ASP E 99 35.687 47.927 4.449 1.00 24.15 O ATOM 697 OD2 ASP E 99 33.932 46.898 3.607 1.00 26.28 O ATOM 698 N GLY E 100 37.651 47.686 7.018 1.00 22.04 N ATOM 699 CA GLY E 100 39.074 47.493 6.822 1.00 21.20 C ATOM 700 C GLY E 100 39.559 47.782 5.416 1.00 20.75 C ATOM 701 O GLY E 100 40.719 47.545 5.130 1.00 19.71 O ATOM 702 N SER E 101 38.688 48.272 4.520 1.00 20.58 N ATOM 703 CA SER E 101 39.103 48.437 3.117 1.00 20.10 C ATOM 704 C SER E 101 38.917 49.883 2.641 1.00 19.11 C ATOM 705 O SER E 101 38.112 50.646 3.196 1.00 19.58 O ATOM 706 CB SER E 101 38.324 47.495 2.185 1.00 20.62 C ATOM 707 OG SER E 101 37.023 48.063 2.016 1.00 23.61 O ATOM 708 N GLY E 102 39.697 50.238 1.629 1.00 19.59 N ATOM 709 CA GLY E 102 39.617 51.557 1.029 1.00 19.86 C ATOM 710 C GLY E 102 39.935 51.512 -0.446 1.00 19.96 C ATOM 711 O GLY E 102 40.708 50.669 -0.939 1.00 19.49 O ATOM 712 N GLN E 103 39.349 52.460 -1.171 1.00 21.01 N ATOM 713 CA GLN E 103 39.672 52.642 -2.594 1.00 22.76 C ATOM 714 C GLN E 103 41.060 53.258 -2.753 1.00 23.14 C ATOM 715 O GLN E 103 41.457 54.067 -1.902 1.00 23.89 O ATOM 716 CB AGLN E 103 38.590 53.504 -3.260 0.50 22.83 C ATOM 717 CB BGLN E 103 38.630 53.566 -3.240 0.50 22.93 C ATOM 718 CG AGLN E 103 37.223 52.782 -3.307 0.50 24.60 C ATOM 719 CG BGLN E 103 37.252 52.911 -3.400 0.50 26.06 C ATOM 720 CD AGLN E 103 36.128 53.590 -3.979 0.50 28.16 C ATOM 721 CD BGLN E 103 37.266 51.731 -4.356 0.50 30.18 C ATOM 722 OE1AGLN E 103 36.401 54.417 -4.847 0.50 28.94 O ATOM 723 OE1BGLN E 103 37.903 51.778 -5.412 0.50 33.84 O ATOM 724 NE2AGLN E 103 34.887 53.354 -3.575 0.50 30.61 N ATOM 725 NE2BGLN E 103 36.563 50.661 -3.986 0.50 34.52 N ATOM 726 N TYR E 104 41.783 52.913 -3.830 1.00 22.62 N ATOM 727 CA TYR E 104 43.116 53.502 -4.061 1.00 22.77 C ATOM 728 C TYR E 104 43.089 55.033 -3.984 1.00 23.11 C ATOM 729 O TYR E 104 43.986 55.644 -3.416 1.00 21.82 O ATOM 730 CB TYR E 104 43.746 53.054 -5.390 1.00 22.33 C ATOM 731 CG TYR E 104 44.493 51.726 -5.318 1.00 24.21 C ATOM 732 CD1 TYR E 104 43.850 50.571 -4.857 1.00 26.85 C ATOM 733 CD2 TYR E 104 45.845 51.613 -5.713 1.00 25.09 C ATOM 734 CE1 TYR E 104 44.510 49.358 -4.799 1.00 27.60 C ATOM 735 CE2 TYR E 104 46.519 50.371 -5.651 1.00 26.26 C ATOM 736 CZ TYR E 104 45.836 49.257 -5.188 1.00 28.63 C ATOM 737 OH TYR E 104 46.445 48.019 -5.097 1.00 33.74 O ATOM 738 N SER E 105 42.057 55.642 -4.550 1.00 22.70 N ATOM 739 CA SER E 105 41.946 57.086 -4.519 1.00 23.40 C ATOM 740 C SER E 105 41.855 57.671 -3.104 1.00 22.91 C ATOM 741 O SER E 105 42.351 58.772 -2.873 1.00 22.05 O ATOM 742 CB SER E 105 40.777 57.580 -5.386 1.00 24.03 C ATOM 743 OG SER E 105 39.541 57.327 -4.750 1.00 24.37 O ATOM 744 N TRP E 106 41.237 56.946 -2.167 1.00 22.21 N ATOM 745 CA TRP E 106 41.140 57.412 -0.775 1.00 22.01 C ATOM 746 C TRP E 106 42.543 57.426 -0.135 1.00 21.34 C ATOM 747 O TRP E 106 42.889 58.397 0.549 1.00 21.05 O ATOM 748 CB TRP E 106 40.223 56.509 0.056 1.00 22.23 C ATOM 749 CG TRP E 106 38.808 56.334 -0.498 1.00 24.00 C ATOM 750 CD1 TRP E 106 38.229 56.989 -1.591 1.00 25.58 C ATOM 751 CD2 TRP E 106 37.820 55.414 -0.018 1.00 23.96 C ATOM 752 NE1 TRP E 106 36.942 56.525 -1.771 1.00 24.76 N ATOM 753 CE2 TRP E 106 36.673 55.553 -0.836 1.00 24.72 C ATOM 754 CE3 TRP E 106 37.773 54.498 1.058 1.00 24.22 C ATOM 755 CZ2 TRP E 106 35.499 54.803 -0.625 1.00 25.03 C ATOM 756 CZ3 TRP E 106 36.611 53.737 1.258 1.00 25.86 C ATOM 757 CH2 TRP E 106 35.497 53.887 0.412 1.00 25.65 C ATOM 758 N ILE E 107 43.319 56.364 -0.357 1.00 19.93 N ATOM 759 CA ILE E 107 44.684 56.254 0.219 1.00 18.88 C ATOM 760 C ILE E 107 45.533 57.385 -0.374 1.00 19.87 C ATOM 761 O ILE E 107 46.262 58.108 0.350 1.00 19.06 O ATOM 762 CB ILE E 107 45.309 54.861 -0.080 1.00 19.94 C ATOM 763 CG1 ILE E 107 44.812 53.792 0.928 1.00 21.22 C ATOM 764 CG2 ILE E 107 46.848 54.892 0.024 1.00 20.02 C ATOM 765 CD1 ILE E 107 43.312 53.431 0.867 1.00 23.43 C ATOM 766 N ILE E 108 45.388 57.587 -1.689 1.00 18.05 N ATOM 767 CA ILE E 108 46.176 58.628 -2.341 1.00 19.00 C ATOM 768 C ILE E 108 45.794 60.006 -1.788 1.00 18.21 C ATOM 769 O ILE E 108 46.687 60.823 -1.495 1.00 19.35 O ATOM 770 CB ILE E 108 46.024 58.549 -3.901 1.00 18.70 C ATOM 771 CG1 ILE E 108 46.785 57.345 -4.442 1.00 18.67 C ATOM 772 CG2 ILE E 108 46.603 59.848 -4.593 1.00 19.26 C ATOM 773 CD1 ILE E 108 46.257 56.907 -5.884 1.00 21.27 C ATOM 774 N ASN E 109 44.505 60.269 -1.608 1.00 18.09 N ATOM 775 CA ASN E 109 44.076 61.540 -1.038 1.00 19.26 C ATOM 776 C ASN E 109 44.655 61.757 0.389 1.00 19.58 C ATOM 777 O ASN E 109 45.027 62.884 0.764 1.00 20.34 O ATOM 778 CB ASN E 109 42.552 61.638 -0.986 1.00 19.43 C ATOM 779 CG ASN E 109 41.940 61.919 -2.353 1.00 24.21 C ATOM 780 OD1 ASN E 109 42.636 62.341 -3.272 1.00 27.01 O ATOM 781 ND2 ASN E 109 40.626 61.698 -2.482 1.00 27.38 N ATOM 782 N GLY E 110 44.709 60.673 1.175 1.00 19.59 N ATOM 783 CA GLY E 110 45.327 60.728 2.507 1.00 17.78 C ATOM 784 C GLY E 110 46.830 61.068 2.448 1.00 17.72 C ATOM 785 O GLY E 110 47.325 61.888 3.269 1.00 17.22 O ATOM 786 N ILE E 111 47.560 60.411 1.542 1.00 17.66 N ATOM 787 CA ILE E 111 48.978 60.713 1.345 1.00 18.92 C ATOM 788 C ILE E 111 49.144 62.188 0.939 1.00 19.16 C ATOM 789 O ILE E 111 50.012 62.875 1.489 1.00 18.35 O ATOM 790 CB ILE E 111 49.632 59.777 0.306 1.00 19.07 C ATOM 791 CG1 ILE E 111 49.602 58.332 0.816 1.00 18.89 C ATOM 792 CG2 ILE E 111 51.078 60.200 -0.035 1.00 18.97 C ATOM 793 CD1 ILE E 111 49.853 57.296 -0.321 1.00 18.34 C ATOM 794 N GLU E 112 48.314 62.668 -0.003 1.00 19.30 N ATOM 795 CA GLU E 112 48.387 64.090 -0.379 1.00 19.47 C ATOM 796 C GLU E 112 48.097 65.041 0.776 1.00 19.56 C ATOM 797 O GLU E 112 48.771 66.067 0.916 1.00 20.68 O ATOM 798 CB GLU E 112 47.444 64.409 -1.569 1.00 21.18 C ATOM 799 CG GLU E 112 47.864 63.696 -2.849 1.00 22.13 C ATOM 800 CD GLU E 112 49.014 64.330 -3.613 1.00 29.31 C ATOM 801 OE1 GLU E 112 49.631 65.338 -3.158 1.00 28.29 O ATOM 802 OE2 GLU E 112 49.314 63.792 -4.706 1.00 34.64 O ATOM 803 N TRP E 113 47.109 64.718 1.604 1.00 18.16 N ATOM 804 CA TRP E 113 46.815 65.518 2.800 1.00 17.93 C ATOM 805 C TRP E 113 48.069 65.554 3.707 1.00 18.14 C ATOM 806 O TRP E 113 48.428 66.595 4.247 1.00 17.71 O ATOM 807 CB TRP E 113 45.614 64.956 3.576 1.00 17.24 C ATOM 808 CG TRP E 113 45.220 65.780 4.766 1.00 18.68 C ATOM 809 CD1 TRP E 113 44.263 66.776 4.801 1.00 21.57 C ATOM 810 CD2 TRP E 113 45.791 65.730 6.097 1.00 19.47 C ATOM 811 NE1 TRP E 113 44.204 67.316 6.063 1.00 21.15 N ATOM 812 CE2 TRP E 113 45.123 66.697 6.876 1.00 21.16 C ATOM 813 CE3 TRP E 113 46.795 64.946 6.709 1.00 19.13 C ATOM 814 CZ2 TRP E 113 45.423 66.924 8.237 1.00 21.64 C ATOM 815 CZ3 TRP E 113 47.117 65.188 8.067 1.00 19.90 C ATOM 816 CH2 TRP E 113 46.415 66.163 8.816 1.00 18.95 C ATOM 817 N ALA E 114 48.702 64.390 3.886 1.00 17.60 N ATOM 818 CA ALA E 114 49.881 64.330 4.760 1.00 17.90 C ATOM 819 C ALA E 114 50.981 65.243 4.246 1.00 18.35 C ATOM 820 O ALA E 114 51.643 65.932 5.030 1.00 18.30 O ATOM 821 CB ALA E 114 50.380 62.877 4.892 1.00 18.09 C ATOM 822 N ILE E 115 51.206 65.233 2.926 1.00 18.50 N ATOM 823 CA ILE E 115 52.241 66.095 2.326 1.00 19.40 C ATOM 824 C ILE E 115 51.854 67.565 2.562 1.00 20.78 C ATOM 825 O ILE E 115 52.686 68.378 3.020 1.00 20.47 O ATOM 826 CB ILE E 115 52.424 65.802 0.800 1.00 19.32 C ATOM 827 CG1 ILE E 115 52.898 64.372 0.568 1.00 20.21 C ATOM 828 CG2 ILE E 115 53.475 66.774 0.176 1.00 20.61 C ATOM 829 CD1 ILE E 115 52.778 63.875 -0.916 1.00 19.70 C ATOM 830 N ALA E 116 50.604 67.914 2.263 1.00 20.17 N ATOM 831 CA ALA E 116 50.153 69.337 2.367 1.00 21.28 C ATOM 832 C ALA E 116 50.186 69.857 3.803 1.00 21.63 C ATOM 833 O ALA E 116 50.287 71.083 4.033 1.00 22.64 O ATOM 834 CB ALA E 116 48.724 69.513 1.793 1.00 21.11 C ATOM 835 N ASN E 117 50.102 68.928 4.766 1.00 19.74 N ATOM 836 CA ASN E 117 50.093 69.279 6.175 1.00 19.75 C ATOM 837 C ASN E 117 51.439 69.085 6.908 1.00 18.62 C ATOM 838 O ASN E 117 51.503 69.162 8.151 1.00 19.88 O ATOM 839 CB ASN E 117 48.926 68.593 6.867 1.00 18.97 C ATOM 840 CG ASN E 117 47.595 69.279 6.535 1.00 22.13 C ATOM 841 OD1 ASN E 117 47.162 70.193 7.244 1.00 24.13 O ATOM 842 ND2 ASN E 117 46.968 68.863 5.444 1.00 19.59 N ATOM 843 N ASN E 118 52.494 68.892 6.121 1.00 19.09 N ATOM 844 CA ASN E 118 53.885 68.842 6.580 1.00 19.57 C ATOM 845 C ASN E 118 54.140 67.722 7.591 1.00 19.22 C ATOM 846 O ASN E 118 54.846 67.913 8.586 1.00 18.71 O ATOM 847 CB ASN E 118 54.346 70.204 7.153 1.00 20.91 C ATOM 848 CG ASN E 118 54.191 71.326 6.132 1.00 25.18 C ATOM 849 OD1 ASN E 118 54.700 71.242 5.027 1.00 28.26 O ATOM 850 ND2 ASN E 118 53.457 72.368 6.505 1.00 31.17 N ATOM 851 N MET E 119 53.550 66.554 7.337 1.00 17.43 N ATOM 852 CA MET E 119 53.866 65.390 8.185 1.00 15.38 C ATOM 853 C MET E 119 55.324 65.003 7.971 1.00 15.79 C ATOM 854 O MET E 119 55.820 65.070 6.859 1.00 16.99 O ATOM 855 CB MET E 119 52.992 64.199 7.767 1.00 15.47 C ATOM 856 CG MET E 119 51.492 64.403 8.034 1.00 15.60 C ATOM 857 SD MET E 119 51.044 64.553 9.783 1.00 16.80 S ATOM 858 CE MET E 119 50.522 66.350 9.844 1.00 17.00 C ATOM 859 N ASP E 120 55.987 64.599 9.055 1.00 14.39 N ATOM 860 CA ASP E 120 57.387 64.135 9.028 1.00 14.49 C ATOM 861 C ASP E 120 57.481 62.645 8.724 1.00 13.34 C ATOM 862 O ASP E 120 58.450 62.181 8.100 1.00 13.27 O ATOM 863 CB ASP E 120 58.025 64.386 10.398 1.00 14.83 C ATOM 864 CG ASP E 120 58.091 65.879 10.721 1.00 18.89 C ATOM 865 OD1 ASP E 120 58.732 66.621 9.915 1.00 17.49 O ATOM 866 OD2 ASP E 120 57.477 66.351 11.711 1.00 16.17 O ATOM 867 N VAL E 121 56.444 61.900 9.124 1.00 13.00 N ATOM 868 CA VAL E 121 56.446 60.421 8.975 1.00 11.98 C ATOM 869 C VAL E 121 55.020 59.997 8.586 1.00 14.11 C ATOM 870 O VAL E 121 54.060 60.549 9.106 1.00 13.94 O ATOM 871 CB VAL E 121 56.818 59.706 10.317 1.00 13.22 C ATOM 872 CG1 VAL E 121 56.874 58.187 10.143 1.00 12.38 C ATOM 873 CG2 VAL E 121 58.185 60.184 10.887 1.00 11.41 C ATOM 874 N ILE E 122 54.916 59.058 7.643 1.00 13.74 N ATOM 875 CA ILE E 122 53.649 58.379 7.326 1.00 13.94 C ATOM 876 C ILE E 122 53.785 56.901 7.677 1.00 13.66 C ATOM 877 O ILE E 122 54.770 56.260 7.315 1.00 14.57 O ATOM 878 CB ILE E 122 53.321 58.528 5.822 1.00 14.16 C ATOM 879 CG1 ILE E 122 52.836 59.952 5.515 1.00 14.01 C ATOM 880 CG2 ILE E 122 52.279 57.447 5.369 1.00 16.12 C ATOM 881 CD1 ILE E 122 52.774 60.234 3.971 1.00 13.52 C ATOM 882 N ASN E 123 52.788 56.352 8.380 1.00 13.69 N ATOM 883 CA ASN E 123 52.745 54.907 8.561 1.00 13.76 C ATOM 884 C ASN E 123 51.541 54.403 7.797 1.00 14.65 C ATOM 885 O ASN E 123 50.446 54.935 8.003 1.00 14.06 O ATOM 886 CB ASN E 123 52.515 54.569 10.028 1.00 13.58 C ATOM 887 CG ASN E 123 52.506 53.065 10.251 1.00 14.65 C ATOM 888 OD1 ASN E 123 53.563 52.449 10.383 1.00 14.90 O ATOM 889 ND2 ASN E 123 51.307 52.461 10.257 1.00 13.48 N ATOM 890 N MET E 124 51.742 53.403 6.922 1.00 15.09 N ATOM 891 CA MET E 124 50.632 52.729 6.235 1.00 14.68 C ATOM 892 C MET E 124 50.600 51.219 6.539 1.00 14.96 C ATOM 893 O MET E 124 51.282 50.440 5.877 1.00 15.80 O ATOM 894 CB MET E 124 50.756 52.946 4.729 1.00 15.40 C ATOM 895 CG MET E 124 50.254 54.364 4.354 1.00 15.09 C ATOM 896 SD MET E 124 50.372 54.717 2.560 1.00 19.29 S ATOM 897 CE MET E 124 52.036 54.771 2.349 1.00 17.01 C ATOM 898 N SER E 125 49.800 50.837 7.533 1.00 15.14 N ATOM 899 CA SER E 125 49.712 49.439 7.930 1.00 15.06 C ATOM 900 C SER E 125 48.610 48.818 7.050 1.00 16.14 C ATOM 901 O SER E 125 47.559 48.405 7.529 1.00 16.03 O ATOM 902 CB SER E 125 49.376 49.348 9.414 1.00 14.64 C ATOM 903 OG SER E 125 50.593 49.549 10.167 1.00 13.89 O ATOM 904 N LEU E 126 48.861 48.840 5.742 1.00 16.52 N ATOM 905 CA LEU E 126 47.828 48.478 4.770 1.00 17.36 C ATOM 906 C LEU E 126 48.501 48.083 3.459 1.00 17.85 C ATOM 907 O LEU E 126 49.723 48.290 3.254 1.00 17.79 O ATOM 908 CB LEU E 126 46.856 49.662 4.602 1.00 16.77 C ATOM 909 CG LEU E 126 47.363 51.092 4.338 1.00 16.82 C ATOM 910 CD1 LEU E 126 48.014 51.196 2.938 1.00 20.64 C ATOM 911 CD2 LEU E 126 46.231 52.111 4.478 1.00 18.33 C ATOM 912 N GLY E 127 47.727 47.510 2.540 1.00 19.06 N ATOM 913 CA GLY E 127 48.325 47.165 1.260 1.00 19.79 C ATOM 914 C GLY E 127 47.360 46.404 0.360 1.00 21.58 C ATOM 915 O GLY E 127 46.227 46.115 0.754 1.00 20.11 O ATOM 916 N GLY E 128 47.819 46.150 -0.866 1.00 22.31 N ATOM 917 CA GLY E 128 47.124 45.259 -1.792 1.00 23.99 C ATOM 918 C GLY E 128 48.127 44.649 -2.747 1.00 25.26 C ATOM 919 O GLY E 128 49.260 45.136 -2.846 1.00 24.34 O ATOM 920 N PRO E 129 47.743 43.575 -3.453 1.00 25.67 N ATOM 921 CA PRO E 129 48.693 42.845 -4.311 1.00 26.64 C ATOM 922 C PRO E 129 49.103 43.549 -5.600 1.00 27.50 C ATOM 923 O PRO E 129 50.119 43.127 -6.195 1.00 28.50 O ATOM 924 CB PRO E 129 47.928 41.564 -4.674 1.00 27.10 C ATOM 925 CG PRO E 129 46.502 41.966 -4.592 1.00 26.44 C ATOM 926 CD PRO E 129 46.410 42.935 -3.417 1.00 26.61 C ATOM 927 N SER E 130 48.365 44.558 -6.044 1.00 27.86 N ATOM 928 CA SER E 130 48.749 45.244 -7.281 1.00 29.64 C ATOM 929 C SER E 130 49.080 46.701 -7.019 1.00 30.69 C ATOM 930 O SER E 130 48.519 47.323 -6.114 1.00 32.11 O ATOM 931 CB SER E 130 47.634 45.174 -8.346 1.00 29.75 C ATOM 932 OG ASER E 130 46.425 45.683 -7.845 0.50 29.67 O ATOM 933 OG BSER E 130 47.140 43.851 -8.470 0.50 27.95 O ATOM 934 N GLY E 131 49.964 47.260 -7.821 1.00 31.20 N ATOM 935 CA GLY E 131 50.209 48.679 -7.648 1.00 31.50 C ATOM 936 C GLY E 131 49.287 49.492 -8.536 1.00 31.58 C ATOM 937 O GLY E 131 48.386 48.945 -9.217 1.00 31.88 O ATOM 938 N SER E 132 49.481 50.804 -8.517 1.00 29.58 N ATOM 939 CA SER E 132 48.983 51.658 -9.595 1.00 28.08 C ATOM 940 C SER E 132 50.009 52.783 -9.792 1.00 28.00 C ATOM 941 O SER E 132 50.742 53.149 -8.853 1.00 25.68 O ATOM 942 CB SER E 132 47.578 52.204 -9.307 1.00 27.93 C ATOM 943 OG SER E 132 47.593 53.321 -8.416 1.00 26.31 O ATOM 944 N ALA E 133 50.085 53.304 -11.014 1.00 27.54 N ATOM 945 CA ALA E 133 50.878 54.497 -11.278 1.00 26.67 C ATOM 946 C ALA E 133 50.577 55.660 -10.318 1.00 25.56 C ATOM 947 O ALA E 133 51.519 56.288 -9.836 1.00 25.95 O ATOM 948 CB ALA E 133 50.700 54.947 -12.753 1.00 27.36 C ATOM 949 N ALA E 134 49.295 55.940 -10.060 1.00 24.40 N ATOM 950 CA ALA E 134 48.916 57.043 -9.197 1.00 23.78 C ATOM 951 C ALA E 134 49.366 56.758 -7.751 1.00 23.33 C ATOM 952 O ALA E 134 49.795 57.685 -7.052 1.00 23.92 O ATOM 953 CB ALA E 134 47.398 57.337 -9.256 1.00 23.10 C ATOM 954 N LEU E 135 49.305 55.492 -7.321 1.00 23.29 N ATOM 955 CA LEU E 135 49.798 55.163 -5.959 1.00 22.72 C ATOM 956 C LEU E 135 51.306 55.382 -5.847 1.00 23.37 C ATOM 957 O LEU E 135 51.791 56.011 -4.871 1.00 22.25 O ATOM 958 CB LEU E 135 49.428 53.733 -5.537 1.00 22.42 C ATOM 959 CG LEU E 135 49.851 53.336 -4.103 1.00 22.81 C ATOM 960 CD1 LEU E 135 49.155 54.232 -3.086 1.00 20.85 C ATOM 961 CD2 LEU E 135 49.561 51.842 -3.803 1.00 22.83 C ATOM 962 N LYS E 136 52.054 54.851 -6.820 1.00 22.39 N ATOM 963 CA LYS E 136 53.497 55.027 -6.838 1.00 22.34 C ATOM 964 C LYS E 136 53.847 56.530 -6.863 1.00 22.49 C ATOM 965 O LYS E 136 54.764 56.986 -6.160 1.00 21.17 O ATOM 966 CB LYS E 136 54.152 54.285 -8.033 1.00 22.60 C ATOM 967 CG LYS E 136 55.691 54.285 -7.940 1.00 23.04 C ATOM 968 CD LYS E 136 56.369 53.626 -9.111 1.00 24.94 C ATOM 969 CE LYS E 136 57.832 53.425 -8.814 1.00 28.32 C ATOM 970 NZ LYS E 136 58.624 54.715 -8.918 1.00 27.32 N ATOM 971 N ALA E 137 53.100 57.311 -7.646 1.00 22.65 N ATOM 972 CA ALA E 137 53.409 58.736 -7.732 1.00 22.83 C ATOM 973 C ALA E 137 53.187 59.452 -6.391 1.00 22.19 C ATOM 974 O ALA E 137 53.949 60.361 -6.042 1.00 22.46 O ATOM 975 CB ALA E 137 52.586 59.392 -8.853 1.00 23.39 C ATOM 976 N ALA E 138 52.158 59.035 -5.639 1.00 21.59 N ATOM 977 CA ALA E 138 51.834 59.691 -4.365 1.00 19.98 C ATOM 978 C ALA E 138 52.908 59.382 -3.336 1.00 19.33 C ATOM 979 O ALA E 138 53.385 60.311 -2.648 1.00 18.63 O ATOM 980 CB ALA E 138 50.454 59.289 -3.858 1.00 20.74 C ATOM 981 N VAL E 139 53.304 58.102 -3.225 1.00 18.61 N ATOM 982 CA VAL E 139 54.408 57.787 -2.275 1.00 18.75 C ATOM 983 C VAL E 139 55.746 58.400 -2.703 1.00 19.19 C ATOM 984 O VAL E 139 56.508 58.880 -1.861 1.00 19.27 O ATOM 985 CB VAL E 139 54.563 56.274 -1.908 1.00 17.95 C ATOM 986 CG1 VAL E 139 53.290 55.767 -1.148 1.00 19.29 C ATOM 987 CG2 VAL E 139 54.941 55.386 -3.099 1.00 18.77 C ATOM 988 N ASP E 140 56.014 58.434 -4.008 1.00 19.55 N ATOM 989 CA ASP E 140 57.261 59.026 -4.487 1.00 20.22 C ATOM 990 C ASP E 140 57.260 60.522 -4.211 1.00 19.52 C ATOM 991 O ASP E 140 58.312 61.085 -3.891 1.00 20.34 O ATOM 992 CB ASP E 140 57.453 58.806 -6.006 1.00 20.73 C ATOM 993 CG ASP E 140 57.812 57.372 -6.367 1.00 24.17 C ATOM 994 OD1 ASP E 140 58.005 56.526 -5.450 1.00 22.27 O ATOM 995 OD2 ASP E 140 57.933 56.992 -7.578 1.00 23.24 O ATOM 996 N LYS E 141 56.098 61.167 -4.318 1.00 19.23 N ATOM 997 CA LYS E 141 55.990 62.588 -4.057 1.00 19.53 C ATOM 998 C LYS E 141 56.234 62.891 -2.574 1.00 19.10 C ATOM 999 O LYS E 141 56.926 63.866 -2.217 1.00 18.43 O ATOM 1000 CB LYS E 141 54.597 63.104 -4.500 1.00 19.89 C ATOM 1001 CG LYS E 141 54.409 64.605 -4.361 1.00 22.42 C ATOM 1002 CD LYS E 141 52.981 65.011 -4.699 1.00 26.24 C ATOM 1003 CE LYS E 141 52.700 66.483 -4.380 1.00 28.42 C ATOM 1004 NZ LYS E 141 51.333 66.828 -4.910 1.00 28.71 N ATOM 1005 N ALA E 142 55.667 62.051 -1.702 1.00 17.75 N ATOM 1006 CA ALA E 142 55.869 62.256 -0.261 1.00 17.54 C ATOM 1007 C ALA E 142 57.345 62.161 0.084 1.00 16.40 C ATOM 1008 O ALA E 142 57.863 62.980 0.838 1.00 16.88 O ATOM 1009 CB ALA E 142 55.050 61.207 0.540 1.00 16.66 C ATOM 1010 N VAL E 143 58.026 61.156 -0.454 1.00 16.82 N ATOM 1011 CA VAL E 143 59.440 60.979 -0.171 1.00 16.76 C ATOM 1012 C VAL E 143 60.270 62.129 -0.765 1.00 17.63 C ATOM 1013 O VAL E 143 61.175 62.648 -0.089 1.00 16.07 O ATOM 1014 CB VAL E 143 59.913 59.582 -0.669 1.00 17.58 C ATOM 1015 CG1 VAL E 143 61.444 59.414 -0.630 1.00 18.17 C ATOM 1016 CG2 VAL E 143 59.194 58.485 0.166 1.00 15.37 C ATOM 1017 N ALA E 144 59.940 62.547 -2.000 1.00 18.03 N ATOM 1018 CA ALA E 144 60.650 63.685 -2.594 1.00 19.09 C ATOM 1019 C ALA E 144 60.481 64.939 -1.749 1.00 20.09 C ATOM 1020 O ALA E 144 61.376 65.811 -1.748 1.00 21.70 O ATOM 1021 CB ALA E 144 60.171 63.954 -4.056 1.00 19.07 C ATOM 1022 N SER E 145 59.346 65.038 -1.058 1.00 19.87 N ATOM 1023 CA SER E 145 59.017 66.186 -0.206 1.00 20.66 C ATOM 1024 C SER E 145 59.623 66.114 1.193 1.00 19.01 C ATOM 1025 O SER E 145 59.460 67.063 1.975 1.00 19.52 O ATOM 1026 CB SER E 145 57.510 66.387 -0.091 1.00 21.09 C ATOM 1027 OG SER E 145 56.925 66.577 -1.375 1.00 24.68 O ATOM 1028 N GLY E 146 60.328 65.019 1.512 1.00 18.03 N ATOM 1029 CA GLY E 146 61.025 64.920 2.784 1.00 15.46 C ATOM 1030 C GLY E 146 60.367 64.012 3.838 1.00 15.79 C ATOM 1031 O GLY E 146 60.857 63.946 4.961 1.00 14.49 O ATOM 1032 N VAL E 147 59.291 63.324 3.467 1.00 14.85 N ATOM 1033 CA VAL E 147 58.532 62.492 4.440 1.00 14.73 C ATOM 1034 C VAL E 147 59.167 61.090 4.526 1.00 14.80 C ATOM 1035 O VAL E 147 59.522 60.511 3.502 1.00 15.51 O ATOM 1036 CB VAL E 147 57.043 62.326 4.011 1.00 15.44 C ATOM 1037 CG1 VAL E 147 56.245 61.527 5.136 1.00 14.33 C ATOM 1038 CG2 VAL E 147 56.381 63.706 3.745 1.00 15.34 C ATOM 1039 N VAL E 148 59.320 60.549 5.738 1.00 13.27 N ATOM 1040 CA VAL E 148 59.678 59.143 5.904 1.00 13.71 C ATOM 1041 C VAL E 148 58.398 58.332 5.741 1.00 13.58 C ATOM 1042 O VAL E 148 57.472 58.526 6.532 1.00 15.16 O ATOM 1043 CB VAL E 148 60.228 58.872 7.355 1.00 13.80 C ATOM 1044 CG1 VAL E 148 60.524 57.389 7.546 1.00 15.06 C ATOM 1045 CG2 VAL E 148 61.545 59.696 7.596 1.00 13.52 C ATOM 1046 N VAL E 149 58.368 57.414 4.763 1.00 13.37 N ATOM 1047 CA VAL E 149 57.166 56.615 4.489 1.00 13.84 C ATOM 1048 C VAL E 149 57.448 55.148 4.820 1.00 12.74 C ATOM 1049 O VAL E 149 58.382 54.541 4.265 1.00 13.84 O ATOM 1050 CB VAL E 149 56.743 56.751 2.992 1.00 13.81 C ATOM 1051 CG1 VAL E 149 55.419 55.963 2.777 1.00 13.52 C ATOM 1052 CG2 VAL E 149 56.531 58.248 2.663 1.00 16.53 C ATOM 1053 N VAL E 150 56.630 54.605 5.740 1.00 13.65 N ATOM 1054 CA VAL E 150 56.827 53.249 6.267 1.00 13.32 C ATOM 1055 C VAL E 150 55.537 52.491 5.980 1.00 14.09 C ATOM 1056 O VAL E 150 54.452 53.026 6.190 1.00 14.23 O ATOM 1057 CB VAL E 150 57.063 53.256 7.819 1.00 14.10 C ATOM 1058 CG1 VAL E 150 57.422 51.799 8.329 1.00 14.06 C ATOM 1059 CG2 VAL E 150 58.210 54.299 8.183 1.00 12.71 C ATOM 1060 N ALA E 151 55.651 51.232 5.553 1.00 13.96 N ATOM 1061 CA ALA E 151 54.445 50.425 5.309 1.00 15.37 C ATOM 1062 C ALA E 151 54.608 48.961 5.737 1.00 14.61 C ATOM 1063 O ALA E 151 55.720 48.437 5.785 1.00 15.56 O ATOM 1064 CB ALA E 151 54.076 50.463 3.825 1.00 15.04 C ATOM 1065 N ALA E 152 53.504 48.306 6.061 1.00 14.34 N ATOM 1066 CA ALA E 152 53.548 46.848 6.298 1.00 15.64 C ATOM 1067 C ALA E 152 53.958 46.098 5.011 1.00 15.80 C ATOM 1068 O ALA E 152 53.530 46.481 3.918 1.00 16.35 O ATOM 1069 CB ALA E 152 52.163 46.361 6.785 1.00 15.68 C ATOM 1070 N ALA E 153 54.771 45.049 5.147 1.00 16.07 N ATOM 1071 CA ALA E 153 55.229 44.265 3.973 1.00 17.53 C ATOM 1072 C ALA E 153 54.090 43.428 3.386 1.00 18.85 C ATOM 1073 O ALA E 153 54.099 43.115 2.181 1.00 19.26 O ATOM 1074 CB ALA E 153 56.438 43.328 4.352 1.00 18.22 C ATOM 1075 N GLY E 154 53.123 43.095 4.240 1.00 18.21 N ATOM 1076 CA GLY E 154 52.005 42.202 3.903 1.00 18.31 C ATOM 1077 C GLY E 154 52.115 40.872 4.654 1.00 18.54 C ATOM 1078 O GLY E 154 53.170 40.536 5.212 1.00 17.15 O ATOM 1079 N ASN E 155 51.005 40.112 4.664 1.00 18.10 N ATOM 1080 CA ASN E 155 50.933 38.862 5.420 1.00 18.74 C ATOM 1081 C ASN E 155 50.687 37.664 4.494 1.00 20.45 C ATOM 1082 O ASN E 155 49.892 36.767 4.840 1.00 20.33 O ATOM 1083 CB ASN E 155 49.786 38.897 6.443 1.00 18.21 C ATOM 1084 CG ASN E 155 49.897 40.068 7.414 1.00 18.54 C ATOM 1085 OD1 ASN E 155 51.017 40.490 7.780 1.00 15.85 O ATOM 1086 ND2 ASN E 155 48.761 40.535 7.885 1.00 16.20 N ATOM 1087 N GLU E 156 51.396 37.657 3.367 1.00 21.65 N ATOM 1088 CA GLU E 156 51.160 36.645 2.302 1.00 23.62 C ATOM 1089 C GLU E 156 52.047 35.405 2.419 1.00 25.50 C ATOM 1090 O GLU E 156 51.955 34.469 1.580 1.00 27.15 O ATOM 1091 CB GLU E 156 51.317 37.308 0.931 1.00 23.13 C ATOM 1092 CG GLU E 156 50.347 38.447 0.685 1.00 25.50 C ATOM 1093 CD GLU E 156 48.902 38.017 0.893 1.00 33.78 C ATOM 1094 OE1 GLU E 156 48.554 36.940 0.375 1.00 34.18 O ATOM 1095 OE2 GLU E 156 48.135 38.717 1.603 1.00 35.81 O ATOM 1096 N GLY E 157 52.912 35.377 3.431 1.00 24.99 N ATOM 1097 CA GLY E 157 53.761 34.226 3.690 1.00 26.14 C ATOM 1098 C GLY E 157 54.713 33.972 2.530 1.00 27.51 C ATOM 1099 O GLY E 157 55.109 34.916 1.855 1.00 26.95 O ATOM 1100 N THR E 158 55.060 32.707 2.290 1.00 28.61 N ATOM 1101 CA THR E 158 55.973 32.354 1.185 1.00 30.62 C ATOM 1102 C THR E 158 55.237 31.809 -0.036 1.00 32.10 C ATOM 1103 O THR E 158 54.071 31.395 0.044 1.00 32.33 O ATOM 1104 CB THR E 158 57.021 31.306 1.614 1.00 30.92 C ATOM 1105 OG1 THR E 158 56.343 30.118 2.045 1.00 32.88 O ATOM 1106 CG2 THR E 158 57.833 31.762 2.825 1.00 30.30 C ATOM 1107 N SER E 159 55.920 31.831 -1.174 1.00 32.65 N ATOM 1108 CA SER E 159 55.366 31.259 -2.395 1.00 34.19 C ATOM 1109 C SER E 159 56.549 30.910 -3.283 1.00 34.30 C ATOM 1110 O SER E 159 56.783 31.564 -4.302 1.00 35.15 O ATOM 1111 CB SER E 159 54.432 32.258 -3.060 1.00 33.71 C ATOM 1112 OG SER E 159 54.061 31.803 -4.346 1.00 38.22 O ATOM 1113 N GLY E 160 57.321 29.915 -2.844 1.00 35.04 N ATOM 1114 CA GLY E 160 58.515 29.473 -3.547 1.00 35.50 C ATOM 1115 C GLY E 160 59.539 30.584 -3.609 1.00 35.89 C ATOM 1116 O GLY E 160 59.930 31.129 -2.574 1.00 35.87 O ATOM 1117 N SER E 161 59.958 30.938 -4.824 1.00 35.59 N ATOM 1118 CA SER E 161 60.975 31.977 -5.023 1.00 34.81 C ATOM 1119 C SER E 161 60.379 33.352 -5.316 1.00 33.61 C ATOM 1120 O SER E 161 61.130 34.303 -5.544 1.00 34.20 O ATOM 1121 CB SER E 161 61.919 31.570 -6.175 1.00 35.91 C ATOM 1122 OG ASER E 161 61.269 31.695 -7.431 0.50 34.92 O ATOM 1123 OG BSER E 161 62.578 30.350 -5.877 0.50 35.89 O ATOM 1124 N SER E 162 59.052 33.466 -5.318 1.00 31.63 N ATOM 1125 CA SER E 162 58.394 34.706 -5.698 1.00 31.18 C ATOM 1126 C SER E 162 58.339 35.678 -4.523 1.00 29.38 C ATOM 1127 O SER E 162 58.200 35.257 -3.384 1.00 28.33 O ATOM 1128 CB SER E 162 56.965 34.456 -6.140 1.00 32.01 C ATOM 1129 OG SER E 162 56.945 33.629 -7.301 1.00 35.79 O ATOM 1130 N SER E 163 58.406 36.964 -4.833 1.00 27.78 N ATOM 1131 CA SER E 163 58.127 37.988 -3.839 1.00 25.89 C ATOM 1132 C SER E 163 56.629 37.989 -3.497 1.00 25.69 C ATOM 1133 O SER E 163 55.785 37.842 -4.377 1.00 24.52 O ATOM 1134 CB SER E 163 58.527 39.342 -4.400 1.00 26.33 C ATOM 1135 OG SER E 163 58.120 40.349 -3.501 1.00 25.90 O ATOM 1136 N THR E 164 56.290 38.173 -2.221 1.00 23.09 N ATOM 1137 CA THR E 164 54.903 38.321 -1.816 1.00 22.17 C ATOM 1138 C THR E 164 54.644 39.643 -1.082 1.00 21.13 C ATOM 1139 O THR E 164 53.601 39.817 -0.483 1.00 19.93 O ATOM 1140 CB THR E 164 54.465 37.159 -0.908 1.00 22.26 C ATOM 1141 OG1 THR E 164 55.233 37.170 0.298 1.00 21.34 O ATOM 1142 CG2 THR E 164 54.802 35.761 -1.570 1.00 23.58 C ATOM 1143 N VAL E 165 55.585 40.576 -1.171 1.00 20.88 N ATOM 1144 CA VAL E 165 55.422 41.895 -0.567 1.00 19.79 C ATOM 1145 C VAL E 165 54.335 42.659 -1.314 1.00 20.93 C ATOM 1146 O VAL E 165 54.346 42.710 -2.568 1.00 21.91 O ATOM 1147 CB VAL E 165 56.787 42.647 -0.622 1.00 19.14 C ATOM 1148 CG1 VAL E 165 56.617 44.112 -0.131 1.00 18.52 C ATOM 1149 CG2 VAL E 165 57.870 41.914 0.132 1.00 19.04 C ATOM 1150 N GLY E 166 53.386 43.255 -0.588 1.00 19.94 N ATOM 1151 CA GLY E 166 52.344 44.034 -1.211 1.00 20.84 C ATOM 1152 C GLY E 166 52.724 45.493 -1.433 1.00 20.03 C ATOM 1153 O GLY E 166 53.800 45.942 -1.001 1.00 20.15 O ATOM 1154 N TYR E 167 51.824 46.213 -2.106 1.00 19.56 N ATOM 1155 CA TYR E 167 51.977 47.654 -2.365 1.00 19.75 C ATOM 1156 C TYR E 167 51.175 48.433 -1.307 1.00 19.42 C ATOM 1157 O TYR E 167 50.065 48.006 -0.917 1.00 18.55 O ATOM 1158 CB TYR E 167 51.390 47.971 -3.743 1.00 19.58 C ATOM 1159 CG TYR E 167 52.174 47.343 -4.889 1.00 21.09 C ATOM 1160 CD1 TYR E 167 53.246 48.026 -5.480 1.00 24.53 C ATOM 1161 CD2 TYR E 167 51.845 46.070 -5.371 1.00 25.15 C ATOM 1162 CE1 TYR E 167 53.976 47.454 -6.526 1.00 26.48 C ATOM 1163 CE2 TYR E 167 52.550 45.499 -6.452 1.00 25.12 C ATOM 1164 CZ TYR E 167 53.615 46.199 -7.008 1.00 28.54 C ATOM 1165 OH TYR E 167 54.329 45.631 -8.051 1.00 30.94 O ATOM 1166 N PRO E 168 51.636 49.601 -0.851 1.00 18.06 N ATOM 1167 CA PRO E 168 52.803 50.350 -1.367 1.00 18.30 C ATOM 1168 C PRO E 168 54.189 49.942 -0.820 1.00 17.57 C ATOM 1169 O PRO E 168 55.244 50.464 -1.248 1.00 17.28 O ATOM 1170 CB PRO E 168 52.443 51.806 -0.970 1.00 18.37 C ATOM 1171 CG PRO E 168 51.691 51.638 0.359 1.00 17.52 C ATOM 1172 CD PRO E 168 50.859 50.340 0.166 1.00 18.91 C ATOM 1173 N GLY E 169 54.221 48.976 0.102 1.00 17.12 N ATOM 1174 CA GLY E 169 55.502 48.539 0.652 1.00 17.09 C ATOM 1175 C GLY E 169 56.492 48.138 -0.450 1.00 17.93 C ATOM 1176 O GLY E 169 57.713 48.358 -0.319 1.00 17.37 O ATOM 1177 N LYS E 170 55.981 47.559 -1.544 1.00 17.83 N ATOM 1178 CA LYS E 170 56.851 46.997 -2.578 1.00 18.28 C ATOM 1179 C LYS E 170 57.591 48.084 -3.415 1.00 19.37 C ATOM 1180 O LYS E 170 58.607 47.785 -4.057 1.00 19.36 O ATOM 1181 CB LYS E 170 56.045 46.049 -3.498 1.00 18.79 C ATOM 1182 CG LYS E 170 56.936 45.112 -4.315 1.00 20.97 C ATOM 1183 CD LYS E 170 56.057 44.188 -5.202 1.00 24.52 C ATOM 1184 CE LYS E 170 56.901 43.169 -5.968 1.00 28.80 C ATOM 1185 NZ LYS E 170 55.994 42.219 -6.724 1.00 32.37 N ATOM 1186 N TYR E 171 57.119 49.330 -3.375 1.00 18.82 N ATOM 1187 CA TYR E 171 57.811 50.434 -4.069 1.00 19.14 C ATOM 1188 C TYR E 171 59.137 50.786 -3.391 1.00 20.24 C ATOM 1189 O TYR E 171 59.189 50.848 -2.145 1.00 19.77 O ATOM 1190 CB TYR E 171 56.912 51.670 -4.072 1.00 19.44 C ATOM 1191 CG TYR E 171 55.670 51.506 -4.898 1.00 20.42 C ATOM 1192 CD1 TYR E 171 55.739 51.078 -6.232 1.00 21.53 C ATOM 1193 CD2 TYR E 171 54.417 51.769 -4.355 1.00 19.99 C ATOM 1194 CE1 TYR E 171 54.584 50.924 -6.988 1.00 23.82 C ATOM 1195 CE2 TYR E 171 53.244 51.639 -5.116 1.00 21.69 C ATOM 1196 CZ TYR E 171 53.351 51.221 -6.436 1.00 22.98 C ATOM 1197 OH TYR E 171 52.195 51.072 -7.186 1.00 25.49 O ATOM 1198 N PRO E 172 60.210 50.996 -4.165 1.00 19.31 N ATOM 1199 CA PRO E 172 61.537 51.339 -3.597 1.00 19.44 C ATOM 1200 C PRO E 172 61.523 52.549 -2.637 1.00 18.50 C ATOM 1201 O PRO E 172 62.308 52.555 -1.665 1.00 18.31 O ATOM 1202 CB PRO E 172 62.372 51.677 -4.855 1.00 20.54 C ATOM 1203 CG PRO E 172 61.752 50.740 -5.917 1.00 22.06 C ATOM 1204 CD PRO E 172 60.257 50.862 -5.643 1.00 21.09 C ATOM 1205 N SER E 173 60.634 53.514 -2.868 1.00 18.45 N ATOM 1206 CA SER E 173 60.623 54.725 -2.023 1.00 18.50 C ATOM 1207 C SER E 173 60.064 54.503 -0.613 1.00 18.40 C ATOM 1208 O SER E 173 60.237 55.373 0.252 1.00 17.40 O ATOM 1209 CB SER E 173 59.873 55.889 -2.700 1.00 18.43 C ATOM 1210 OG SER E 173 58.496 55.578 -2.862 1.00 20.78 O ATOM 1211 N VAL E 174 59.385 53.367 -0.410 1.00 16.86 N ATOM 1212 CA VAL E 174 58.693 53.050 0.862 1.00 16.75 C ATOM 1213 C VAL E 174 59.514 52.018 1.628 1.00 16.90 C ATOM 1214 O VAL E 174 60.036 51.055 1.029 1.00 17.20 O ATOM 1215 CB VAL E 174 57.264 52.477 0.560 1.00 17.55 C ATOM 1216 CG1 VAL E 174 56.535 52.029 1.829 1.00 17.36 C ATOM 1217 CG2 VAL E 174 56.438 53.508 -0.204 1.00 16.09 C ATOM 1218 N ILE E 175 59.637 52.180 2.938 1.00 15.12 N ATOM 1219 CA ILE E 175 60.306 51.166 3.762 1.00 15.13 C ATOM 1220 C ILE E 175 59.281 50.045 4.071 1.00 15.16 C ATOM 1221 O ILE E 175 58.290 50.287 4.794 1.00 14.63 O ATOM 1222 CB ILE E 175 60.765 51.811 5.081 1.00 14.38 C ATOM 1223 CG1 ILE E 175 61.823 52.905 4.825 1.00 15.89 C ATOM 1224 CG2 ILE E 175 61.290 50.733 6.114 1.00 14.92 C ATOM 1225 CD1 ILE E 175 61.901 53.904 6.019 1.00 14.68 C ATOM 1226 N ALA E 176 59.518 48.844 3.515 1.00 14.99 N ATOM 1227 CA ALA E 176 58.618 47.692 3.762 1.00 14.86 C ATOM 1228 C ALA E 176 59.049 46.870 4.984 1.00 14.11 C ATOM 1229 O ALA E 176 60.202 46.458 5.103 1.00 14.71 O ATOM 1230 CB ALA E 176 58.557 46.777 2.506 1.00 15.37 C ATOM 1231 N VAL E 177 58.111 46.676 5.924 1.00 14.39 N ATOM 1232 CA VAL E 177 58.450 46.087 7.233 1.00 13.88 C ATOM 1233 C VAL E 177 57.775 44.730 7.427 1.00 14.55 C ATOM 1234 O VAL E 177 56.542 44.648 7.380 1.00 14.49 O ATOM 1235 CB VAL E 177 57.992 47.018 8.399 1.00 14.27 C ATOM 1236 CG1 VAL E 177 58.421 46.438 9.769 1.00 14.25 C ATOM 1237 CG2 VAL E 177 58.557 48.486 8.168 1.00 14.32 C ATOM 1238 N GLY E 178 58.591 43.701 7.654 1.00 14.77 N ATOM 1239 CA GLY E 178 58.082 42.359 8.006 1.00 14.83 C ATOM 1240 C GLY E 178 58.022 42.146 9.512 1.00 15.73 C ATOM 1241 O GLY E 178 58.477 43.000 10.292 1.00 14.27 O ATOM 1242 N ALA E 179 57.477 40.997 9.928 1.00 15.28 N ATOM 1243 CA ALA E 179 57.176 40.733 11.336 1.00 14.67 C ATOM 1244 C ALA E 179 57.996 39.599 11.916 1.00 15.17 C ATOM 1245 O ALA E 179 58.075 38.530 11.303 1.00 16.47 O ATOM 1246 CB ALA E 179 55.680 40.420 11.507 1.00 15.29 C ATOM 1247 N VAL E 180 58.562 39.837 13.097 1.00 14.29 N ATOM 1248 CA VAL E 180 59.211 38.787 13.900 1.00 14.40 C ATOM 1249 C VAL E 180 58.486 38.666 15.240 1.00 16.14 C ATOM 1250 O VAL E 180 57.709 39.556 15.629 1.00 14.87 O ATOM 1251 CB VAL E 180 60.736 39.001 14.163 1.00 15.03 C ATOM 1252 CG1 VAL E 180 61.552 38.887 12.873 1.00 14.62 C ATOM 1253 CG2 VAL E 180 61.015 40.381 14.914 1.00 14.62 C ATOM 1254 N ASP E 181 58.738 37.562 15.953 1.00 15.97 N ATOM 1255 CA ASP E 181 58.201 37.434 17.303 1.00 17.04 C ATOM 1256 C ASP E 181 59.274 37.807 18.335 1.00 17.42 C ATOM 1257 O ASP E 181 60.348 38.355 17.974 1.00 16.81 O ATOM 1258 CB ASP E 181 57.638 35.999 17.488 1.00 17.86 C ATOM 1259 CG ASP E 181 58.707 34.925 17.420 1.00 22.10 C ATOM 1260 OD1 ASP E 181 59.928 35.203 17.572 1.00 19.19 O ATOM 1261 OD2 ASP E 181 58.375 33.720 17.234 1.00 23.45 O ATOM 1262 N SER E 182 59.020 37.523 19.614 1.00 17.93 N ATOM 1263 CA SER E 182 59.923 37.965 20.682 1.00 19.47 C ATOM 1264 C SER E 182 61.256 37.219 20.701 1.00 20.17 C ATOM 1265 O SER E 182 62.169 37.612 21.425 1.00 20.34 O ATOM 1266 CB SER E 182 59.218 37.821 22.065 1.00 21.70 C ATOM 1267 OG SER E 182 58.980 36.432 22.381 1.00 22.36 O ATOM 1268 N SER E 183 61.358 36.129 19.933 1.00 19.94 N ATOM 1269 CA SER E 183 62.618 35.399 19.770 1.00 20.33 C ATOM 1270 C SER E 183 63.352 35.772 18.482 1.00 20.62 C ATOM 1271 O SER E 183 64.364 35.107 18.110 1.00 20.26 O ATOM 1272 CB SER E 183 62.359 33.865 19.755 1.00 22.10 C ATOM 1273 OG ASER E 183 61.800 33.439 20.991 0.50 21.60 O ATOM 1274 OG BSER E 183 61.804 33.487 18.511 0.50 23.09 O ATOM 1275 N ASN E 184 62.886 36.841 17.803 1.00 18.65 N ATOM 1276 CA ASN E 184 63.420 37.231 16.492 1.00 19.72 C ATOM 1277 C ASN E 184 63.180 36.226 15.360 1.00 20.13 C ATOM 1278 O ASN E 184 63.841 36.299 14.319 1.00 21.59 O ATOM 1279 CB ASN E 184 64.924 37.573 16.568 1.00 19.36 C ATOM 1280 CG ASN E 184 65.168 38.875 17.288 1.00 23.93 C ATOM 1281 OD1 ASN E 184 64.246 39.664 17.421 1.00 24.56 O ATOM 1282 ND2 ASN E 184 66.411 39.123 17.717 1.00 23.74 N ATOM 1283 N GLN E 185 62.227 35.307 15.541 1.00 20.70 N ATOM 1284 CA GLN E 185 61.851 34.399 14.446 1.00 21.85 C ATOM 1285 C GLN E 185 60.828 35.087 13.560 1.00 20.26 C ATOM 1286 O GLN E 185 59.860 35.667 14.062 1.00 19.27 O ATOM 1287 CB GLN E 185 61.193 33.121 15.004 1.00 22.92 C ATOM 1288 CG GLN E 185 62.117 32.063 15.438 1.00 32.10 C ATOM 1289 CD GLN E 185 62.778 31.385 14.249 1.00 40.53 C ATOM 1290 OE1 GLN E 185 62.092 30.835 13.365 1.00 44.44 O ATOM 1291 NE2 GLN E 185 64.107 31.448 14.203 1.00 42.87 N ATOM 1292 N ARG E 186 61.007 35.008 12.246 1.00 18.74 N ATOM 1293 CA ARG E 186 60.015 35.534 11.335 1.00 19.89 C ATOM 1294 C ARG E 186 58.654 34.866 11.620 1.00 19.74 C ATOM 1295 O ARG E 186 58.607 33.646 11.817 1.00 20.05 O ATOM 1296 CB ARG E 186 60.517 35.251 9.924 1.00 20.36 C ATOM 1297 CG ARG E 186 59.536 35.270 8.885 1.00 23.24 C ATOM 1298 CD ARG E 186 60.074 34.773 7.526 1.00 22.27 C ATOM 1299 NE ARG E 186 58.902 34.820 6.702 1.00 22.08 N ATOM 1300 CZ ARG E 186 58.058 33.795 6.557 1.00 23.36 C ATOM 1301 NH1 ARG E 186 58.329 32.603 7.080 1.00 24.66 N ATOM 1302 NH2 ARG E 186 56.974 33.953 5.841 1.00 23.41 N ATOM 1303 N ALA E 187 57.578 35.650 11.673 1.00 18.51 N ATOM 1304 CA ALA E 187 56.210 35.128 11.766 1.00 19.14 C ATOM 1305 C ALA E 187 55.893 34.349 10.494 1.00 19.84 C ATOM 1306 O ALA E 187 56.241 34.784 9.389 1.00 18.97 O ATOM 1307 CB ALA E 187 55.182 36.279 11.923 1.00 18.87 C ATOM 1308 N SER E 188 55.201 33.208 10.610 1.00 21.90 N ATOM 1309 CA SER E 188 54.976 32.409 9.366 1.00 23.10 C ATOM 1310 C SER E 188 54.170 33.152 8.285 1.00 22.08 C ATOM 1311 O SER E 188 54.331 32.894 7.099 1.00 23.71 O ATOM 1312 CB SER E 188 54.324 31.053 9.713 1.00 23.69 C ATOM 1313 OG SER E 188 53.040 31.313 10.283 1.00 28.96 O ATOM 1314 N PHE E 189 53.281 34.072 8.670 1.00 21.09 N ATOM 1315 CA PHE E 189 52.503 34.855 7.715 1.00 19.98 C ATOM 1316 C PHE E 189 53.288 36.015 7.052 1.00 19.96 C ATOM 1317 O PHE E 189 52.811 36.603 6.103 1.00 20.50 O ATOM 1318 CB PHE E 189 51.223 35.414 8.390 1.00 20.73 C ATOM 1319 CG PHE E 189 51.498 36.316 9.591 1.00 20.90 C ATOM 1320 CD1 PHE E 189 51.978 37.612 9.399 1.00 18.83 C ATOM 1321 CD2 PHE E 189 51.251 35.880 10.906 1.00 22.59 C ATOM 1322 CE1 PHE E 189 52.264 38.445 10.488 1.00 20.25 C ATOM 1323 CE2 PHE E 189 51.524 36.711 12.031 1.00 24.23 C ATOM 1324 CZ PHE E 189 52.030 37.997 11.819 1.00 20.28 C ATOM 1325 N SER E 190 54.450 36.387 7.588 1.00 19.48 N ATOM 1326 CA SER E 190 55.145 37.611 7.110 1.00 18.63 C ATOM 1327 C SER E 190 55.585 37.487 5.625 1.00 18.66 C ATOM 1328 O SER E 190 56.245 36.514 5.258 1.00 19.31 O ATOM 1329 CB SER E 190 56.339 37.919 8.041 1.00 19.03 C ATOM 1330 OG SER E 190 57.016 39.113 7.628 1.00 19.75 O ATOM 1331 N SER E 191 55.212 38.460 4.794 1.00 19.41 N ATOM 1332 CA SER E 191 55.633 38.501 3.384 1.00 19.43 C ATOM 1333 C SER E 191 57.135 38.458 3.200 1.00 20.25 C ATOM 1334 O SER E 191 57.891 38.827 4.099 1.00 20.87 O ATOM 1335 CB SER E 191 55.034 39.698 2.651 1.00 19.14 C ATOM 1336 OG SER E 191 53.659 39.474 2.372 1.00 20.34 O ATOM 1337 N VAL E 192 57.564 37.985 2.024 1.00 19.73 N ATOM 1338 CA VAL E 192 58.972 37.763 1.716 1.00 19.68 C ATOM 1339 C VAL E 192 59.295 38.318 0.339 1.00 19.58 C ATOM 1340 O VAL E 192 58.393 38.558 -0.476 1.00 19.79 O ATOM 1341 CB VAL E 192 59.376 36.244 1.794 1.00 20.61 C ATOM 1342 CG1 VAL E 192 59.247 35.735 3.237 1.00 20.84 C ATOM 1343 CG2 VAL E 192 58.519 35.412 0.801 1.00 20.97 C ATOM 1344 N GLY E 193 60.580 38.520 0.067 1.00 20.14 N ATOM 1345 CA GLY E 193 60.960 39.089 -1.231 1.00 21.13 C ATOM 1346 C GLY E 193 62.128 40.048 -1.091 1.00 21.54 C ATOM 1347 O GLY E 193 62.485 40.461 0.016 1.00 20.69 O ATOM 1348 N PRO E 194 62.766 40.387 -2.206 1.00 21.80 N ATOM 1349 CA PRO E 194 63.924 41.291 -2.156 1.00 22.37 C ATOM 1350 C PRO E 194 63.483 42.700 -1.724 1.00 21.37 C ATOM 1351 O PRO E 194 64.332 43.465 -1.275 1.00 22.37 O ATOM 1352 CB PRO E 194 64.480 41.245 -3.587 1.00 22.42 C ATOM 1353 CG PRO E 194 63.359 40.798 -4.423 1.00 24.07 C ATOM 1354 CD PRO E 194 62.484 39.897 -3.573 1.00 23.46 C ATOM 1355 N GLU E 195 62.192 43.001 -1.796 1.00 20.77 N ATOM 1356 CA GLU E 195 61.662 44.317 -1.368 1.00 20.72 C ATOM 1357 C GLU E 195 61.475 44.438 0.144 1.00 20.77 C ATOM 1358 O GLU E 195 61.194 45.543 0.662 1.00 21.19 O ATOM 1359 CB GLU E 195 60.346 44.657 -2.059 1.00 21.14 C ATOM 1360 CG GLU E 195 60.396 44.582 -3.588 1.00 24.16 C ATOM 1361 CD GLU E 195 60.149 43.172 -4.137 1.00 28.98 C ATOM 1362 OE1 GLU E 195 59.935 42.206 -3.344 1.00 25.78 O ATOM 1363 OE2 GLU E 195 60.212 43.025 -5.395 1.00 31.20 O ATOM 1364 N LEU E 196 61.603 43.331 0.856 1.00 19.39 N ATOM 1365 CA LEU E 196 61.486 43.387 2.327 1.00 19.33 C ATOM 1366 C LEU E 196 62.680 44.173 2.839 1.00 19.85 C ATOM 1367 O LEU E 196 63.825 43.828 2.515 1.00 19.59 O ATOM 1368 CB LEU E 196 61.494 41.944 2.873 1.00 20.17 C ATOM 1369 CG LEU E 196 61.357 41.667 4.350 1.00 23.97 C ATOM 1370 CD1 LEU E 196 60.031 42.320 4.854 1.00 23.35 C ATOM 1371 CD2 LEU E 196 61.373 40.117 4.529 1.00 20.13 C ATOM 1372 N ASP E 197 62.456 45.228 3.645 1.00 16.53 N ATOM 1373 CA ASP E 197 63.568 46.059 4.037 1.00 17.20 C ATOM 1374 C ASP E 197 64.082 45.747 5.449 1.00 16.03 C ATOM 1375 O ASP E 197 65.255 45.413 5.643 1.00 16.38 O ATOM 1376 CB ASP E 197 63.144 47.522 3.901 1.00 17.43 C ATOM 1377 CG ASP E 197 64.321 48.480 3.978 1.00 19.97 C ATOM 1378 OD1 ASP E 197 65.510 48.028 3.934 1.00 19.62 O ATOM 1379 OD2 ASP E 197 64.136 49.713 4.104 1.00 22.36 O ATOM 1380 N VAL E 198 63.195 45.841 6.453 1.00 15.37 N ATOM 1381 CA VAL E 198 63.597 45.575 7.846 1.00 14.62 C ATOM 1382 C VAL E 198 62.458 44.810 8.529 1.00 14.12 C ATOM 1383 O VAL E 198 61.332 44.728 7.992 1.00 15.25 O ATOM 1384 CB VAL E 198 63.848 46.936 8.644 1.00 14.58 C ATOM 1385 CG1 VAL E 198 65.032 47.750 8.025 1.00 15.44 C ATOM 1386 CG2 VAL E 198 62.507 47.818 8.700 1.00 14.12 C ATOM 1387 N MET E 199 62.736 44.310 9.720 1.00 14.21 N ATOM 1388 CA MET E 199 61.744 43.594 10.496 1.00 14.83 C ATOM 1389 C MET E 199 61.480 44.324 11.810 1.00 13.28 C ATOM 1390 O MET E 199 62.368 44.992 12.350 1.00 13.72 O ATOM 1391 CB MET E 199 62.298 42.235 10.922 1.00 14.74 C ATOM 1392 CG MET E 199 62.724 41.281 9.737 1.00 15.92 C ATOM 1393 SD MET E 199 61.468 40.992 8.480 1.00 17.30 S ATOM 1394 CE MET E 199 60.729 39.457 9.194 1.00 16.44 C ATOM 1395 N ALA E 200 60.294 44.100 12.378 1.00 12.93 N ATOM 1396 CA ALA E 200 60.025 44.603 13.742 1.00 13.05 C ATOM 1397 C ALA E 200 59.019 43.652 14.389 1.00 13.22 C ATOM 1398 O ALA E 200 58.439 42.793 13.696 1.00 12.82 O ATOM 1399 CB ALA E 200 59.454 46.037 13.675 1.00 13.14 C ATOM 1400 N PRO E 201 58.787 43.782 15.696 1.00 13.97 N ATOM 1401 CA PRO E 201 57.842 42.862 16.380 1.00 13.53 C ATOM 1402 C PRO E 201 56.411 42.949 15.817 1.00 13.65 C ATOM 1403 O PRO E 201 55.836 44.048 15.740 1.00 12.81 O ATOM 1404 CB PRO E 201 57.883 43.357 17.825 1.00 13.27 C ATOM 1405 CG PRO E 201 59.347 43.926 17.962 1.00 14.30 C ATOM 1406 CD PRO E 201 59.458 44.712 16.634 1.00 13.60 C ATOM 1407 N GLY E 202 55.822 41.790 15.476 1.00 12.93 N ATOM 1408 CA GLY E 202 54.481 41.775 14.914 1.00 13.11 C ATOM 1409 C GLY E 202 53.624 40.603 15.391 1.00 14.44 C ATOM 1410 O GLY E 202 52.605 40.298 14.764 1.00 15.26 O ATOM 1411 N VAL E 203 54.028 39.978 16.494 1.00 15.02 N ATOM 1412 CA VAL E 203 53.278 38.845 17.063 1.00 15.76 C ATOM 1413 C VAL E 203 52.861 39.184 18.482 1.00 15.36 C ATOM 1414 O VAL E 203 53.702 39.536 19.293 1.00 14.77 O ATOM 1415 CB VAL E 203 54.178 37.581 17.030 1.00 15.99 C ATOM 1416 CG1 VAL E 203 53.456 36.381 17.658 1.00 16.70 C ATOM 1417 CG2 VAL E 203 54.552 37.267 15.577 1.00 17.52 C ATOM 1418 N SER E 204 51.555 39.075 18.763 1.00 15.14 N ATOM 1419 CA SER E 204 51.001 39.294 20.118 1.00 15.22 C ATOM 1420 C SER E 204 51.450 40.680 20.651 1.00 13.52 C ATOM 1421 O SER E 204 52.012 40.797 21.730 1.00 13.26 O ATOM 1422 CB SER E 204 51.462 38.201 21.088 1.00 17.26 C ATOM 1423 OG SER E 204 51.067 36.924 20.564 1.00 21.81 O ATOM 1424 N ILE E 205 51.133 41.706 19.880 1.00 13.81 N ATOM 1425 CA ILE E 205 51.507 43.076 20.224 1.00 12.90 C ATOM 1426 C ILE E 205 50.348 43.769 20.933 1.00 12.86 C ATOM 1427 O ILE E 205 49.296 44.001 20.335 1.00 13.37 O ATOM 1428 CB ILE E 205 51.844 43.866 18.915 1.00 12.16 C ATOM 1429 CG1 ILE E 205 52.952 43.142 18.098 1.00 12.53 C ATOM 1430 CG2 ILE E 205 52.243 45.340 19.228 1.00 13.71 C ATOM 1431 CD1 ILE E 205 54.279 42.896 18.927 1.00 13.64 C ATOM 1432 N GLN E 206 50.550 44.076 22.207 1.00 13.00 N ATOM 1433 CA GLN E 206 49.550 44.773 23.012 1.00 13.78 C ATOM 1434 C GLN E 206 49.530 46.247 22.635 1.00 14.24 C ATOM 1435 O GLN E 206 50.607 46.892 22.520 1.00 13.23 O ATOM 1436 CB GLN E 206 49.894 44.654 24.518 1.00 13.70 C ATOM 1437 CG GLN E 206 49.557 43.289 25.109 1.00 16.60 C ATOM 1438 CD GLN E 206 48.038 43.038 25.229 1.00 16.86 C ATOM 1439 OE1 GLN E 206 47.229 43.984 25.135 1.00 17.06 O ATOM 1440 NE2 GLN E 206 47.669 41.788 25.480 1.00 19.14 N ATOM 1441 N SER E 207 48.321 46.785 22.441 1.00 13.87 N ATOM 1442 CA SER E 207 48.178 48.217 22.154 1.00 13.44 C ATOM 1443 C SER E 207 46.752 48.698 22.488 1.00 13.30 C ATOM 1444 O SER E 207 45.914 47.921 22.944 1.00 13.32 O ATOM 1445 CB SER E 207 48.550 48.523 20.680 1.00 13.14 C ATOM 1446 OG SER E 207 48.589 49.925 20.469 1.00 13.39 O ATOM 1447 N THR E 208 46.499 49.980 22.248 1.00 13.79 N ATOM 1448 CA THR E 208 45.184 50.633 22.486 1.00 13.40 C ATOM 1449 C THR E 208 44.125 50.150 21.500 1.00 14.05 C ATOM 1450 O THR E 208 44.414 49.962 20.344 1.00 14.30 O ATOM 1451 CB THR E 208 45.356 52.161 22.296 1.00 13.62 C ATOM 1452 OG1 THR E 208 46.132 52.412 21.102 1.00 12.50 O ATOM 1453 CG2 THR E 208 46.200 52.735 23.476 1.00 13.29 C ATOM 1454 N LEU E 209 42.898 49.969 21.988 1.00 14.78 N ATOM 1455 CA LEU E 209 41.720 49.608 21.149 1.00 15.34 C ATOM 1456 C LEU E 209 40.582 50.579 21.516 1.00 15.07 C ATOM 1457 O LEU E 209 40.554 51.100 22.628 1.00 15.11 O ATOM 1458 CB LEU E 209 41.305 48.151 21.395 1.00 15.00 C ATOM 1459 CG LEU E 209 42.292 47.087 20.850 1.00 14.76 C ATOM 1460 CD1 LEU E 209 41.952 45.635 21.313 1.00 16.78 C ATOM 1461 CD2 LEU E 209 42.349 47.161 19.332 1.00 13.83 C ATOM 1462 N PRO E 210 39.639 50.835 20.605 1.00 15.51 N ATOM 1463 CA PRO E 210 38.578 51.816 20.869 1.00 16.25 C ATOM 1464 C PRO E 210 37.703 51.482 22.102 1.00 16.77 C ATOM 1465 O PRO E 210 37.543 50.280 22.496 1.00 17.24 O ATOM 1466 CB PRO E 210 37.752 51.785 19.568 1.00 16.76 C ATOM 1467 CG PRO E 210 38.786 51.309 18.493 1.00 16.58 C ATOM 1468 CD PRO E 210 39.555 50.258 19.242 1.00 15.66 C ATOM 1469 N GLY E 211 37.155 52.547 22.702 1.00 17.09 N ATOM 1470 CA GLY E 211 36.374 52.454 23.929 1.00 17.98 C ATOM 1471 C GLY E 211 37.218 52.108 25.140 1.00 17.29 C ATOM 1472 O GLY E 211 36.800 51.307 25.989 1.00 18.07 O ATOM 1473 N ASN E 212 38.423 52.688 25.200 1.00 16.90 N ATOM 1474 CA ASN E 212 39.287 52.577 26.372 1.00 17.20 C ATOM 1475 C ASN E 212 39.606 51.107 26.674 1.00 16.73 C ATOM 1476 O ASN E 212 39.481 50.615 27.817 1.00 16.75 O ATOM 1477 CB ASN E 212 38.689 53.316 27.590 1.00 18.89 C ATOM 1478 CG ASN E 212 39.664 53.381 28.735 1.00 19.13 C ATOM 1479 OD1 ASN E 212 40.852 53.343 28.510 1.00 20.15 O ATOM 1480 ND2 ASN E 212 39.164 53.402 29.963 1.00 23.07 N ATOM 1481 N LYS E 213 40.015 50.380 25.634 1.00 15.17 N ATOM 1482 CA LYS E 213 40.416 48.981 25.790 1.00 14.72 C ATOM 1483 C LYS E 213 41.860 48.800 25.320 1.00 14.33 C ATOM 1484 O LYS E 213 42.496 49.766 24.815 1.00 14.35 O ATOM 1485 CB LYS E 213 39.456 48.054 24.980 1.00 15.18 C ATOM 1486 CG LYS E 213 37.941 48.158 25.409 1.00 18.19 C ATOM 1487 CD LYS E 213 37.742 47.537 26.786 1.00 24.57 C ATOM 1488 CE LYS E 213 36.250 47.462 27.249 1.00 26.50 C ATOM 1489 NZ ALYS E 213 36.134 46.609 28.500 0.50 21.86 N ATOM 1490 NZ BLYS E 213 35.479 48.678 26.891 0.50 24.19 N ATOM 1491 N TYR E 214 42.397 47.604 25.545 1.00 14.54 N ATOM 1492 CA TYR E 214 43.743 47.210 25.096 1.00 14.52 C ATOM 1493 C TYR E 214 43.637 45.776 24.597 1.00 15.20 C ATOM 1494 O TYR E 214 42.744 45.033 25.022 1.00 15.53 O ATOM 1495 CB TYR E 214 44.777 47.255 26.262 1.00 14.26 C ATOM 1496 CG TYR E 214 44.863 48.621 26.882 1.00 13.89 C ATOM 1497 CD1 TYR E 214 45.729 49.604 26.335 1.00 13.88 C ATOM 1498 CD2 TYR E 214 44.041 48.974 27.977 1.00 14.55 C ATOM 1499 CE1 TYR E 214 45.780 50.910 26.891 1.00 14.72 C ATOM 1500 CE2 TYR E 214 44.064 50.287 28.519 1.00 17.00 C ATOM 1501 CZ TYR E 214 44.936 51.232 27.977 1.00 14.62 C ATOM 1502 OH TYR E 214 44.965 52.502 28.539 1.00 14.61 O ATOM 1503 N GLY E 215 44.531 45.369 23.708 1.00 14.28 N ATOM 1504 CA GLY E 215 44.539 43.993 23.268 1.00 14.64 C ATOM 1505 C GLY E 215 45.721 43.668 22.382 1.00 14.92 C ATOM 1506 O GLY E 215 46.339 44.569 21.815 1.00 14.45 O ATOM 1507 N ALA E 216 46.012 42.371 22.280 1.00 13.65 N ATOM 1508 CA ALA E 216 47.107 41.861 21.474 1.00 13.64 C ATOM 1509 C ALA E 216 46.684 41.511 20.058 1.00 14.69 C ATOM 1510 O ALA E 216 45.819 40.655 19.865 1.00 14.94 O ATOM 1511 CB ALA E 216 47.742 40.596 22.183 1.00 13.94 C ATOM 1512 N TYR E 217 47.303 42.168 19.065 1.00 14.70 N ATOM 1513 CA TYR E 217 47.037 41.893 17.643 1.00 14.24 C ATOM 1514 C TYR E 217 48.308 41.349 16.994 1.00 14.79 C ATOM 1515 O TYR E 217 49.419 41.440 17.557 1.00 13.97 O ATOM 1516 CB TYR E 217 46.586 43.181 16.905 1.00 14.45 C ATOM 1517 CG TYR E 217 45.143 43.595 17.008 1.00 15.60 C ATOM 1518 CD1 TYR E 217 44.288 43.008 17.918 1.00 15.53 C ATOM 1519 CD2 TYR E 217 44.619 44.568 16.133 1.00 15.01 C ATOM 1520 CE1 TYR E 217 42.926 43.393 17.984 1.00 16.71 C ATOM 1521 CE2 TYR E 217 43.264 44.983 16.200 1.00 16.15 C ATOM 1522 CZ TYR E 217 42.438 44.384 17.119 1.00 17.33 C ATOM 1523 OH TYR E 217 41.109 44.733 17.192 1.00 19.00 O ATOM 1524 N ASN E 218 48.134 40.724 15.816 1.00 15.44 N ATOM 1525 CA ASN E 218 49.219 40.126 15.044 1.00 15.56 C ATOM 1526 C ASN E 218 49.206 40.688 13.643 1.00 14.34 C ATOM 1527 O ASN E 218 48.136 41.004 13.112 1.00 16.69 O ATOM 1528 CB ASN E 218 49.068 38.580 14.954 1.00 15.70 C ATOM 1529 CG ASN E 218 48.956 37.938 16.321 1.00 18.54 C ATOM 1530 OD1 ASN E 218 49.943 37.753 17.007 1.00 21.19 O ATOM 1531 ND2 ASN E 218 47.721 37.643 16.745 1.00 24.95 N ATOM 1532 N GLY E 219 50.377 40.834 13.039 1.00 14.81 N ATOM 1533 CA GLY E 219 50.409 41.267 11.646 1.00 14.52 C ATOM 1534 C GLY E 219 51.651 42.090 11.318 1.00 14.72 C ATOM 1535 O GLY E 219 52.289 42.675 12.213 1.00 13.64 O ATOM 1536 N THR E 220 51.979 42.168 10.031 1.00 14.44 N ATOM 1537 CA THR E 220 52.954 43.199 9.626 1.00 14.22 C ATOM 1538 C THR E 220 52.387 44.595 9.876 1.00 13.75 C ATOM 1539 O THR E 220 53.153 45.544 9.980 1.00 14.49 O ATOM 1540 CB THR E 220 53.431 43.045 8.156 1.00 13.80 C ATOM 1541 OG1 THR E 220 52.312 42.996 7.254 1.00 14.57 O ATOM 1542 CG2 THR E 220 54.269 41.737 8.002 1.00 14.32 C ATOM 1543 N SER E 221 51.059 44.735 9.975 1.00 14.07 N ATOM 1544 CA SER E 221 50.437 46.006 10.450 1.00 13.91 C ATOM 1545 C SER E 221 50.973 46.466 11.822 1.00 14.03 C ATOM 1546 O SER E 221 51.018 47.673 12.110 1.00 13.75 O ATOM 1547 CB SER E 221 48.924 45.857 10.640 1.00 13.49 C ATOM 1548 OG SER E 221 48.273 46.059 9.405 1.00 15.31 O ATOM 1549 N MET E 222 51.299 45.500 12.661 1.00 13.61 N ATOM 1550 CA MET E 222 51.785 45.782 14.024 1.00 14.01 C ATOM 1551 C MET E 222 53.285 46.091 13.998 1.00 13.60 C ATOM 1552 O MET E 222 53.802 46.797 14.876 1.00 13.18 O ATOM 1553 CB MET E 222 51.527 44.586 14.965 1.00 13.62 C ATOM 1554 CG MET E 222 50.045 44.458 15.471 1.00 13.39 C ATOM 1555 SD MET E 222 48.774 44.286 14.148 1.00 15.74 S ATOM 1556 CE MET E 222 48.069 45.857 14.079 1.00 14.11 C ATOM 1557 N ALA E 223 53.994 45.530 13.026 1.00 13.53 N ATOM 1558 CA ALA E 223 55.434 45.730 12.917 1.00 13.42 C ATOM 1559 C ALA E 223 55.753 47.139 12.379 1.00 13.39 C ATOM 1560 O ALA E 223 56.599 47.834 12.919 1.00 13.57 O ATOM 1561 CB ALA E 223 56.039 44.638 11.990 1.00 13.25 C ATOM 1562 N SER E 224 55.052 47.534 11.318 1.00 13.53 N ATOM 1563 CA SER E 224 55.241 48.868 10.672 1.00 12.99 C ATOM 1564 C SER E 224 55.307 50.050 11.672 1.00 13.46 C ATOM 1565 O SER E 224 56.257 50.869 11.591 1.00 13.08 O ATOM 1566 CB SER E 224 54.152 49.094 9.614 1.00 14.25 C ATOM 1567 OG SER E 224 54.381 50.291 8.856 1.00 14.20 O ATOM 1568 N PRO E 225 54.356 50.199 12.587 1.00 12.48 N ATOM 1569 CA PRO E 225 54.408 51.368 13.494 1.00 11.42 C ATOM 1570 C PRO E 225 55.553 51.321 14.520 1.00 12.27 C ATOM 1571 O PRO E 225 55.887 52.390 15.032 1.00 11.92 O ATOM 1572 CB PRO E 225 53.042 51.334 14.221 1.00 12.09 C ATOM 1573 CG PRO E 225 52.658 49.783 14.164 1.00 11.47 C ATOM 1574 CD PRO E 225 53.090 49.451 12.748 1.00 12.37 C ATOM 1575 N HIS E 226 56.182 50.171 14.762 1.00 11.79 N ATOM 1576 CA HIS E 226 57.438 50.186 15.546 1.00 12.56 C ATOM 1577 C HIS E 226 58.471 51.017 14.774 1.00 12.63 C ATOM 1578 O HIS E 226 59.238 51.761 15.380 1.00 12.21 O ATOM 1579 CB HIS E 226 57.981 48.772 15.787 1.00 12.38 C ATOM 1580 CG HIS E 226 57.198 47.991 16.827 1.00 12.57 C ATOM 1581 ND1 HIS E 226 56.095 47.216 16.515 1.00 11.95 N ATOM 1582 CD2 HIS E 226 57.406 47.830 18.158 1.00 14.21 C ATOM 1583 CE1 HIS E 226 55.629 46.650 17.622 1.00 12.20 C ATOM 1584 NE2 HIS E 226 56.405 47.002 18.631 1.00 13.07 N ATOM 1585 N VAL E 227 58.527 50.806 13.453 1.00 13.21 N ATOM 1586 CA VAL E 227 59.509 51.517 12.606 1.00 13.04 C ATOM 1587 C VAL E 227 59.101 52.982 12.410 1.00 12.87 C ATOM 1588 O VAL E 227 59.970 53.872 12.430 1.00 12.16 O ATOM 1589 CB VAL E 227 59.670 50.774 11.244 1.00 12.88 C ATOM 1590 CG1 VAL E 227 60.671 51.489 10.313 1.00 12.56 C ATOM 1591 CG2 VAL E 227 60.119 49.297 11.505 1.00 13.71 C ATOM 1592 N ALA E 228 57.808 53.254 12.217 1.00 12.14 N ATOM 1593 CA ALA E 228 57.385 54.668 12.103 1.00 11.81 C ATOM 1594 C ALA E 228 57.683 55.398 13.428 1.00 13.11 C ATOM 1595 O ALA E 228 58.175 56.526 13.431 1.00 11.54 O ATOM 1596 CB ALA E 228 55.884 54.746 11.782 1.00 13.36 C ATOM 1597 N GLY E 229 57.351 54.766 14.559 1.00 11.65 N ATOM 1598 CA GLY E 229 57.689 55.352 15.870 1.00 12.20 C ATOM 1599 C GLY E 229 59.216 55.498 16.029 1.00 11.82 C ATOM 1600 O GLY E 229 59.697 56.543 16.554 1.00 12.26 O ATOM 1601 N ALA E 230 59.994 54.533 15.539 1.00 12.13 N ATOM 1602 CA ALA E 230 61.456 54.648 15.657 1.00 11.56 C ATOM 1603 C ALA E 230 61.944 55.877 14.854 1.00 12.29 C ATOM 1604 O ALA E 230 62.855 56.611 15.300 1.00 12.11 O ATOM 1605 CB ALA E 230 62.168 53.368 15.147 1.00 11.93 C ATOM 1606 N ALA E 231 61.369 56.063 13.677 1.00 11.82 N ATOM 1607 CA ALA E 231 61.716 57.238 12.850 1.00 11.79 C ATOM 1608 C ALA E 231 61.426 58.547 13.612 1.00 12.49 C ATOM 1609 O ALA E 231 62.232 59.515 13.535 1.00 12.18 O ATOM 1610 CB ALA E 231 60.871 57.233 11.532 1.00 10.81 C ATOM 1611 N ALA E 232 60.284 58.607 14.301 1.00 12.39 N ATOM 1612 CA ALA E 232 59.987 59.786 15.128 1.00 12.35 C ATOM 1613 C ALA E 232 61.001 59.995 16.263 1.00 12.83 C ATOM 1614 O ALA E 232 61.354 61.145 16.585 1.00 12.79 O ATOM 1615 CB ALA E 232 58.522 59.734 15.677 1.00 13.06 C ATOM 1616 N LEU E 233 61.419 58.909 16.937 1.00 12.36 N ATOM 1617 CA LEU E 233 62.455 59.041 17.981 1.00 12.36 C ATOM 1618 C LEU E 233 63.727 59.618 17.402 1.00 13.17 C ATOM 1619 O LEU E 233 64.327 60.537 17.993 1.00 13.77 O ATOM 1620 CB LEU E 233 62.812 57.666 18.611 1.00 11.86 C ATOM 1621 CG LEU E 233 61.652 57.091 19.464 1.00 11.95 C ATOM 1622 CD1 LEU E 233 62.097 55.687 20.005 1.00 10.05 C ATOM 1623 CD2 LEU E 233 61.311 58.079 20.636 1.00 11.26 C ATOM 1624 N ILE E 234 64.140 59.063 16.257 1.00 12.32 N ATOM 1625 CA ILE E 234 65.396 59.484 15.623 1.00 12.41 C ATOM 1626 C ILE E 234 65.339 60.993 15.261 1.00 13.50 C ATOM 1627 O ILE E 234 66.277 61.742 15.538 1.00 13.41 O ATOM 1628 CB ILE E 234 65.673 58.627 14.366 1.00 11.93 C ATOM 1629 CG1 ILE E 234 66.001 57.204 14.833 1.00 10.42 C ATOM 1630 CG2 ILE E 234 66.861 59.244 13.544 1.00 14.52 C ATOM 1631 CD1 ILE E 234 65.942 56.144 13.675 1.00 12.16 C ATOM 1632 N LEU E 235 64.223 61.409 14.663 1.00 12.15 N ATOM 1633 CA LEU E 235 64.046 62.826 14.284 1.00 13.47 C ATOM 1634 C LEU E 235 63.931 63.735 15.511 1.00 14.46 C ATOM 1635 O LEU E 235 64.383 64.890 15.469 1.00 15.96 O ATOM 1636 CB LEU E 235 62.781 62.986 13.417 1.00 13.68 C ATOM 1637 CG LEU E 235 62.927 62.520 11.970 1.00 12.41 C ATOM 1638 CD1 LEU E 235 61.520 62.469 11.320 1.00 14.00 C ATOM 1639 CD2 LEU E 235 63.926 63.492 11.182 1.00 13.32 C ATOM 1640 N SER E 236 63.382 63.244 16.621 1.00 13.74 N ATOM 1641 CA SER E 236 63.398 64.068 17.850 1.00 13.78 C ATOM 1642 C SER E 236 64.811 64.286 18.396 1.00 14.75 C ATOM 1643 O SER E 236 65.109 65.358 18.971 1.00 15.58 O ATOM 1644 CB SER E 236 62.398 63.556 18.921 1.00 13.00 C ATOM 1645 OG SER E 236 62.861 62.381 19.587 1.00 13.30 O ATOM 1646 N LYS E 237 65.707 63.324 18.183 1.00 13.65 N ATOM 1647 CA LYS E 237 67.107 63.499 18.621 1.00 14.35 C ATOM 1648 C LYS E 237 67.937 64.249 17.551 1.00 15.30 C ATOM 1649 O LYS E 237 68.926 64.929 17.901 1.00 15.40 O ATOM 1650 CB LYS E 237 67.773 62.149 18.890 1.00 13.26 C ATOM 1651 CG LYS E 237 69.203 62.294 19.476 1.00 13.32 C ATOM 1652 CD LYS E 237 69.818 60.925 19.828 1.00 14.94 C ATOM 1653 CE LYS E 237 71.234 61.128 20.382 1.00 17.15 C ATOM 1654 NZ LYS E 237 71.857 59.784 20.695 1.00 18.33 N ATOM 1655 N HIS E 238 67.576 64.074 16.282 1.00 14.27 N ATOM 1656 CA HIS E 238 68.305 64.685 15.148 1.00 14.53 C ATOM 1657 C HIS E 238 67.322 65.425 14.239 1.00 14.38 C ATOM 1658 O HIS E 238 66.999 64.925 13.152 1.00 14.81 O ATOM 1659 CB HIS E 238 69.102 63.623 14.348 1.00 14.03 C ATOM 1660 CG HIS E 238 70.128 62.887 15.163 1.00 14.36 C ATOM 1661 ND1 HIS E 238 71.383 63.416 15.437 1.00 13.86 N ATOM 1662 CD2 HIS E 238 70.088 61.669 15.763 1.00 13.00 C ATOM 1663 CE1 HIS E 238 72.074 62.532 16.148 1.00 14.45 C ATOM 1664 NE2 HIS E 238 71.309 61.469 16.362 1.00 14.03 N ATOM 1665 N PRO E 239 66.788 66.567 14.677 1.00 16.21 N ATOM 1666 CA PRO E 239 65.672 67.194 13.939 1.00 17.26 C ATOM 1667 C PRO E 239 66.024 67.692 12.537 1.00 18.22 C ATOM 1668 O PRO E 239 65.125 67.912 11.747 1.00 20.33 O ATOM 1669 CB PRO E 239 65.204 68.363 14.850 1.00 18.37 C ATOM 1670 CG PRO E 239 65.942 68.254 16.111 1.00 20.77 C ATOM 1671 CD PRO E 239 67.113 67.283 15.934 1.00 15.65 C ATOM 1672 N ASN E 240 67.293 67.846 12.230 1.00 17.69 N ATOM 1673 CA ASN E 240 67.673 68.217 10.860 1.00 18.96 C ATOM 1674 C AASN E 240 67.957 67.090 9.923 0.50 18.28 C ATOM 1675 C BASN E 240 68.294 67.078 10.026 0.50 18.64 C ATOM 1676 O AASN E 240 68.189 67.356 8.724 0.50 18.33 O ATOM 1677 O BASN E 240 68.967 67.284 8.998 0.50 18.72 O ATOM 1678 CB AASN E 240 68.986 69.030 10.985 0.50 18.23 C ATOM 1679 CB BASN E 240 68.416 69.550 10.767 0.50 20.24 C ATOM 1680 CG AASN E 240 68.697 70.488 11.219 0.50 18.43 C ATOM 1681 CG BASN E 240 69.663 69.502 11.515 0.50 19.34 C ATOM 1682 OD1AASN E 240 67.583 70.905 10.964 0.50 16.42 O ATOM 1683 OD1BASN E 240 69.937 68.490 12.130 0.50 22.46 O ATOM 1684 ND2AASN E 240 69.640 71.242 11.769 0.50 13.07 N ATOM 1685 ND2BASN E 240 70.436 70.577 11.503 0.50 21.81 N ATOM 1686 N TRP E 241 68.013 65.850 10.443 1.00 17.52 N ATOM 1687 CA TRP E 241 68.263 64.689 9.563 1.00 16.90 C ATOM 1688 C TRP E 241 67.141 64.608 8.550 1.00 16.64 C ATOM 1689 O TRP E 241 65.986 64.793 8.896 1.00 16.80 O ATOM 1690 CB TRP E 241 68.302 63.373 10.354 1.00 16.29 C ATOM 1691 CG TRP E 241 69.642 63.130 10.974 1.00 16.18 C ATOM 1692 CD1 TRP E 241 70.697 64.026 11.064 1.00 16.77 C ATOM 1693 CD2 TRP E 241 70.084 61.936 11.607 1.00 16.21 C ATOM 1694 NE1 TRP E 241 71.766 63.435 11.698 1.00 15.83 N ATOM 1695 CE2 TRP E 241 71.418 62.152 12.045 1.00 16.88 C ATOM 1696 CE3 TRP E 241 69.483 60.686 11.868 1.00 16.05 C ATOM 1697 CZ2 TRP E 241 72.148 61.183 12.727 1.00 13.82 C ATOM 1698 CZ3 TRP E 241 70.216 59.720 12.534 1.00 13.44 C ATOM 1699 CH2 TRP E 241 71.543 59.971 12.969 1.00 17.20 C ATOM 1700 N THR E 242 67.479 64.334 7.296 1.00 15.76 N ATOM 1701 CA THR E 242 66.482 64.172 6.258 1.00 15.13 C ATOM 1702 C THR E 242 65.851 62.783 6.377 1.00 14.59 C ATOM 1703 O THR E 242 66.375 61.883 7.084 1.00 14.73 O ATOM 1704 CB THR E 242 67.172 64.185 4.878 1.00 15.95 C ATOM 1705 OG1 THR E 242 68.168 63.145 4.839 1.00 17.39 O ATOM 1706 CG2 THR E 242 67.946 65.525 4.694 1.00 17.94 C ATOM 1707 N ASN E 243 64.762 62.603 5.643 1.00 13.41 N ATOM 1708 CA ASN E 243 64.168 61.247 5.536 1.00 14.72 C ATOM 1709 C ASN E 243 65.192 60.236 4.993 1.00 14.59 C ATOM 1710 O ASN E 243 65.260 59.100 5.467 1.00 16.04 O ATOM 1711 CB ASN E 243 62.874 61.211 4.728 1.00 13.46 C ATOM 1712 CG ASN E 243 63.010 61.795 3.301 1.00 16.18 C ATOM 1713 OD1 ASN E 243 63.968 62.544 2.973 1.00 15.05 O ATOM 1714 ND2 ASN E 243 62.022 61.468 2.452 1.00 14.89 N ATOM 1715 N THR E 244 66.009 60.658 4.011 1.00 14.29 N ATOM 1716 CA THR E 244 67.072 59.799 3.491 1.00 15.31 C ATOM 1717 C THR E 244 67.962 59.283 4.604 1.00 16.17 C ATOM 1718 O THR E 244 68.259 58.071 4.680 1.00 17.32 O ATOM 1719 CB THR E 244 67.959 60.632 2.544 1.00 16.43 C ATOM 1720 OG1 THR E 244 67.115 61.293 1.595 1.00 16.92 O ATOM 1721 CG2 THR E 244 68.874 59.691 1.754 1.00 18.02 C ATOM 1722 N GLN E 245 68.356 60.197 5.499 1.00 15.44 N ATOM 1723 CA GLN E 245 69.240 59.849 6.594 1.00 16.59 C ATOM 1724 C GLN E 245 68.547 58.983 7.666 1.00 14.94 C ATOM 1725 O GLN E 245 69.158 58.065 8.246 1.00 15.58 O ATOM 1726 CB GLN E 245 69.817 61.122 7.202 1.00 17.03 C ATOM 1727 CG GLN E 245 70.572 60.915 8.485 1.00 21.55 C ATOM 1728 CD GLN E 245 71.849 60.029 8.391 1.00 27.79 C ATOM 1729 OE1 GLN E 245 72.324 59.517 9.423 1.00 28.71 O ATOM 1730 NE2 GLN E 245 72.397 59.872 7.193 1.00 25.41 N ATOM 1731 N VAL E 246 67.292 59.293 7.959 1.00 14.52 N ATOM 1732 CA VAL E 246 66.560 58.464 8.950 1.00 13.59 C ATOM 1733 C VAL E 246 66.431 57.035 8.408 1.00 13.75 C ATOM 1734 O VAL E 246 66.703 56.053 9.128 1.00 14.91 O ATOM 1735 CB VAL E 246 65.160 59.056 9.251 1.00 13.37 C ATOM 1736 CG1 VAL E 246 64.315 58.084 10.135 1.00 12.86 C ATOM 1737 CG2 VAL E 246 65.310 60.433 9.971 1.00 13.29 C ATOM 1738 N ARG E 247 66.060 56.914 7.134 1.00 14.09 N ATOM 1739 CA ARG E 247 65.910 55.601 6.527 1.00 14.43 C ATOM 1740 C ARG E 247 67.237 54.861 6.558 1.00 14.77 C ATOM 1741 O ARG E 247 67.283 53.683 6.992 1.00 14.70 O ATOM 1742 CB ARG E 247 65.408 55.718 5.074 1.00 14.92 C ATOM 1743 CG ARG E 247 65.361 54.347 4.356 1.00 14.25 C ATOM 1744 CD ARG E 247 64.584 54.402 3.063 1.00 16.04 C ATOM 1745 NE ARG E 247 64.541 53.076 2.448 1.00 18.49 N ATOM 1746 CZ ARG E 247 63.737 52.742 1.433 1.00 20.17 C ATOM 1747 NH1 ARG E 247 62.922 53.636 0.861 1.00 17.70 N ATOM 1748 NH2 ARG E 247 63.787 51.494 0.967 1.00 19.48 N ATOM 1749 N SER E 248 68.330 55.508 6.115 1.00 14.68 N ATOM 1750 CA SER E 248 69.618 54.787 6.196 1.00 15.33 C ATOM 1751 C SER E 248 70.010 54.434 7.617 1.00 15.25 C ATOM 1752 O SER E 248 70.590 53.383 7.825 1.00 14.64 O ATOM 1753 CB SER E 248 70.818 55.517 5.548 1.00 16.31 C ATOM 1754 OG ASER E 248 70.572 56.002 4.255 0.50 12.08 O ATOM 1755 OG BSER E 248 70.975 56.806 6.014 0.50 16.04 O ATOM 1756 N SER E 249 69.731 55.315 8.592 1.00 14.11 N ATOM 1757 CA SER E 249 70.110 55.011 9.958 1.00 14.42 C ATOM 1758 C SER E 249 69.446 53.735 10.462 1.00 14.16 C ATOM 1759 O SER E 249 70.105 52.925 11.145 1.00 15.12 O ATOM 1760 CB SER E 249 69.825 56.197 10.905 1.00 14.11 C ATOM 1761 OG ASER E 249 70.446 57.373 10.432 0.33 16.27 O ATOM 1762 OG BSER E 249 68.467 56.289 11.263 0.67 13.16 O ATOM 1763 N LEU E 250 68.187 53.544 10.102 1.00 14.33 N ATOM 1764 CA LEU E 250 67.457 52.321 10.527 1.00 14.35 C ATOM 1765 C LEU E 250 67.972 51.084 9.780 1.00 14.42 C ATOM 1766 O LEU E 250 68.155 49.994 10.378 1.00 15.81 O ATOM 1767 CB LEU E 250 65.964 52.501 10.239 1.00 14.59 C ATOM 1768 CG LEU E 250 65.275 53.405 11.281 1.00 15.77 C ATOM 1769 CD1 LEU E 250 63.999 53.978 10.678 1.00 17.82 C ATOM 1770 CD2 LEU E 250 65.059 52.660 12.628 1.00 15.76 C ATOM 1771 N GLU E 251 68.202 51.233 8.480 1.00 14.07 N ATOM 1772 CA GLU E 251 68.720 50.097 7.679 1.00 13.97 C ATOM 1773 C GLU E 251 70.132 49.681 8.075 1.00 14.79 C ATOM 1774 O GLU E 251 70.465 48.493 8.069 1.00 15.55 O ATOM 1775 CB GLU E 251 68.703 50.467 6.179 1.00 14.06 C ATOM 1776 CG GLU E 251 67.280 50.559 5.642 1.00 14.96 C ATOM 1777 CD GLU E 251 67.217 51.197 4.258 1.00 19.29 C ATOM 1778 OE1 GLU E 251 68.208 51.834 3.802 1.00 20.72 O ATOM 1779 OE2 GLU E 251 66.158 51.022 3.617 1.00 19.82 O ATOM 1780 N ASN E 252 70.986 50.656 8.398 1.00 13.95 N ATOM 1781 CA ASN E 252 72.410 50.403 8.606 1.00 14.26 C ATOM 1782 C ASN E 252 72.742 49.896 10.010 1.00 14.08 C ATOM 1783 O ASN E 252 73.931 49.586 10.296 1.00 15.03 O ATOM 1784 CB ASN E 252 73.192 51.709 8.340 1.00 14.03 C ATOM 1785 CG ASN E 252 73.171 52.125 6.857 1.00 15.32 C ATOM 1786 OD1 ASN E 252 73.712 53.211 6.503 1.00 18.92 O ATOM 1787 ND2 ASN E 252 72.522 51.333 6.012 1.00 12.39 N ATOM 1788 N THR E 253 71.731 49.843 10.909 1.00 13.76 N ATOM 1789 CA THR E 253 71.998 49.464 12.303 1.00 13.69 C ATOM 1790 C THR E 253 71.100 48.312 12.787 1.00 13.27 C ATOM 1791 O THR E 253 71.019 48.094 13.976 1.00 14.94 O ATOM 1792 CB THR E 253 71.798 50.643 13.295 1.00 13.72 C ATOM 1793 OG1 THR E 253 70.462 51.156 13.152 1.00 13.73 O ATOM 1794 CG2 THR E 253 72.715 51.854 12.877 1.00 13.99 C ATOM 1795 N THR E 254 70.416 47.641 11.881 1.00 13.93 N ATOM 1796 CA THR E 254 69.642 46.454 12.274 1.00 14.25 C ATOM 1797 C THR E 254 70.552 45.384 12.893 1.00 14.44 C ATOM 1798 O THR E 254 71.773 45.320 12.639 1.00 15.38 O ATOM 1799 CB THR E 254 68.996 45.780 11.051 1.00 13.28 C ATOM 1800 OG1 THR E 254 70.022 45.587 10.049 1.00 16.30 O ATOM 1801 CG2 THR E 254 67.920 46.658 10.381 1.00 13.52 C ATOM 1802 N THR E 255 69.920 44.516 13.672 1.00 14.99 N ATOM 1803 CA THR E 255 70.538 43.261 14.078 1.00 15.22 C ATOM 1804 C THR E 255 70.224 42.264 12.983 1.00 16.26 C ATOM 1805 O THR E 255 69.056 41.910 12.772 1.00 14.82 O ATOM 1806 CB THR E 255 69.934 42.829 15.400 1.00 14.72 C ATOM 1807 OG1 THR E 255 70.376 43.727 16.436 1.00 17.26 O ATOM 1808 CG2 THR E 255 70.545 41.430 15.843 1.00 15.66 C ATOM 1809 N LYS E 256 71.246 41.791 12.256 1.00 16.98 N ATOM 1810 CA LYS E 256 70.945 40.902 11.101 1.00 17.61 C ATOM 1811 C LYS E 256 70.454 39.535 11.638 1.00 18.67 C ATOM 1812 O LYS E 256 70.916 39.074 12.708 1.00 19.34 O ATOM 1813 CB LYS E 256 72.188 40.729 10.190 1.00 18.98 C ATOM 1814 CG LYS E 256 72.662 42.056 9.487 1.00 17.45 C ATOM 1815 CD LYS E 256 72.227 42.130 8.012 1.00 20.62 C ATOM 1816 CE LYS E 256 72.473 43.552 7.448 1.00 20.32 C ATOM 1817 NZ LYS E 256 72.743 43.598 5.939 1.00 17.26 N ATOM 1818 N LEU E 257 69.491 38.960 10.919 1.00 19.56 N ATOM 1819 CA LEU E 257 68.808 37.744 11.348 1.00 22.08 C ATOM 1820 C LEU E 257 69.156 36.750 10.236 1.00 24.42 C ATOM 1821 O LEU E 257 70.340 36.591 9.928 1.00 27.77 O ATOM 1822 CB LEU E 257 67.306 37.999 11.533 1.00 19.85 C ATOM 1823 CG LEU E 257 67.026 39.024 12.672 1.00 19.87 C ATOM 1824 CD1 LEU E 257 65.511 39.332 12.854 1.00 20.41 C ATOM 1825 CD2 LEU E 257 67.719 38.655 13.991 1.00 23.46 C ATOM 1826 N GLY E 258 68.196 36.131 9.585 1.00 26.49 N ATOM 1827 CA GLY E 258 68.554 35.231 8.477 1.00 27.39 C ATOM 1828 C GLY E 258 68.818 35.817 7.091 1.00 27.38 C ATOM 1829 O GLY E 258 69.151 37.007 6.904 1.00 27.91 O ATOM 1830 N ASP E 259 68.619 34.972 6.076 1.00 27.36 N ATOM 1831 CA ASP E 259 68.650 35.427 4.685 1.00 26.54 C ATOM 1832 C ASP E 259 67.727 36.617 4.423 1.00 24.92 C ATOM 1833 O ASP E 259 66.588 36.644 4.900 1.00 23.36 O ATOM 1834 CB ASP E 259 68.235 34.295 3.743 1.00 27.76 C ATOM 1835 CG ASP E 259 68.487 34.643 2.288 1.00 32.31 C ATOM 1836 OD1 ASP E 259 69.599 34.332 1.778 1.00 40.63 O ATOM 1837 OD2 ASP E 259 67.675 35.237 1.557 1.00 30.72 O ATOM 1838 N SER E 260 68.195 37.573 3.628 1.00 24.22 N ATOM 1839 CA SER E 260 67.458 38.825 3.408 1.00 23.88 C ATOM 1840 C SER E 260 66.146 38.648 2.662 1.00 22.84 C ATOM 1841 O SER E 260 65.249 39.455 2.780 1.00 21.25 O ATOM 1842 CB SER E 260 68.353 39.874 2.720 1.00 24.73 C ATOM 1843 OG SER E 260 68.792 39.396 1.468 1.00 27.99 O ATOM 1844 N PHE E 261 66.009 37.553 1.902 1.00 22.70 N ATOM 1845 CA PHE E 261 64.742 37.224 1.295 1.00 21.64 C ATOM 1846 C PHE E 261 63.648 37.065 2.353 1.00 20.72 C ATOM 1847 O PHE E 261 62.506 37.410 2.114 1.00 20.69 O ATOM 1848 CB PHE E 261 64.888 35.904 0.476 1.00 22.94 C ATOM 1849 CG PHE E 261 63.714 35.603 -0.393 1.00 22.92 C ATOM 1850 CD1 PHE E 261 63.620 36.153 -1.681 1.00 25.34 C ATOM 1851 CD2 PHE E 261 62.690 34.749 0.070 1.00 24.65 C ATOM 1852 CE1 PHE E 261 62.507 35.880 -2.493 1.00 25.78 C ATOM 1853 CE2 PHE E 261 61.580 34.464 -0.749 1.00 26.01 C ATOM 1854 CZ PHE E 261 61.498 35.038 -2.024 1.00 26.00 C ATOM 1855 N TYR E 262 64.019 36.551 3.521 1.00 20.59 N ATOM 1856 CA TYR E 262 63.019 36.273 4.569 1.00 21.23 C ATOM 1857 C TYR E 262 63.028 37.312 5.691 1.00 19.63 C ATOM 1858 O TYR E 262 62.036 37.469 6.371 1.00 19.22 O ATOM 1859 CB TYR E 262 63.261 34.897 5.202 1.00 21.03 C ATOM 1860 CG TYR E 262 63.104 33.782 4.180 1.00 25.67 C ATOM 1861 CD1 TYR E 262 61.820 33.306 3.814 1.00 28.11 C ATOM 1862 CD2 TYR E 262 64.226 33.230 3.551 1.00 29.70 C ATOM 1863 CE1 TYR E 262 61.671 32.288 2.847 1.00 31.60 C ATOM 1864 CE2 TYR E 262 64.081 32.211 2.571 1.00 33.10 C ATOM 1865 CZ TYR E 262 62.811 31.753 2.238 1.00 32.92 C ATOM 1866 OH TYR E 262 62.686 30.762 1.286 1.00 33.52 O ATOM 1867 N TYR E 263 64.157 37.975 5.875 1.00 18.95 N ATOM 1868 CA TYR E 263 64.342 38.852 7.036 1.00 17.98 C ATOM 1869 C TYR E 263 64.726 40.286 6.660 1.00 18.26 C ATOM 1870 O TYR E 263 64.968 41.088 7.555 1.00 18.00 O ATOM 1871 CB TYR E 263 65.438 38.274 7.947 1.00 17.71 C ATOM 1872 CG TYR E 263 64.958 37.087 8.756 1.00 19.33 C ATOM 1873 CD1 TYR E 263 64.328 37.285 10.001 1.00 19.25 C ATOM 1874 CD2 TYR E 263 65.108 35.768 8.287 1.00 21.88 C ATOM 1875 CE1 TYR E 263 63.874 36.188 10.786 1.00 19.56 C ATOM 1876 CE2 TYR E 263 64.649 34.663 9.050 1.00 22.36 C ATOM 1877 CZ TYR E 263 64.025 34.879 10.297 1.00 22.79 C ATOM 1878 OH TYR E 263 63.546 33.816 11.068 1.00 24.55 O ATOM 1879 N GLY E 264 64.852 40.592 5.374 1.00 18.09 N ATOM 1880 CA GLY E 264 65.494 41.861 4.979 1.00 18.24 C ATOM 1881 C GLY E 264 66.822 42.072 5.667 1.00 18.72 C ATOM 1882 O GLY E 264 67.627 41.130 5.844 1.00 19.00 O ATOM 1883 N LYS E 265 67.073 43.316 6.095 1.00 17.61 N ATOM 1884 CA LYS E 265 68.281 43.634 6.864 1.00 16.85 C ATOM 1885 C LYS E 265 68.270 43.207 8.333 1.00 15.73 C ATOM 1886 O LYS E 265 69.289 43.272 9.001 1.00 16.97 O ATOM 1887 CB LYS E 265 68.586 45.135 6.734 1.00 16.65 C ATOM 1888 CG LYS E 265 68.776 45.478 5.225 1.00 19.67 C ATOM 1889 CD LYS E 265 68.833 46.949 5.028 1.00 20.33 C ATOM 1890 CE LYS E 265 69.032 47.274 3.519 1.00 24.24 C ATOM 1891 NZ LYS E 265 67.840 46.893 2.656 1.00 26.50 N ATOM 1892 N GLY E 266 67.135 42.694 8.816 1.00 15.47 N ATOM 1893 CA GLY E 266 67.054 42.259 10.199 1.00 14.81 C ATOM 1894 C GLY E 266 66.161 43.153 11.065 1.00 14.68 C ATOM 1895 O GLY E 266 65.400 43.990 10.539 1.00 14.12 O ATOM 1896 N LEU E 267 66.314 42.982 12.376 1.00 14.06 N ATOM 1897 CA LEU E 267 65.477 43.667 13.369 1.00 14.05 C ATOM 1898 C LEU E 267 65.993 45.086 13.572 1.00 13.07 C ATOM 1899 O LEU E 267 67.164 45.264 13.824 1.00 13.35 O ATOM 1900 CB LEU E 267 65.548 42.914 14.704 1.00 14.39 C ATOM 1901 CG LEU E 267 64.903 43.622 15.903 1.00 12.59 C ATOM 1902 CD1 LEU E 267 63.385 43.605 15.728 1.00 13.52 C ATOM 1903 CD2 LEU E 267 65.328 42.892 17.178 1.00 15.92 C ATOM 1904 N ILE E 268 65.113 46.101 13.498 1.00 12.88 N ATOM 1905 CA ILE E 268 65.582 47.468 13.825 1.00 13.16 C ATOM 1906 C ILE E 268 66.049 47.629 15.269 1.00 13.23 C ATOM 1907 O ILE E 268 65.593 46.938 16.205 1.00 13.31 O ATOM 1908 CB ILE E 268 64.480 48.510 13.490 1.00 12.15 C ATOM 1909 CG1 ILE E 268 63.189 48.306 14.321 1.00 12.71 C ATOM 1910 CG2 ILE E 268 64.196 48.529 11.946 1.00 12.75 C ATOM 1911 CD1 ILE E 268 62.459 49.707 14.608 1.00 12.82 C ATOM 1912 N ASN E 269 67.003 48.546 15.453 1.00 12.56 N ATOM 1913 CA ASN E 269 67.580 48.843 16.740 1.00 12.33 C ATOM 1914 C ASN E 269 67.681 50.373 16.768 1.00 12.54 C ATOM 1915 O ASN E 269 68.572 50.960 16.143 1.00 13.13 O ATOM 1916 CB ASN E 269 68.975 48.203 16.817 1.00 13.15 C ATOM 1917 CG ASN E 269 69.770 48.665 18.030 1.00 14.99 C ATOM 1918 OD1 ASN E 269 69.368 49.596 18.749 1.00 13.80 O ATOM 1919 ND2 ASN E 269 70.872 47.951 18.329 1.00 13.51 N ATOM 1920 N VAL E 270 66.702 51.021 17.387 1.00 11.95 N ATOM 1921 CA VAL E 270 66.645 52.491 17.313 1.00 12.46 C ATOM 1922 C VAL E 270 67.746 53.168 18.181 1.00 13.39 C ATOM 1923 O VAL E 270 68.186 54.295 17.867 1.00 13.81 O ATOM 1924 CB VAL E 270 65.216 52.992 17.648 1.00 12.31 C ATOM 1925 CG1 VAL E 270 64.871 52.707 19.097 1.00 13.76 C ATOM 1926 CG2 VAL E 270 65.069 54.522 17.326 1.00 14.30 C ATOM 1927 N GLN E 271 68.222 52.486 19.223 1.00 12.45 N ATOM 1928 CA GLN E 271 69.374 52.997 19.974 1.00 12.72 C ATOM 1929 C GLN E 271 70.582 53.196 19.039 1.00 14.29 C ATOM 1930 O GLN E 271 71.201 54.262 19.028 1.00 13.88 O ATOM 1931 CB GLN E 271 69.751 52.056 21.131 1.00 14.01 C ATOM 1932 CG GLN E 271 70.983 52.553 21.928 1.00 15.00 C ATOM 1933 CD GLN E 271 71.329 51.584 23.038 1.00 18.44 C ATOM 1934 OE1 GLN E 271 71.089 50.376 22.896 1.00 20.37 O ATOM 1935 NE2 GLN E 271 71.830 52.103 24.163 1.00 19.36 N ATOM 1936 N ALA E 272 70.918 52.141 18.302 1.00 13.70 N ATOM 1937 CA ALA E 272 72.045 52.203 17.355 1.00 14.71 C ATOM 1938 C ALA E 272 71.757 53.202 16.202 1.00 14.29 C ATOM 1939 O ALA E 272 72.675 53.973 15.806 1.00 15.17 O ATOM 1940 CB ALA E 272 72.351 50.824 16.806 1.00 13.98 C ATOM 1941 N ALA E 273 70.513 53.234 15.694 1.00 13.27 N ATOM 1942 CA ALA E 273 70.146 54.124 14.581 1.00 12.87 C ATOM 1943 C ALA E 273 70.375 55.601 14.971 1.00 14.80 C ATOM 1944 O ALA E 273 70.716 56.447 14.115 1.00 15.06 O ATOM 1945 CB ALA E 273 68.668 53.945 14.190 1.00 12.58 C ATOM 1946 N ALA E 274 70.135 55.910 16.243 1.00 14.52 N ATOM 1947 CA ALA E 274 70.124 57.319 16.672 1.00 15.11 C ATOM 1948 C ALA E 274 71.506 57.807 17.103 1.00 15.92 C ATOM 1949 O ALA E 274 71.631 58.936 17.590 1.00 16.59 O ATOM 1950 CB ALA E 274 69.074 57.529 17.812 1.00 14.33 C ATOM 1951 N GLN E 275 72.542 56.973 16.957 1.00 15.44 N ATOM 1952 CA GLN E 275 73.926 57.408 17.211 1.00 16.86 C ATOM 1953 C GLN E 275 74.437 58.104 15.954 1.00 16.94 C ATOM 1954 O GLN E 275 73.804 57.997 14.909 1.00 17.62 O ATOM 1955 CB GLN E 275 74.812 56.189 17.500 1.00 17.22 C ATOM 1956 CG GLN E 275 74.524 55.512 18.869 1.00 21.70 C ATOM 1957 CD GLN E 275 74.696 56.497 20.043 1.00 29.13 C ATOM 1958 OE1 GLN E 275 73.750 57.209 20.463 1.00 35.42 O ATOM 1959 NE2 GLN E 275 75.903 56.562 20.554 1.00 35.27 N ATOM 1960 N AHIS E 276 75.574 58.799 15.997 0.50 17.15 N ATOM 1961 N BHIS E 276 75.595 58.794 16.097 0.50 17.37 N ATOM 1962 CA AHIS E 276 76.062 59.351 14.723 0.50 17.00 C ATOM 1963 CA BHIS E 276 76.326 59.473 14.996 0.50 17.83 C ATOM 1964 C AHIS E 276 76.659 58.288 13.814 0.50 18.44 C ATOM 1965 C BHIS E 276 76.854 58.497 13.932 0.50 18.92 C ATOM 1966 O AHIS E 276 76.402 58.266 12.599 0.50 18.98 O ATOM 1967 O BHIS E 276 76.749 58.759 12.726 0.50 19.67 O ATOM 1968 CB AHIS E 276 77.058 60.465 14.951 0.50 16.68 C ATOM 1969 CB BHIS E 276 77.555 60.253 15.539 0.50 17.71 C ATOM 1970 CG AHIS E 276 76.401 61.758 15.277 0.50 15.65 C ATOM 1971 CG BHIS E 276 77.237 61.311 16.552 0.50 17.15 C ATOM 1972 ND1AHIS E 276 76.395 62.289 16.547 0.50 15.60 N ATOM 1973 ND1BHIS E 276 76.282 62.286 16.345 0.50 18.27 N ATOM 1974 CD2AHIS E 276 75.695 62.612 14.503 0.50 15.63 C ATOM 1975 CD2BHIS E 276 77.768 61.558 17.775 0.50 18.30 C ATOM 1976 CE1AHIS E 276 75.720 63.422 16.537 0.50 13.92 C ATOM 1977 CE1BHIS E 276 76.231 63.082 17.398 0.50 18.41 C ATOM 1978 NE2AHIS E 276 75.286 63.640 15.310 0.50 14.63 N ATOM 1979 NE2BHIS E 276 77.113 62.656 18.286 0.50 18.24 N ATOM 1980 N HIS E 277 77.435 57.398 14.407 1.00 18.45 N ATOM 1981 CA HIS E 277 78.093 56.366 13.613 1.00 20.80 C ATOM 1982 C HIS E 277 77.320 55.060 13.655 1.00 18.80 C ATOM 1983 O HIS E 277 76.892 54.628 14.717 1.00 19.23 O ATOM 1984 CB HIS E 277 79.519 56.243 14.119 1.00 22.65 C ATOM 1985 CG HIS E 277 80.274 57.529 13.934 1.00 31.30 C ATOM 1986 ND1 HIS E 277 80.745 58.279 14.992 1.00 36.50 N ATOM 1987 CD2 HIS E 277 80.509 58.264 12.818 1.00 37.07 C ATOM 1988 CE1 HIS E 277 81.304 59.384 14.529 1.00 36.76 C ATOM 1989 NE2 HIS E 277 81.166 59.405 13.216 1.00 37.16 N ATOM 1990 N HIS E 278 77.071 54.499 12.478 1.00 18.54 N ATOM 1991 CA HIS E 278 76.147 53.368 12.353 1.00 17.20 C ATOM 1992 C HIS E 278 76.858 52.078 11.986 1.00 17.51 C ATOM 1993 O HIS E 278 77.707 52.073 11.097 1.00 18.35 O ATOM 1994 CB HIS E 278 75.103 53.683 11.282 1.00 16.95 C ATOM 1995 CG HIS E 278 74.306 54.926 11.596 1.00 18.27 C ATOM 1996 ND1 HIS E 278 74.022 55.895 10.659 1.00 20.45 N ATOM 1997 CD2 HIS E 278 73.722 55.333 12.752 1.00 19.14 C ATOM 1998 CE1 HIS E 278 73.314 56.864 11.231 1.00 21.10 C ATOM 1999 NE2 HIS E 278 73.105 56.537 12.496 1.00 18.84 N ATOM 2000 N HIS E 279 76.517 51.012 12.685 1.00 16.79 N ATOM 2001 CA HIS E 279 76.900 49.642 12.282 1.00 16.95 C ATOM 2002 C HIS E 279 75.876 48.677 12.832 1.00 16.69 C ATOM 2003 O HIS E 279 75.103 49.032 13.741 1.00 16.26 O ATOM 2004 CB HIS E 279 78.302 49.288 12.802 1.00 18.54 C ATOM 2005 CG HIS E 279 78.480 49.480 14.278 1.00 24.15 C ATOM 2006 ND1 HIS E 279 78.962 50.656 14.822 1.00 30.64 N ATOM 2007 CD2 HIS E 279 78.278 48.639 15.320 1.00 30.79 C ATOM 2008 CE1 HIS E 279 79.036 50.531 16.140 1.00 32.71 C ATOM 2009 NE2 HIS E 279 78.645 49.311 16.466 1.00 31.61 N ATOM 2010 N HIS E 280 75.881 47.471 12.283 1.00 15.63 N ATOM 2011 CA HIS E 280 74.955 46.415 12.698 1.00 16.96 C ATOM 2012 C HIS E 280 75.436 45.784 14.014 1.00 18.12 C ATOM 2013 O HIS E 280 76.650 45.695 14.278 1.00 17.56 O ATOM 2014 CB HIS E 280 74.871 45.347 11.621 1.00 16.91 C ATOM 2015 CG HIS E 280 74.290 45.842 10.329 1.00 17.90 C ATOM 2016 ND1 HIS E 280 72.945 46.108 10.179 1.00 15.60 N ATOM 2017 CD2 HIS E 280 74.871 46.125 9.133 1.00 17.07 C ATOM 2018 CE1 HIS E 280 72.715 46.521 8.937 1.00 14.82 C ATOM 2019 NE2 HIS E 280 73.870 46.526 8.280 1.00 15.91 N ATOM 2020 N HIS E 281 74.473 45.395 14.857 1.00 19.17 N ATOM 2021 CA HIS E 281 74.819 44.630 16.056 1.00 21.82 C ATOM 2022 C HIS E 281 74.324 43.211 15.888 1.00 22.25 C ATOM 2023 O HIS E 281 74.461 42.511 16.902 1.00 25.38 O ATOM 2024 CB HIS E 281 74.264 45.271 17.358 1.00 21.88 C ATOM 2025 CG HIS E 281 74.814 46.631 17.652 1.00 24.63 C ATOM 2026 ND1 HIS E 281 75.564 46.900 18.781 1.00 29.30 N ATOM 2027 CD2 HIS E 281 74.699 47.809 16.989 1.00 26.22 C ATOM 2028 CE1 HIS E 281 75.904 48.177 18.787 1.00 31.60 C ATOM 2029 NE2 HIS E 281 75.403 48.746 17.704 1.00 29.70 N ATOM 2030 OXT HIS E 281 73.858 42.759 14.816 1.00 23.15 O TER 2031 HIS E 281 ATOM 2032 C MET I 20 44.233 23.066 6.665 1.00 39.84 C ATOM 2033 O MET I 20 45.336 23.510 6.298 1.00 41.23 O ATOM 2034 N LYS I 21 43.148 23.146 5.901 1.00 38.89 N ATOM 2035 CA LYS I 21 43.169 23.940 4.659 1.00 36.58 C ATOM 2036 C LYS I 21 43.208 25.429 4.976 1.00 34.25 C ATOM 2037 O LYS I 21 42.358 25.905 5.736 1.00 34.64 O ATOM 2038 CB LYS I 21 41.949 23.634 3.786 1.00 37.64 C ATOM 2039 CG LYS I 21 42.212 23.982 2.316 1.00 36.77 C ATOM 2040 CD LYS I 21 41.235 23.332 1.373 1.00 37.85 C ATOM 2041 CE LYS I 21 41.532 23.799 -0.023 1.00 36.27 C ATOM 2042 NZ LYS I 21 40.983 22.876 -1.010 1.00 42.70 N ATOM 2043 N THR I 22 44.168 26.168 4.406 1.00 31.51 N ATOM 2044 CA THR I 22 44.216 27.636 4.584 1.00 29.24 C ATOM 2045 C THR I 22 44.213 28.495 3.294 1.00 27.22 C ATOM 2046 O THR I 22 44.285 29.727 3.376 1.00 25.47 O ATOM 2047 CB THR I 22 45.427 28.073 5.445 1.00 30.02 C ATOM 2048 OG1 THR I 22 46.630 27.751 4.746 1.00 32.72 O ATOM 2049 CG2 THR I 22 45.528 27.255 6.742 1.00 32.81 C ATOM 2050 N GLU I 23 44.169 27.863 2.116 1.00 25.35 N ATOM 2051 CA GLU I 23 44.056 28.590 0.846 1.00 24.59 C ATOM 2052 C GLU I 23 43.119 27.782 -0.060 1.00 22.12 C ATOM 2053 O GLU I 23 43.135 26.534 -0.007 1.00 21.63 O ATOM 2054 CB GLU I 23 45.403 28.679 0.097 1.00 26.61 C ATOM 2055 CG GLU I 23 46.530 29.471 0.773 1.00 34.75 C ATOM 2056 CD GLU I 23 47.812 29.462 -0.070 1.00 43.18 C ATOM 2057 OE1 GLU I 23 47.761 29.897 -1.248 1.00 45.98 O ATOM 2058 OE2 GLU I 23 48.869 29.005 0.434 1.00 48.27 O ATOM 2059 N TRP I 24 42.393 28.474 -0.943 1.00 19.54 N ATOM 2060 CA TRP I 24 41.413 27.814 -1.839 1.00 19.41 C ATOM 2061 C TRP I 24 41.585 28.273 -3.294 1.00 19.58 C ATOM 2062 O TRP I 24 40.707 28.946 -3.868 1.00 18.85 O ATOM 2063 CB TRP I 24 39.970 28.116 -1.388 1.00 19.06 C ATOM 2064 CG TRP I 24 39.572 27.488 -0.055 1.00 18.93 C ATOM 2065 CD1 TRP I 24 38.856 26.336 0.124 1.00 20.79 C ATOM 2066 CD2 TRP I 24 39.838 27.993 1.260 1.00 18.29 C ATOM 2067 NE1 TRP I 24 38.664 26.084 1.466 1.00 20.98 N ATOM 2068 CE2 TRP I 24 39.255 27.081 2.191 1.00 19.70 C ATOM 2069 CE3 TRP I 24 40.470 29.151 1.759 1.00 17.04 C ATOM 2070 CZ2 TRP I 24 39.327 27.269 3.585 1.00 20.62 C ATOM 2071 CZ3 TRP I 24 40.561 29.329 3.153 1.00 20.15 C ATOM 2072 CH2 TRP I 24 39.981 28.391 4.044 1.00 19.37 C ATOM 2073 N PRO I 25 42.692 27.900 -3.933 1.00 20.48 N ATOM 2074 CA PRO I 25 42.935 28.364 -5.318 1.00 20.77 C ATOM 2075 C PRO I 25 41.868 27.844 -6.305 1.00 21.01 C ATOM 2076 O PRO I 25 41.621 28.503 -7.327 1.00 21.45 O ATOM 2077 CB PRO I 25 44.312 27.779 -5.662 1.00 21.07 C ATOM 2078 CG PRO I 25 44.464 26.607 -4.699 1.00 21.84 C ATOM 2079 CD PRO I 25 43.768 27.027 -3.412 1.00 20.97 C ATOM 2080 N GLU I 26 41.237 26.719 -5.977 1.00 20.60 N ATOM 2081 CA GLU I 26 40.216 26.133 -6.841 1.00 22.12 C ATOM 2082 C GLU I 26 38.937 27.016 -6.898 1.00 21.05 C ATOM 2083 O GLU I 26 38.065 26.812 -7.754 1.00 21.40 O ATOM 2084 CB GLU I 26 39.901 24.693 -6.382 1.00 23.04 C ATOM 2085 CG GLU I 26 39.155 24.613 -5.049 1.00 25.64 C ATOM 2086 CD GLU I 26 40.043 24.671 -3.795 1.00 30.12 C ATOM 2087 OE1 GLU I 26 41.258 24.956 -3.872 1.00 29.98 O ATOM 2088 OE2 GLU I 26 39.496 24.414 -2.708 1.00 33.34 O ATOM 2089 N LEU I 27 38.827 27.997 -5.993 1.00 18.75 N ATOM 2090 CA LEU I 27 37.634 28.861 -5.966 1.00 18.07 C ATOM 2091 C LEU I 27 37.728 30.100 -6.885 1.00 17.45 C ATOM 2092 O LEU I 27 36.737 30.804 -7.091 1.00 18.18 O ATOM 2093 CB LEU I 27 37.307 29.280 -4.504 1.00 17.03 C ATOM 2094 CG LEU I 27 36.749 28.116 -3.647 1.00 19.65 C ATOM 2095 CD1 LEU I 27 36.494 28.634 -2.206 1.00 20.28 C ATOM 2096 CD2 LEU I 27 35.435 27.503 -4.211 1.00 21.21 C ATOM 2097 N VAL I 28 38.922 30.401 -7.416 1.00 18.35 N ATOM 2098 CA VAL I 28 39.044 31.585 -8.268 1.00 17.89 C ATOM 2099 C VAL I 28 38.146 31.369 -9.493 1.00 18.57 C ATOM 2100 O VAL I 28 38.159 30.264 -10.077 1.00 18.75 O ATOM 2101 CB VAL I 28 40.506 31.799 -8.703 1.00 18.15 C ATOM 2102 CG1 VAL I 28 40.578 32.933 -9.733 1.00 18.96 C ATOM 2103 CG2 VAL I 28 41.353 32.126 -7.454 1.00 17.91 C ATOM 2104 N GLY I 29 37.354 32.382 -9.842 1.00 18.72 N ATOM 2105 CA GLY I 29 36.445 32.305 -10.994 1.00 18.92 C ATOM 2106 C GLY I 29 35.088 31.688 -10.681 1.00 19.58 C ATOM 2107 O GLY I 29 34.198 31.661 -11.559 1.00 20.20 O ATOM 2108 N LYS I 30 34.920 31.163 -9.466 1.00 18.33 N ATOM 2109 CA LYS I 30 33.589 30.726 -8.988 1.00 17.31 C ATOM 2110 C LYS I 30 32.806 31.890 -8.445 1.00 17.01 C ATOM 2111 O LYS I 30 33.366 32.963 -8.192 1.00 16.39 O ATOM 2112 CB LYS I 30 33.669 29.638 -7.911 1.00 17.72 C ATOM 2113 CG LYS I 30 34.409 28.359 -8.331 1.00 22.98 C ATOM 2114 CD LYS I 30 33.867 27.745 -9.575 1.00 31.50 C ATOM 2115 CE LYS I 30 34.653 26.444 -9.883 1.00 37.34 C ATOM 2116 NZ LYS I 30 34.042 25.291 -9.151 1.00 41.39 N ATOM 2117 N SER I 31 31.505 31.681 -8.263 1.00 15.73 N ATOM 2118 CA SER I 31 30.643 32.707 -7.643 1.00 15.14 C ATOM 2119 C SER I 31 31.038 32.925 -6.193 1.00 15.71 C ATOM 2120 O SER I 31 31.527 32.017 -5.535 1.00 15.99 O ATOM 2121 CB SER I 31 29.171 32.303 -7.667 1.00 15.38 C ATOM 2122 OG SER I 31 28.951 31.118 -6.856 1.00 16.02 O ATOM 2123 N VAL I 32 30.765 34.122 -5.684 1.00 14.52 N ATOM 2124 CA VAL I 32 30.983 34.372 -4.250 1.00 15.51 C ATOM 2125 C VAL I 32 30.138 33.438 -3.374 1.00 16.13 C ATOM 2126 O VAL I 32 30.581 33.013 -2.305 1.00 16.14 O ATOM 2127 CB VAL I 32 30.744 35.889 -3.908 1.00 15.88 C ATOM 2128 CG1 VAL I 32 29.251 36.253 -4.058 1.00 16.87 C ATOM 2129 CG2 VAL I 32 31.230 36.201 -2.467 1.00 15.64 C ATOM 2130 N GLU I 33 28.934 33.071 -3.852 1.00 14.78 N ATOM 2131 CA GLU I 33 28.055 32.161 -3.100 1.00 15.28 C ATOM 2132 C GLU I 33 28.680 30.789 -2.951 1.00 15.60 C ATOM 2133 O GLU I 33 28.701 30.228 -1.843 1.00 15.67 O ATOM 2134 CB GLU I 33 26.685 32.020 -3.798 1.00 14.00 C ATOM 2135 CG GLU I 33 25.832 33.310 -3.790 1.00 15.39 C ATOM 2136 CD GLU I 33 26.149 34.307 -4.913 1.00 16.30 C ATOM 2137 OE1 GLU I 33 27.033 34.068 -5.786 1.00 15.57 O ATOM 2138 OE2 GLU I 33 25.457 35.367 -4.947 1.00 19.22 O ATOM 2139 N GLU I 34 29.202 30.246 -4.045 1.00 14.90 N ATOM 2140 CA GLU I 34 29.816 28.913 -3.929 1.00 16.22 C ATOM 2141 C GLU I 34 31.061 28.972 -3.043 1.00 15.71 C ATOM 2142 O GLU I 34 31.290 28.080 -2.201 1.00 15.36 O ATOM 2143 CB GLU I 34 30.183 28.378 -5.309 1.00 17.23 C ATOM 2144 CG GLU I 34 30.791 26.977 -5.199 1.00 18.66 C ATOM 2145 CD GLU I 34 31.027 26.285 -6.533 1.00 25.85 C ATOM 2146 OE1 GLU I 34 30.439 26.669 -7.570 1.00 22.56 O ATOM 2147 OE2 GLU I 34 31.789 25.291 -6.515 1.00 27.95 O ATOM 2148 N ALA I 35 31.877 30.018 -3.231 1.00 15.52 N ATOM 2149 CA ALA I 35 33.055 30.175 -2.369 1.00 15.22 C ATOM 2150 C ALA I 35 32.708 30.199 -0.870 1.00 15.57 C ATOM 2151 O ALA I 35 33.378 29.526 -0.064 1.00 15.24 O ATOM 2152 CB ALA I 35 33.840 31.457 -2.774 1.00 15.35 C ATOM 2153 N LYS I 36 31.677 30.954 -0.481 1.00 15.24 N ATOM 2154 CA LYS I 36 31.263 30.987 0.934 1.00 15.81 C ATOM 2155 C LYS I 36 30.887 29.571 1.391 1.00 16.13 C ATOM 2156 O LYS I 36 31.251 29.136 2.490 1.00 15.29 O ATOM 2157 CB LYS I 36 30.077 31.908 1.182 1.00 16.97 C ATOM 2158 CG LYS I 36 30.412 33.436 1.058 1.00 21.66 C ATOM 2159 CD LYS I 36 29.089 34.255 1.217 1.00 26.92 C ATOM 2160 CE LYS I 36 29.359 35.726 1.468 1.00 35.42 C ATOM 2161 NZ LYS I 36 28.078 36.541 1.600 1.00 38.51 N ATOM 2162 N LYS I 37 30.132 28.862 0.554 1.00 14.81 N ATOM 2163 CA LYS I 37 29.636 27.540 0.969 1.00 14.87 C ATOM 2164 C LYS I 37 30.812 26.595 1.219 1.00 15.12 C ATOM 2165 O LYS I 37 30.865 25.881 2.233 1.00 16.29 O ATOM 2166 CB LYS I 37 28.742 26.950 -0.117 1.00 14.99 C ATOM 2167 CG LYS I 37 28.265 25.552 0.277 1.00 18.38 C ATOM 2168 CD LYS I 37 27.218 25.054 -0.720 1.00 23.48 C ATOM 2169 CE LYS I 37 26.890 23.588 -0.400 1.00 31.56 C ATOM 2170 NZ LYS I 37 25.551 23.130 -0.944 1.00 33.79 N ATOM 2171 N VAL I 38 31.749 26.594 0.282 1.00 15.82 N ATOM 2172 CA VAL I 38 32.903 25.699 0.367 1.00 16.58 C ATOM 2173 C VAL I 38 33.802 26.045 1.556 1.00 16.76 C ATOM 2174 O VAL I 38 34.196 25.163 2.362 1.00 17.45 O ATOM 2175 CB VAL I 38 33.723 25.761 -0.947 1.00 16.99 C ATOM 2176 CG1 VAL I 38 35.105 25.034 -0.780 1.00 20.46 C ATOM 2177 CG2 VAL I 38 32.927 25.119 -2.097 1.00 17.08 C ATOM 2178 N ILE I 39 34.110 27.327 1.693 1.00 16.18 N ATOM 2179 CA ILE I 39 34.946 27.731 2.819 1.00 16.43 C ATOM 2180 C ILE I 39 34.315 27.357 4.184 1.00 15.69 C ATOM 2181 O ILE I 39 35.009 26.856 5.083 1.00 16.54 O ATOM 2182 CB ILE I 39 35.261 29.245 2.735 1.00 17.13 C ATOM 2183 CG1 ILE I 39 36.294 29.483 1.617 1.00 18.54 C ATOM 2184 CG2 ILE I 39 35.841 29.732 4.088 1.00 17.79 C ATOM 2185 CD1 ILE I 39 36.231 30.911 1.048 1.00 20.41 C ATOM 2186 N LEU I 40 33.012 27.562 4.336 1.00 15.40 N ATOM 2187 CA LEU I 40 32.343 27.199 5.599 1.00 15.40 C ATOM 2188 C LEU I 40 32.247 25.683 5.847 1.00 16.21 C ATOM 2189 O LEU I 40 32.098 25.262 6.992 1.00 16.83 O ATOM 2190 CB LEU I 40 30.979 27.864 5.711 1.00 16.28 C ATOM 2191 CG LEU I 40 31.098 29.408 5.795 1.00 16.74 C ATOM 2192 CD1 LEU I 40 29.757 30.030 5.556 1.00 20.92 C ATOM 2193 CD2 LEU I 40 31.634 29.797 7.213 1.00 18.26 C ATOM 2194 N GLN I 41 32.309 24.860 4.799 1.00 15.42 N ATOM 2195 CA GLN I 41 32.428 23.404 5.020 1.00 15.50 C ATOM 2196 C GLN I 41 33.803 23.068 5.591 1.00 16.76 C ATOM 2197 O GLN I 41 33.925 22.202 6.491 1.00 17.65 O ATOM 2198 CB GLN I 41 32.229 22.637 3.715 1.00 15.74 C ATOM 2199 CG GLN I 41 30.823 22.710 3.214 1.00 16.57 C ATOM 2200 CD GLN I 41 30.563 21.883 1.956 1.00 21.69 C ATOM 2201 OE1 GLN I 41 29.401 21.599 1.647 1.00 21.38 O ATOM 2202 NE2 GLN I 41 31.621 21.575 1.185 1.00 23.37 N ATOM 2203 N ASP I 42 34.837 23.757 5.103 1.00 16.02 N ATOM 2204 CA ASP I 42 36.213 23.461 5.549 1.00 17.20 C ATOM 2205 C ASP I 42 36.539 24.112 6.877 1.00 17.77 C ATOM 2206 O ASP I 42 37.341 23.585 7.674 1.00 19.62 O ATOM 2207 CB ASP I 42 37.269 23.946 4.524 1.00 17.52 C ATOM 2208 CG ASP I 42 37.230 23.178 3.217 1.00 21.69 C ATOM 2209 OD1 ASP I 42 36.790 21.990 3.247 1.00 26.57 O ATOM 2210 OD2 ASP I 42 37.574 23.682 2.112 1.00 19.64 O ATOM 2211 N LYS I 43 35.915 25.247 7.131 1.00 15.72 N ATOM 2212 CA LYS I 43 36.251 26.107 8.258 1.00 17.77 C ATOM 2213 C LYS I 43 34.938 26.726 8.763 1.00 17.37 C ATOM 2214 O LYS I 43 34.615 27.885 8.442 1.00 16.95 O ATOM 2215 CB LYS I 43 37.265 27.171 7.763 1.00 17.65 C ATOM 2216 CG LYS I 43 37.748 28.177 8.845 1.00 20.27 C ATOM 2217 CD LYS I 43 38.833 29.161 8.249 1.00 22.65 C ATOM 2218 CE LYS I 43 39.281 30.230 9.273 1.00 24.27 C ATOM 2219 NZ LYS I 43 40.197 29.580 10.280 1.00 25.52 N ATOM 2220 N PRO I 44 34.115 25.952 9.477 1.00 16.76 N ATOM 2221 CA PRO I 44 32.766 26.416 9.827 1.00 17.38 C ATOM 2222 C PRO I 44 32.690 27.673 10.689 1.00 17.88 C ATOM 2223 O PRO I 44 31.646 28.330 10.642 1.00 18.31 O ATOM 2224 CB PRO I 44 32.139 25.215 10.586 1.00 17.98 C ATOM 2225 CG PRO I 44 32.934 24.041 10.146 1.00 17.40 C ATOM 2226 CD PRO I 44 34.347 24.550 9.883 1.00 17.81 C ATOM 2227 N ALA I 45 33.740 27.980 11.445 1.00 19.59 N ATOM 2228 CA ALA I 45 33.735 29.176 12.275 1.00 21.02 C ATOM 2229 C ALA I 45 34.346 30.379 11.544 1.00 21.51 C ATOM 2230 O ALA I 45 34.537 31.444 12.156 1.00 21.11 O ATOM 2231 CB ALA I 45 34.460 28.905 13.616 1.00 22.20 C ATOM 2232 N ALA I 46 34.630 30.242 10.243 1.00 20.24 N ATOM 2233 CA ALA I 46 35.244 31.359 9.497 1.00 20.31 C ATOM 2234 C ALA I 46 34.421 32.646 9.516 1.00 20.06 C ATOM 2235 O ALA I 46 33.174 32.634 9.381 1.00 18.92 O ATOM 2236 CB ALA I 46 35.564 30.950 8.050 1.00 19.41 C ATOM 2237 N GLN I 47 35.135 33.765 9.655 1.00 19.09 N ATOM 2238 CA GLN I 47 34.532 35.084 9.556 1.00 20.62 C ATOM 2239 C GLN I 47 34.805 35.587 8.165 1.00 20.30 C ATOM 2240 O GLN I 47 35.940 35.983 7.837 1.00 21.08 O ATOM 2241 CB GLN I 47 35.126 36.011 10.635 1.00 21.57 C ATOM 2242 CG AGLN I 47 35.004 35.421 12.031 0.50 22.91 C ATOM 2243 CG BGLN I 47 34.485 35.828 12.023 0.50 24.81 C ATOM 2244 CD AGLN I 47 33.553 35.144 12.401 0.50 26.30 C ATOM 2245 CD BGLN I 47 35.450 36.111 13.178 0.50 29.44 C ATOM 2246 OE1AGLN I 47 32.764 36.073 12.555 0.50 26.43 O ATOM 2247 OE1BGLN I 47 35.308 35.549 14.286 0.50 30.64 O ATOM 2248 NE2AGLN I 47 33.197 33.866 12.511 0.50 28.06 N ATOM 2249 NE2BGLN I 47 36.438 36.969 12.925 0.50 29.66 N ATOM 2250 N ILE I 48 33.786 35.512 7.305 1.00 18.87 N ATOM 2251 CA ILE I 48 33.992 35.819 5.894 1.00 19.12 C ATOM 2252 C ILE I 48 33.601 37.250 5.595 1.00 19.94 C ATOM 2253 O ILE I 48 32.503 37.671 5.949 1.00 21.48 O ATOM 2254 CB ILE I 48 33.204 34.823 4.989 1.00 19.37 C ATOM 2255 CG1 ILE I 48 33.801 33.416 5.159 1.00 18.76 C ATOM 2256 CG2 ILE I 48 33.242 35.287 3.503 1.00 19.44 C ATOM 2257 CD1 ILE I 48 32.975 32.275 4.462 1.00 21.47 C ATOM 2258 N ILE I 49 34.485 38.002 4.941 1.00 19.59 N ATOM 2259 CA ILE I 49 34.122 39.361 4.530 1.00 20.75 C ATOM 2260 C ILE I 49 34.353 39.498 3.046 1.00 18.96 C ATOM 2261 O ILE I 49 35.418 39.142 2.547 1.00 19.01 O ATOM 2262 CB ILE I 49 34.914 40.468 5.335 1.00 21.21 C ATOM 2263 CG1AILE I 49 34.235 41.825 5.099 0.50 22.83 C ATOM 2264 CG1BILE I 49 34.602 40.387 6.841 0.50 22.93 C ATOM 2265 CG2AILE I 49 36.357 40.482 4.988 0.50 20.71 C ATOM 2266 CG2BILE I 49 34.649 41.856 4.743 0.50 22.89 C ATOM 2267 CD1AILE I 49 34.293 42.757 6.294 0.50 25.14 C ATOM 2268 CD1BILE I 49 35.645 39.694 7.644 0.50 23.96 C ATOM 2269 N VAL I 50 33.348 39.982 2.342 1.00 19.14 N ATOM 2270 CA VAL I 50 33.439 40.164 0.907 1.00 19.66 C ATOM 2271 C VAL I 50 33.838 41.614 0.581 1.00 21.26 C ATOM 2272 O VAL I 50 33.212 42.556 1.060 1.00 20.99 O ATOM 2273 CB VAL I 50 32.112 39.797 0.234 1.00 20.01 C ATOM 2274 CG1 VAL I 50 32.156 40.045 -1.253 1.00 20.94 C ATOM 2275 CG2 VAL I 50 31.748 38.314 0.562 1.00 20.05 C ATOM 2276 N LEU I 51 34.867 41.767 -0.238 1.00 21.33 N ATOM 2277 CA LEU I 51 35.423 43.081 -0.579 1.00 21.61 C ATOM 2278 C LEU I 51 35.679 43.143 -2.082 1.00 21.76 C ATOM 2279 O LEU I 51 35.936 42.118 -2.745 1.00 20.62 O ATOM 2280 CB LEU I 51 36.754 43.305 0.192 1.00 21.87 C ATOM 2281 CG LEU I 51 36.728 43.216 1.739 1.00 24.33 C ATOM 2282 CD1 LEU I 51 38.146 43.211 2.322 1.00 24.16 C ATOM 2283 CD2 LEU I 51 35.915 44.381 2.350 1.00 26.69 C ATOM 2284 N PRO I 52 35.639 44.342 -2.670 1.00 22.77 N ATOM 2285 CA PRO I 52 35.956 44.459 -4.097 1.00 22.82 C ATOM 2286 C PRO I 52 37.425 44.172 -4.367 1.00 22.58 C ATOM 2287 O PRO I 52 38.282 44.640 -3.602 1.00 23.95 O ATOM 2288 CB PRO I 52 35.642 45.934 -4.429 1.00 23.47 C ATOM 2289 CG PRO I 52 34.876 46.455 -3.256 1.00 24.43 C ATOM 2290 CD PRO I 52 35.302 45.639 -2.043 1.00 24.12 C ATOM 2291 N VAL I 53 37.728 43.465 -5.447 1.00 22.50 N ATOM 2292 CA VAL I 53 39.102 43.215 -5.817 1.00 23.94 C ATOM 2293 C VAL I 53 39.711 44.600 -6.180 1.00 24.13 C ATOM 2294 O VAL I 53 38.983 45.482 -6.616 1.00 24.40 O ATOM 2295 CB VAL I 53 39.195 42.218 -6.988 1.00 24.87 C ATOM 2296 CG1 VAL I 53 38.687 42.831 -8.288 1.00 23.81 C ATOM 2297 CG2 VAL I 53 40.643 41.635 -7.140 1.00 25.27 C ATOM 2298 N GLY I 54 41.001 44.792 -5.927 1.00 25.58 N ATOM 2299 CA GLY I 54 41.643 46.069 -6.210 1.00 25.68 C ATOM 2300 C GLY I 54 41.398 47.137 -5.144 1.00 27.05 C ATOM 2301 O GLY I 54 41.534 48.349 -5.424 1.00 28.09 O ATOM 2302 N THR I 55 40.992 46.727 -3.942 1.00 24.84 N ATOM 2303 CA THR I 55 40.952 47.710 -2.838 1.00 23.96 C ATOM 2304 C THR I 55 42.176 47.472 -1.989 1.00 22.85 C ATOM 2305 O THR I 55 42.839 46.451 -2.122 1.00 22.25 O ATOM 2306 CB THR I 55 39.710 47.605 -1.978 1.00 24.84 C ATOM 2307 OG1 THR I 55 39.519 46.242 -1.599 1.00 25.98 O ATOM 2308 CG2 THR I 55 38.489 47.949 -2.795 1.00 25.63 C ATOM 2309 N ILE I 56 42.466 48.437 -1.123 1.00 21.30 N ATOM 2310 CA ILE I 56 43.576 48.334 -0.191 1.00 20.80 C ATOM 2311 C ILE I 56 42.942 47.937 1.146 1.00 18.99 C ATOM 2312 O ILE I 56 41.855 48.399 1.452 1.00 18.42 O ATOM 2313 CB ILE I 56 44.290 49.724 -0.111 1.00 21.36 C ATOM 2314 CG1 ILE I 56 45.025 50.001 -1.446 1.00 24.24 C ATOM 2315 CG2 ILE I 56 45.139 49.822 1.210 1.00 21.23 C ATOM 2316 CD1AILE I 56 45.980 51.208 -1.499 0.50 23.95 C ATOM 2317 CD1BILE I 56 46.420 49.391 -1.580 0.50 21.27 C ATOM 2318 N VAL I 57 43.618 47.082 1.924 1.00 18.12 N ATOM 2319 CA VAL I 57 43.037 46.614 3.188 1.00 18.27 C ATOM 2320 C VAL I 57 44.054 46.642 4.317 1.00 17.74 C ATOM 2321 O VAL I 57 45.272 46.664 4.078 1.00 18.58 O ATOM 2322 CB VAL I 57 42.503 45.135 3.065 1.00 18.92 C ATOM 2323 CG1 VAL I 57 41.320 45.071 1.989 1.00 19.14 C ATOM 2324 CG2 VAL I 57 43.646 44.160 2.698 1.00 17.78 C ATOM 2325 N THR I 58 43.553 46.593 5.536 1.00 17.68 N ATOM 2326 CA THR I 58 44.435 46.512 6.736 1.00 17.91 C ATOM 2327 C THR I 58 45.371 45.320 6.694 1.00 19.72 C ATOM 2328 O THR I 58 45.005 44.235 6.185 1.00 19.40 O ATOM 2329 CB THR I 58 43.580 46.442 8.031 1.00 18.97 C ATOM 2330 OG1 THR I 58 42.682 45.297 7.961 1.00 20.24 O ATOM 2331 CG2 THR I 58 42.707 47.672 8.183 1.00 17.83 C ATOM 2332 N GLY I 59 46.601 45.501 7.205 1.00 17.30 N ATOM 2333 CA GLY I 59 47.601 44.452 7.215 1.00 18.44 C ATOM 2334 C GLY I 59 47.721 43.632 8.502 1.00 17.83 C ATOM 2335 O GLY I 59 48.809 43.132 8.827 1.00 17.68 O ATOM 2336 N GLU I 60 46.634 43.475 9.241 1.00 17.44 N ATOM 2337 CA GLU I 60 46.656 42.587 10.406 1.00 17.18 C ATOM 2338 C GLU I 60 46.309 41.129 10.017 1.00 17.51 C ATOM 2339 O GLU I 60 45.692 40.867 8.953 1.00 17.45 O ATOM 2340 CB GLU I 60 45.803 43.120 11.559 1.00 17.41 C ATOM 2341 CG GLU I 60 44.337 42.654 11.660 1.00 18.98 C ATOM 2342 CD GLU I 60 43.398 43.256 10.604 1.00 18.01 C ATOM 2343 OE1 GLU I 60 43.855 43.519 9.477 1.00 20.84 O ATOM 2344 OE2 GLU I 60 42.192 43.459 10.871 1.00 20.66 O ATOM 2345 N TYR I 61 46.781 40.202 10.837 1.00 17.24 N ATOM 2346 CA TYR I 61 46.591 38.760 10.579 1.00 18.30 C ATOM 2347 C TYR I 61 45.572 38.177 11.552 1.00 20.17 C ATOM 2348 O TYR I 61 45.773 38.214 12.783 1.00 19.61 O ATOM 2349 CB TYR I 61 47.929 38.043 10.652 1.00 19.34 C ATOM 2350 CG TYR I 61 47.855 36.579 10.260 1.00 23.19 C ATOM 2351 CD1 TYR I 61 47.749 36.222 8.921 1.00 25.89 C ATOM 2352 CD2 TYR I 61 47.884 35.577 11.228 1.00 29.32 C ATOM 2353 CE1 TYR I 61 47.692 34.879 8.534 1.00 31.46 C ATOM 2354 CE2 TYR I 61 47.819 34.213 10.845 1.00 33.20 C ATOM 2355 CZ TYR I 61 47.716 33.890 9.504 1.00 35.21 C ATOM 2356 OH TYR I 61 47.643 32.562 9.101 1.00 39.73 O ATOM 2357 N ARG I 62 44.457 37.679 11.006 1.00 19.61 N ATOM 2358 CA ARG I 62 43.358 37.163 11.806 1.00 21.11 C ATOM 2359 C ARG I 62 43.166 35.718 11.330 1.00 21.96 C ATOM 2360 O ARG I 62 42.740 35.486 10.177 1.00 20.16 O ATOM 2361 CB ARG I 62 42.093 37.962 11.545 1.00 21.74 C ATOM 2362 CG AARG I 62 42.145 39.361 12.083 0.50 21.78 C ATOM 2363 CG BARG I 62 41.997 39.359 12.253 0.50 22.15 C ATOM 2364 CD AARG I 62 41.712 39.409 13.508 0.50 22.68 C ATOM 2365 CD BARG I 62 40.611 40.073 12.125 0.50 22.71 C ATOM 2366 NE AARG I 62 40.511 38.617 13.748 0.50 25.61 N ATOM 2367 NE BARG I 62 40.587 41.432 12.693 0.50 27.79 N ATOM 2368 CZ AARG I 62 39.270 39.019 13.507 0.50 26.10 C ATOM 2369 CZ BARG I 62 40.018 41.767 13.853 0.50 29.45 C ATOM 2370 NH1AARG I 62 39.030 40.221 12.979 0.50 26.89 N ATOM 2371 NH1BARG I 62 39.426 40.840 14.600 0.50 30.36 N ATOM 2372 NH2AARG I 62 38.261 38.214 13.806 0.50 25.25 N ATOM 2373 NH2BARG I 62 40.064 43.030 14.287 0.50 28.62 N ATOM 2374 N ILE I 63 43.503 34.763 12.198 1.00 22.32 N ATOM 2375 CA ILE I 63 43.467 33.355 11.835 1.00 24.52 C ATOM 2376 C ILE I 63 42.004 32.878 11.594 1.00 23.12 C ATOM 2377 O ILE I 63 41.782 31.872 10.913 1.00 24.79 O ATOM 2378 CB ILE I 63 44.209 32.489 12.952 1.00 25.56 C ATOM 2379 CG1 ILE I 63 44.419 31.041 12.483 1.00 30.76 C ATOM 2380 CG2 ILE I 63 43.445 32.558 14.253 1.00 27.31 C ATOM 2381 CD1 ILE I 63 45.565 30.287 13.244 1.00 34.35 C ATOM 2382 N ASP I 64 41.029 33.616 12.104 1.00 23.15 N ATOM 2383 CA ASP I 64 39.615 33.254 11.978 1.00 23.38 C ATOM 2384 C ASP I 64 38.954 33.824 10.700 1.00 22.62 C ATOM 2385 O ASP I 64 37.815 33.452 10.348 1.00 23.14 O ATOM 2386 CB ASP I 64 38.862 33.762 13.198 1.00 24.40 C ATOM 2387 CG AASP I 64 39.052 35.268 13.395 0.50 24.74 C ATOM 2388 CG BASP I 64 39.280 33.075 14.493 0.50 27.06 C ATOM 2389 OD1AASP I 64 40.193 35.735 13.692 0.50 25.46 O ATOM 2390 OD1BASP I 64 39.299 31.823 14.517 0.50 32.88 O ATOM 2391 OD2AASP I 64 38.116 36.054 13.226 0.50 25.38 O ATOM 2392 OD2BASP I 64 39.581 33.694 15.550 0.50 29.42 O ATOM 2393 N ARG I 65 39.654 34.726 10.010 1.00 20.18 N ATOM 2394 CA ARG I 65 39.077 35.482 8.886 1.00 18.58 C ATOM 2395 C ARG I 65 39.458 34.907 7.528 1.00 17.94 C ATOM 2396 O ARG I 65 40.592 34.451 7.318 1.00 19.00 O ATOM 2397 CB ARG I 65 39.593 36.933 8.937 1.00 18.72 C ATOM 2398 CG ARG I 65 39.037 37.839 7.819 1.00 16.89 C ATOM 2399 CD ARG I 65 39.371 39.327 8.119 1.00 17.01 C ATOM 2400 NE ARG I 65 40.845 39.477 8.114 1.00 16.53 N ATOM 2401 CZ ARG I 65 41.465 40.594 8.554 1.00 17.18 C ATOM 2402 NH1 ARG I 65 40.730 41.625 8.977 1.00 17.99 N ATOM 2403 NH2 ARG I 65 42.796 40.663 8.515 1.00 19.43 N ATOM 2404 N VAL I 66 38.493 34.945 6.600 1.00 17.50 N ATOM 2405 CA VAL I 66 38.757 34.749 5.183 1.00 17.27 C ATOM 2406 C VAL I 66 38.148 35.884 4.390 1.00 17.35 C ATOM 2407 O VAL I 66 36.929 36.023 4.308 1.00 17.73 O ATOM 2408 CB VAL I 66 38.243 33.381 4.628 1.00 18.22 C ATOM 2409 CG1 VAL I 66 38.711 33.223 3.200 1.00 17.15 C ATOM 2410 CG2 VAL I 66 38.779 32.199 5.488 1.00 16.41 C ATOM 2411 N ARG I 67 38.999 36.742 3.829 1.00 17.41 N ATOM 2412 CA ARG I 67 38.497 37.779 2.945 1.00 16.59 C ATOM 2413 C ARG I 67 38.258 37.177 1.557 1.00 17.62 C ATOM 2414 O ARG I 67 39.102 36.420 1.038 1.00 18.54 O ATOM 2415 CB ARG I 67 39.534 38.905 2.827 1.00 17.94 C ATOM 2416 CG ARG I 67 39.695 39.717 4.101 1.00 18.80 C ATOM 2417 CD ARG I 67 40.805 40.758 3.954 1.00 24.48 C ATOM 2418 NE ARG I 67 40.691 41.812 4.944 1.00 26.37 N ATOM 2419 CZ ARG I 67 41.753 42.445 5.474 1.00 27.76 C ATOM 2420 NH1 ARG I 67 42.975 42.102 5.134 1.00 29.54 N ATOM 2421 NH2 ARG I 67 41.562 43.413 6.327 1.00 27.80 N ATOM 2422 N LEU I 68 37.126 37.539 0.937 1.00 16.86 N ATOM 2423 CA LEU I 68 36.855 37.132 -0.450 1.00 17.39 C ATOM 2424 C LEU I 68 36.823 38.375 -1.337 1.00 17.03 C ATOM 2425 O LEU I 68 35.978 39.245 -1.133 1.00 18.14 O ATOM 2426 CB LEU I 68 35.491 36.421 -0.541 1.00 16.81 C ATOM 2427 CG LEU I 68 35.415 35.095 0.202 1.00 18.52 C ATOM 2428 CD1 LEU I 68 33.971 34.529 0.087 1.00 17.30 C ATOM 2429 CD2 LEU I 68 36.476 34.093 -0.348 1.00 18.28 C ATOM 2430 N PHE I 69 37.754 38.439 -2.278 1.00 16.52 N ATOM 2431 CA PHE I 69 37.869 39.565 -3.205 1.00 17.74 C ATOM 2432 C PHE I 69 37.148 39.238 -4.495 1.00 17.28 C ATOM 2433 O PHE I 69 37.531 38.301 -5.181 1.00 17.78 O ATOM 2434 CB PHE I 69 39.353 39.872 -3.472 1.00 17.54 C ATOM 2435 CG PHE I 69 40.029 40.499 -2.267 1.00 19.26 C ATOM 2436 CD1 PHE I 69 39.891 41.868 -2.009 1.00 21.41 C ATOM 2437 CD2 PHE I 69 40.709 39.718 -1.362 1.00 20.94 C ATOM 2438 CE1 PHE I 69 40.491 42.458 -0.841 1.00 20.38 C ATOM 2439 CE2 PHE I 69 41.318 40.299 -0.205 1.00 20.06 C ATOM 2440 CZ PHE I 69 41.190 41.651 0.046 1.00 18.94 C ATOM 2441 N VAL I 70 36.097 40.011 -4.785 1.00 17.67 N ATOM 2442 CA VAL I 70 35.267 39.757 -5.960 1.00 19.12 C ATOM 2443 C VAL I 70 35.407 40.799 -7.048 1.00 20.11 C ATOM 2444 O VAL I 70 35.682 41.975 -6.775 1.00 20.31 O ATOM 2445 CB VAL I 70 33.761 39.644 -5.573 1.00 19.07 C ATOM 2446 CG1 VAL I 70 33.558 38.359 -4.682 1.00 18.82 C ATOM 2447 CG2 VAL I 70 33.302 40.851 -4.782 1.00 20.67 C ATOM 2448 N ASP I 71 35.205 40.355 -8.278 1.00 20.75 N ATOM 2449 CA ASP I 71 35.151 41.299 -9.394 1.00 21.75 C ATOM 2450 C ASP I 71 33.762 41.932 -9.470 1.00 22.38 C ATOM 2451 O ASP I 71 32.960 41.731 -8.563 1.00 23.01 O ATOM 2452 CB ASP I 71 35.644 40.646 -10.669 1.00 21.84 C ATOM 2453 CG ASP I 71 34.725 39.515 -11.166 1.00 22.73 C ATOM 2454 OD1 ASP I 71 33.530 39.466 -10.785 1.00 21.77 O ATOM 2455 OD2 ASP I 71 35.168 38.638 -11.924 1.00 27.18 O ATOM 2456 N ARG I 72 33.510 42.782 -10.485 1.00 24.45 N ATOM 2457 CA ARG I 72 32.261 43.535 -10.535 1.00 25.84 C ATOM 2458 C ARG I 72 31.055 42.626 -10.849 1.00 25.28 C ATOM 2459 O ARG I 72 29.924 43.101 -10.723 1.00 25.42 O ATOM 2460 CB ARG I 72 32.329 44.659 -11.593 1.00 27.27 C ATOM 2461 CG ARG I 72 32.429 44.083 -12.985 1.00 32.75 C ATOM 2462 CD ARG I 72 32.689 45.057 -14.163 1.00 42.44 C ATOM 2463 NE ARG I 72 33.094 44.243 -15.312 1.00 48.11 N ATOM 2464 CZ ARG I 72 32.255 43.718 -16.216 1.00 50.31 C ATOM 2465 NH1 ARG I 72 30.942 43.961 -16.152 1.00 50.85 N ATOM 2466 NH2 ARG I 72 32.740 42.965 -17.203 1.00 50.32 N ATOM 2467 N LEU I 73 31.312 41.360 -11.241 1.00 23.25 N ATOM 2468 CA LEU I 73 30.250 40.358 -11.498 1.00 22.55 C ATOM 2469 C LEU I 73 29.960 39.500 -10.268 1.00 22.12 C ATOM 2470 O LEU I 73 29.075 38.647 -10.336 1.00 21.97 O ATOM 2471 CB LEU I 73 30.633 39.446 -12.662 1.00 21.90 C ATOM 2472 CG LEU I 73 30.987 40.122 -14.008 1.00 25.51 C ATOM 2473 CD1 LEU I 73 31.326 39.138 -15.110 1.00 24.74 C ATOM 2474 CD2 LEU I 73 29.839 41.062 -14.406 1.00 25.16 C ATOM 2475 N ASP I 74 30.657 39.754 -9.148 1.00 19.92 N ATOM 2476 CA ASP I 74 30.549 38.953 -7.907 1.00 20.00 C ATOM 2477 C ASP I 74 31.145 37.537 -8.042 1.00 18.19 C ATOM 2478 O ASP I 74 30.664 36.588 -7.369 1.00 16.91 O ATOM 2479 CB ASP I 74 29.089 38.859 -7.380 1.00 19.58 C ATOM 2480 CG ASP I 74 28.898 39.503 -6.012 1.00 23.02 C ATOM 2481 OD1 ASP I 74 29.841 40.156 -5.511 1.00 27.13 O ATOM 2482 OD2 ASP I 74 27.817 39.462 -5.369 1.00 21.55 O ATOM 2483 N ASN I 75 32.158 37.387 -8.892 1.00 17.35 N ATOM 2484 CA ASN I 75 32.931 36.154 -8.953 1.00 17.95 C ATOM 2485 C ASN I 75 34.258 36.366 -8.219 1.00 17.42 C ATOM 2486 O ASN I 75 34.751 37.511 -8.146 1.00 17.88 O ATOM 2487 CB ASN I 75 33.189 35.740 -10.393 1.00 17.56 C ATOM 2488 CG ASN I 75 31.901 35.414 -11.131 1.00 17.95 C ATOM 2489 OD1 ASN I 75 30.974 34.853 -10.536 1.00 18.04 O ATOM 2490 ND2 ASN I 75 31.815 35.812 -12.413 1.00 17.05 N ATOM 2491 N ILE I 76 34.844 35.276 -7.701 1.00 16.78 N ATOM 2492 CA ILE I 76 36.119 35.388 -6.960 1.00 16.20 C ATOM 2493 C ILE I 76 37.243 35.734 -7.909 1.00 16.28 C ATOM 2494 O ILE I 76 37.420 35.070 -8.942 1.00 17.23 O ATOM 2495 CB ILE I 76 36.431 34.028 -6.233 1.00 16.35 C ATOM 2496 CG1 ILE I 76 35.286 33.678 -5.247 1.00 13.75 C ATOM 2497 CG2 ILE I 76 37.842 34.044 -5.581 1.00 15.89 C ATOM 2498 CD1 ILE I 76 35.056 34.718 -4.103 1.00 16.21 C ATOM 2499 N ALA I 77 38.022 36.765 -7.560 1.00 17.35 N ATOM 2500 CA ALA I 77 39.039 37.296 -8.474 1.00 19.04 C ATOM 2501 C ALA I 77 40.460 37.106 -7.962 1.00 20.85 C ATOM 2502 O ALA I 77 41.424 37.445 -8.682 1.00 22.66 O ATOM 2503 CB ALA I 77 38.780 38.805 -8.742 1.00 19.64 C ATOM 2504 N GLN I 78 40.597 36.544 -6.760 1.00 19.33 N ATOM 2505 CA GLN I 78 41.912 36.338 -6.124 1.00 21.07 C ATOM 2506 C GLN I 78 41.808 35.081 -5.235 1.00 20.00 C ATOM 2507 O GLN I 78 40.716 34.798 -4.709 1.00 19.68 O ATOM 2508 CB GLN I 78 42.157 37.579 -5.257 1.00 21.82 C ATOM 2509 CG GLN I 78 43.419 37.646 -4.482 1.00 28.05 C ATOM 2510 CD GLN I 78 43.567 39.044 -3.895 1.00 34.20 C ATOM 2511 OE1 GLN I 78 43.389 40.039 -4.617 1.00 33.51 O ATOM 2512 NE2 GLN I 78 43.829 39.126 -2.586 1.00 31.07 N ATOM 2513 N VAL I 79 42.916 34.350 -5.051 1.00 18.74 N ATOM 2514 CA VAL I 79 42.864 33.114 -4.258 1.00 19.36 C ATOM 2515 C VAL I 79 42.448 33.468 -2.829 1.00 18.70 C ATOM 2516 O VAL I 79 43.171 34.226 -2.137 1.00 19.31 O ATOM 2517 CB VAL I 79 44.263 32.415 -4.193 1.00 19.73 C ATOM 2518 CG1 VAL I 79 44.220 31.200 -3.305 1.00 18.95 C ATOM 2519 CG2 VAL I 79 44.725 31.992 -5.600 1.00 21.17 C ATOM 2520 N PRO I 80 41.336 32.918 -2.339 1.00 17.64 N ATOM 2521 CA PRO I 80 41.001 33.113 -0.917 1.00 17.17 C ATOM 2522 C PRO I 80 42.027 32.428 -0.001 1.00 17.57 C ATOM 2523 O PRO I 80 42.485 31.315 -0.265 1.00 16.77 O ATOM 2524 CB PRO I 80 39.633 32.412 -0.768 1.00 17.27 C ATOM 2525 CG PRO I 80 39.064 32.405 -2.211 1.00 16.88 C ATOM 2526 CD PRO I 80 40.302 32.129 -3.052 1.00 16.63 C ATOM 2527 N ARG I 81 42.332 33.100 1.095 1.00 18.53 N ATOM 2528 CA ARG I 81 43.266 32.549 2.093 1.00 19.35 C ATOM 2529 C ARG I 81 42.883 33.013 3.471 1.00 19.60 C ATOM 2530 O ARG I 81 42.275 34.073 3.659 1.00 19.62 O ATOM 2531 CB ARG I 81 44.699 32.987 1.781 1.00 21.69 C ATOM 2532 CG ARG I 81 44.898 34.516 1.853 1.00 27.94 C ATOM 2533 CD ARG I 81 46.324 35.015 1.506 1.00 38.57 C ATOM 2534 NE ARG I 81 47.396 34.321 2.229 1.00 43.04 N ATOM 2535 CZ ARG I 81 48.073 33.278 1.733 1.00 46.69 C ATOM 2536 NH1 ARG I 81 47.774 32.806 0.517 1.00 46.82 N ATOM 2537 NH2 ARG I 81 49.039 32.703 2.451 1.00 46.18 N ATOM 2538 N VAL I 82 43.222 32.207 4.464 1.00 18.28 N ATOM 2539 CA VAL I 82 43.001 32.646 5.850 1.00 18.70 C ATOM 2540 C VAL I 82 43.910 33.850 6.189 1.00 19.23 C ATOM 2541 O VAL I 82 45.067 33.865 5.782 1.00 19.67 O ATOM 2542 CB VAL I 82 43.359 31.489 6.765 1.00 19.43 C ATOM 2543 CG1 VAL I 82 43.472 31.937 8.210 1.00 22.25 C ATOM 2544 CG2 VAL I 82 42.328 30.353 6.594 1.00 18.92 C ATOM 2545 N GLY I 83 43.406 34.817 6.949 1.00 18.81 N ATOM 2546 CA GLY I 83 44.268 35.906 7.403 1.00 20.52 C ATOM 2547 C GLY I 83 43.540 37.212 7.538 1.00 20.90 C ATOM 2548 O GLY I 83 44.081 38.126 8.199 1.00 21.43 O ATOM 2549 OXT GLY I 83 42.396 37.358 7.022 1.00 20.16 O TER 2550 GLY I 83 HETATM 2551 CA CA E 450 50.554 54.912 28.922 1.00 17.79 CA HETATM 2552 NA NA E 451 59.844 49.333 -0.497 1.00 19.90 NA HETATM 2553 C1 CIT E 452 74.191 68.295 9.218 1.00 20.42 C HETATM 2554 O1 CIT E 452 75.326 67.805 9.120 1.00 18.28 O HETATM 2555 O2 CIT E 452 73.605 68.785 8.202 1.00 23.58 O HETATM 2556 C2 CIT E 452 73.519 68.281 10.579 1.00 16.36 C HETATM 2557 C3 CIT E 452 74.220 67.446 11.703 1.00 19.77 C HETATM 2558 O7 CIT E 452 75.697 67.712 12.194 1.00 16.39 O HETATM 2559 C4 CIT E 452 73.029 67.292 12.722 1.00 17.38 C HETATM 2560 C5 CIT E 452 73.082 66.089 13.681 1.00 18.62 C HETATM 2561 O3 CIT E 452 74.173 65.537 13.853 1.00 18.23 O HETATM 2562 O4 CIT E 452 72.053 65.647 14.267 1.00 16.41 O HETATM 2563 C6 CIT E 452 74.589 66.189 11.184 1.00 24.86 C HETATM 2564 O5 CIT E 452 75.856 65.920 11.329 1.00 15.17 O HETATM 2565 O6 CIT E 452 73.634 65.576 10.661 1.00 17.39 O HETATM 2566 C1 CIT E 453 74.405 62.795 7.050 1.00 39.81 C HETATM 2567 O1 CIT E 453 75.122 62.141 6.241 1.00 40.61 O HETATM 2568 O2 CIT E 453 73.785 63.808 6.608 1.00 37.67 O HETATM 2569 C2 CIT E 453 74.251 62.341 8.512 1.00 35.92 C HETATM 2570 C3 CIT E 453 75.435 62.683 9.434 1.00 33.03 C HETATM 2571 O7 CIT E 453 75.421 61.944 10.710 1.00 30.48 O HETATM 2572 C4 CIT E 453 76.749 62.990 8.693 1.00 27.41 C HETATM 2573 C5 CIT E 453 77.813 63.683 9.567 1.00 33.46 C HETATM 2574 O3 CIT E 453 78.041 63.410 10.784 1.00 27.64 O HETATM 2575 O4 CIT E 453 78.504 64.592 9.032 1.00 34.17 O HETATM 2576 C6 CIT E 453 75.165 63.913 10.114 1.00 32.91 C HETATM 2577 O5 CIT E 453 74.932 63.780 11.358 1.00 19.73 O HETATM 2578 O6 CIT E 453 75.242 64.944 9.403 1.00 23.10 O HETATM 2579 C13 1PE E 454 60.767 58.076 30.211 1.00 21.66 C HETATM 2580 OH4 1PE E 454 60.823 59.504 30.135 1.00 20.50 O HETATM 2581 C14 1PE E 454 61.707 61.192 28.685 1.00 21.17 C HETATM 2582 C24 1PE E 454 61.066 59.808 28.757 1.00 19.23 C HETATM 2583 OH5 1PE E 454 60.707 62.148 29.040 1.00 23.67 O HETATM 2584 C15 1PE E 454 60.359 64.465 29.701 1.00 35.18 C HETATM 2585 C25 1PE E 454 61.367 63.432 29.190 1.00 29.03 C HETATM 2586 OH6 1PE E 454 59.275 64.599 28.753 1.00 41.97 O HETATM 2587 C16 1PE E 454 58.330 65.785 26.809 1.00 47.36 C HETATM 2588 C26 1PE E 454 59.567 65.484 27.655 1.00 44.98 C HETATM 2589 OH7 1PE E 454 57.218 65.988 27.677 1.00 49.78 O HETATM 2590 OH2 1PE E 455 61.465 69.930 1.735 1.00 55.29 O HETATM 2591 C12 1PE E 455 61.295 70.762 0.579 1.00 54.93 C HETATM 2592 C22 1PE E 455 59.976 70.422 -0.107 1.00 52.39 C HETATM 2593 OH3 1PE E 455 58.946 70.534 0.878 1.00 51.11 O HETATM 2594 C13 1PE E 455 56.633 70.485 1.423 1.00 45.32 C HETATM 2595 C23 1PE E 455 57.648 70.736 0.320 1.00 47.72 C HETATM 2596 OH4 1PE E 455 56.956 69.265 2.090 1.00 40.20 O HETATM 2597 C14 1PE E 455 56.306 67.562 3.644 1.00 38.38 C HETATM 2598 C24 1PE E 455 55.888 68.824 2.918 1.00 39.61 C HETATM 2599 OH5 1PE E 455 57.263 67.937 4.619 1.00 35.49 O HETATM 2600 C15 1PE E 455 58.993 67.338 6.124 1.00 36.78 C HETATM 2601 C25 1PE E 455 57.965 66.819 5.148 1.00 36.29 C HETATM 2602 OH6 1PE E 455 60.189 67.619 5.416 1.00 38.32 O HETATM 2603 C16 1PE E 455 61.866 69.349 5.758 1.00 47.45 C HETATM 2604 C26 1PE E 455 61.198 68.086 6.311 1.00 42.36 C HETATM 2605 OH7 1PE E 455 61.973 69.269 4.327 1.00 49.25 O HETATM 2606 OH3 1PE E 456 40.299 68.363 12.450 1.00 50.31 O HETATM 2607 C13 1PE E 456 41.539 69.431 14.247 1.00 50.48 C HETATM 2608 C23 1PE E 456 40.186 69.282 13.539 1.00 51.24 C HETATM 2609 OH4 1PE E 456 41.694 68.407 15.241 1.00 50.78 O HETATM 2610 C14 1PE E 456 42.474 67.603 17.418 1.00 47.77 C HETATM 2611 C24 1PE E 456 42.303 68.808 16.485 1.00 50.28 C HETATM 2612 OH5 1PE E 456 41.190 67.058 17.673 1.00 48.14 O HETATM 2613 C15 1PE E 456 39.735 65.209 18.078 1.00 49.96 C HETATM 2614 C25 1PE E 456 41.179 65.684 18.020 1.00 48.75 C HETATM 2615 OH6 1PE E 456 39.074 65.696 19.251 1.00 53.37 O HETATM 2616 C16 1PE E 456 36.893 65.874 20.282 1.00 53.98 C HETATM 2617 C26 1PE E 456 37.707 66.051 19.003 1.00 53.91 C HETATM 2618 O HOH E 457 52.902 42.938 23.410 1.00 13.24 O HETATM 2619 O HOH E 458 50.117 47.908 16.211 1.00 13.33 O HETATM 2620 O HOH E 459 52.526 48.407 21.053 1.00 12.77 O HETATM 2621 O HOH E 460 54.877 44.253 21.907 1.00 13.80 O HETATM 2622 O HOH E 461 49.777 63.882 19.609 1.00 17.95 O HETATM 2623 O HOH E 462 61.435 64.175 22.433 1.00 14.11 O HETATM 2624 O HOH E 463 48.522 52.754 9.180 1.00 15.11 O HETATM 2625 O HOH E 464 66.849 45.932 18.509 1.00 14.07 O HETATM 2626 O HOH E 465 67.911 49.921 13.154 1.00 14.16 O HETATM 2627 O HOH E 466 60.892 63.393 7.661 1.00 17.41 O HETATM 2628 O HOH E 467 52.506 50.676 22.602 1.00 13.49 O HETATM 2629 O HOH E 468 49.441 59.921 21.722 1.00 15.43 O HETATM 2630 O HOH E 469 53.488 61.052 26.418 1.00 14.85 O HETATM 2631 O HOH E 470 66.727 49.876 25.470 1.00 17.17 O HETATM 2632 O HOH E 471 58.941 45.332 27.937 1.00 18.56 O HETATM 2633 O HOH E 472 71.597 46.290 15.981 1.00 15.52 O HETATM 2634 O HOH E 473 54.915 46.907 21.126 1.00 12.84 O HETATM 2635 O HOH E 474 51.653 61.795 21.851 1.00 16.63 O HETATM 2636 O HOH E 475 68.738 43.986 18.548 1.00 18.42 O HETATM 2637 O HOH E 476 61.109 53.701 28.488 1.00 16.72 O HETATM 2638 O HOH E 477 54.693 66.519 19.634 1.00 17.91 O HETATM 2639 O HOH E 478 42.980 53.069 30.258 1.00 17.77 O HETATM 2640 O HOH E 479 43.952 56.504 10.950 1.00 16.05 O HETATM 2641 O HOH E 480 56.405 46.855 31.710 1.00 17.08 O HETATM 2642 O HOH E 481 71.016 51.796 3.817 1.00 17.03 O HETATM 2643 O HOH E 482 60.408 55.983 3.000 1.00 19.67 O HETATM 2644 O HOH E 483 67.803 63.942 1.256 1.00 18.25 O HETATM 2645 O HOH E 484 69.982 67.468 14.292 1.00 20.33 O HETATM 2646 O HOH E 485 52.137 47.665 1.887 1.00 19.09 O HETATM 2647 O HOH E 486 54.086 42.601 25.966 1.00 20.36 O HETATM 2648 O HOH E 487 62.326 57.600 4.309 1.00 19.69 O HETATM 2649 O HOH E 488 61.368 48.147 1.174 1.00 17.96 O HETATM 2650 O HOH E 489 42.948 51.185 32.109 1.00 20.69 O HETATM 2651 O HOH E 490 64.761 60.355 0.524 1.00 22.15 O HETATM 2652 O HOH E 491 62.818 56.494 0.545 1.00 23.30 O HETATM 2653 O HOH E 492 71.263 56.592 20.560 1.00 19.53 O HETATM 2654 O HOH E 493 36.631 44.225 27.178 1.00 20.39 O HETATM 2655 O HOH E 494 74.690 55.621 8.062 1.00 21.64 O HETATM 2656 O HOH E 495 40.347 43.986 24.542 1.00 21.33 O HETATM 2657 O HOH E 496 70.593 41.906 4.822 1.00 24.46 O HETATM 2658 O HOH E 497 36.736 53.110 10.767 1.00 23.42 O HETATM 2659 O HOH E 498 66.408 54.298 32.705 1.00 21.85 O HETATM 2660 O HOH E 499 56.330 61.275 26.422 1.00 22.84 O HETATM 2661 O HOH E 500 56.245 49.070 33.373 1.00 18.27 O HETATM 2662 O HOH E 501 75.287 52.552 15.572 1.00 24.05 O HETATM 2663 O HOH E 502 68.763 39.692 8.158 1.00 22.14 O HETATM 2664 O HOH E 503 51.280 44.932 1.714 1.00 27.14 O HETATM 2665 O HOH E 504 49.563 67.318 -1.460 1.00 24.92 O HETATM 2666 O HOH E 505 68.334 56.083 2.428 1.00 20.98 O HETATM 2667 O HOH E 506 71.849 53.968 2.504 1.00 24.41 O HETATM 2668 O HOH E 507 63.333 65.245 5.304 1.00 14.94 O HETATM 2669 O HOH E 508 70.579 63.137 3.524 1.00 26.54 O HETATM 2670 O HOH E 509 59.375 54.024 -5.569 1.00 22.73 O HETATM 2671 O HOH E 510 55.504 61.732 -7.878 1.00 25.96 O HETATM 2672 O HOH E 511 73.453 39.631 13.545 1.00 23.90 O HETATM 2673 O HOH E 512 72.474 49.092 20.667 1.00 21.90 O HETATM 2674 O HOH E 513 38.385 55.256 24.127 1.00 23.35 O HETATM 2675 O HOH E 514 36.301 55.272 17.875 1.00 22.67 O HETATM 2676 O HOH E 515 64.033 58.320 2.101 1.00 23.45 O HETATM 2677 O HOH E 516 72.263 65.041 4.353 1.00 26.77 O HETATM 2678 O HOH E 517 68.086 53.440 1.725 1.00 25.49 O HETATM 2679 O HOH E 518 37.504 57.576 27.302 1.00 27.51 O HETATM 2680 O HOH E 519 40.038 45.001 9.345 1.00 28.04 O HETATM 2681 O HOH E 520 53.179 47.499 34.929 1.00 25.06 O HETATM 2682 O HOH E 521 63.836 62.321 -1.098 1.00 28.23 O HETATM 2683 O HOH E 522 60.773 59.806 -4.385 1.00 24.78 O HETATM 2684 O HOH E 523 78.198 54.213 17.274 1.00 46.47 O HETATM 2685 O HOH E 524 48.269 58.599 34.185 1.00 27.85 O HETATM 2686 O HOH E 525 67.784 41.507 19.266 1.00 23.80 O HETATM 2687 O HOH E 526 59.151 37.781 6.289 1.00 21.49 O HETATM 2688 O HOH E 527 46.784 53.111 36.794 1.00 32.16 O HETATM 2689 O HOH E 528 46.403 37.853 3.872 1.00 43.01 O HETATM 2690 O HOH E 529 50.625 62.161 -6.221 1.00 28.85 O HETATM 2691 O HOH E 530 61.199 63.845 25.606 1.00 23.72 O HETATM 2692 O HOH E 531 65.432 41.880 1.262 1.00 29.48 O HETATM 2693 O HOH E 532 74.038 42.142 12.550 1.00 21.86 O HETATM 2694 O HOH E 533 58.353 33.208 -1.577 1.00 28.09 O HETATM 2695 O HOH E 534 46.128 50.746 33.004 1.00 29.65 O HETATM 2696 O HOH E 535 55.068 44.148 29.229 1.00 29.39 O HETATM 2697 O HOH E 536 70.492 55.301 26.804 1.00 37.91 O HETATM 2698 O HOH E 537 66.258 43.233 21.474 1.00 29.55 O HETATM 2699 O HOH E 538 61.509 42.665 24.796 1.00 28.51 O HETATM 2700 O HOH E 539 72.409 65.621 8.251 1.00 33.82 O HETATM 2701 O HOH E 540 47.927 60.828 30.242 1.00 28.41 O HETATM 2702 O HOH E 541 56.110 37.089 20.451 1.00 25.04 O HETATM 2703 O HOH E 542 69.494 49.095 24.919 1.00 28.22 O HETATM 2704 O HOH E 543 66.378 57.123 1.228 1.00 27.93 O HETATM 2705 O HOH E 544 51.787 45.331 27.677 0.50 17.47 O HETATM 2706 O HOH E 545 57.262 68.873 9.252 1.00 26.77 O HETATM 2707 O HOH E 546 63.826 56.567 31.239 1.00 22.21 O HETATM 2708 O HOH E 547 64.054 48.314 0.719 1.00 28.91 O HETATM 2709 O HOH E 548 47.297 55.024 -12.001 1.00 27.56 O HETATM 2710 O HOH E 549 67.381 50.730 27.953 1.00 29.06 O HETATM 2711 O HOH E 550 65.171 47.666 25.684 1.00 24.07 O HETATM 2712 O HOH E 551 40.268 54.456 -6.713 1.00 27.57 O HETATM 2713 O HOH E 552 35.738 44.564 24.516 1.00 26.01 O HETATM 2714 O HOH E 553 56.289 57.693 -9.717 1.00 30.07 O HETATM 2715 O HOH E 554 63.017 66.115 21.542 1.00 26.73 O HETATM 2716 O HOH E 555 44.689 68.664 11.554 1.00 25.94 O HETATM 2717 O HOH E 556 45.202 54.277 -8.582 1.00 27.71 O HETATM 2718 O HOH E 557 48.511 36.817 21.037 1.00 37.95 O HETATM 2719 O HOH E 558 49.128 60.349 -7.637 1.00 25.81 O HETATM 2720 O HOH E 559 51.625 64.264 23.535 1.00 33.40 O HETATM 2721 O HOH E 560 45.050 45.699 -4.764 1.00 44.91 O HETATM 2722 O HOH E 561 35.838 52.516 29.818 1.00 45.56 O HETATM 2723 O HOH E 562 72.048 60.594 4.449 1.00 33.16 O HETATM 2724 O HOH E 563 43.100 63.010 21.681 1.00 31.86 O HETATM 2725 O HOH E 564 66.462 49.848 1.207 1.00 31.90 O HETATM 2726 O HOH E 565 71.909 54.941 24.880 1.00 35.35 O HETATM 2727 O HOH E 566 64.583 64.103 0.904 1.00 32.16 O HETATM 2728 O HOH E 567 33.155 49.768 5.570 1.00 25.01 O HETATM 2729 O HOH E 568 38.561 60.491 -0.803 1.00 30.62 O HETATM 2730 O HOH E 569 57.826 55.514 31.523 1.00 18.86 O HETATM 2731 O HOH E 570 54.023 56.566 -11.093 1.00 26.12 O HETATM 2732 O HOH E 571 74.116 54.562 3.966 1.00 21.07 O HETATM 2733 O HOH E 572 65.098 45.749 0.541 1.00 36.01 O HETATM 2734 O HOH E 573 78.534 68.468 12.534 1.00 31.57 O HETATM 2735 O HOH E 574 35.240 55.617 22.000 1.00 35.59 O HETATM 2736 O HOH E 575 40.458 51.080 -5.579 1.00 30.17 O HETATM 2737 O HOH E 576 33.003 47.411 30.895 1.00 25.05 O HETATM 2738 O HOH E 577 58.813 45.779 30.844 1.00 25.13 O HETATM 2739 O HOH E 578 38.237 44.675 23.051 1.00 29.28 O HETATM 2740 O HOH E 579 37.945 65.392 7.376 1.00 27.87 O HETATM 2741 O HOH E 580 74.165 51.269 20.168 1.00 29.88 O HETATM 2742 O HOH E 581 75.785 51.218 17.856 1.00 32.04 O HETATM 2743 O HOH E 582 49.754 33.966 4.856 1.00 28.16 O HETATM 2744 O HOH E 583 35.198 62.116 4.336 1.00 30.82 O HETATM 2745 O HOH E 584 43.676 65.220 -0.026 1.00 33.63 O HETATM 2746 O HOH E 585 67.882 52.853 29.231 1.00 23.69 O HETATM 2747 O HOH E 586 32.241 52.395 5.815 1.00 33.12 O HETATM 2748 O HOH E 587 49.687 66.554 20.421 1.00 31.25 O HETATM 2749 O HOH E 588 38.750 43.476 6.294 1.00 37.52 O HETATM 2750 O HOH E 589 45.028 61.330 28.247 1.00 36.16 O HETATM 2751 O HOH E 590 36.028 57.966 19.065 1.00 32.17 O HETATM 2752 O HOH E 591 37.336 48.114 21.084 1.00 34.94 O HETATM 2753 O HOH E 592 60.900 48.077 -2.327 1.00 24.88 O HETATM 2754 O HOH E 593 44.972 70.162 3.902 1.00 32.27 O HETATM 2755 O HOH E 594 32.983 58.475 10.782 1.00 40.68 O HETATM 2756 O HOH E 595 52.550 50.323 -9.763 1.00 32.75 O HETATM 2757 O HOH E 596 66.816 32.514 6.770 1.00 39.49 O HETATM 2758 O HOH E 597 69.871 68.965 7.082 1.00 35.98 O HETATM 2759 O HOH E 598 35.442 65.224 7.228 1.00 30.77 O HETATM 2760 O HOH E 599 35.430 50.766 3.158 1.00 30.33 O HETATM 2761 O HOH E 600 76.558 59.163 18.635 1.00 34.65 O HETATM 2762 O HOH E 601 61.858 67.347 16.791 1.00 39.46 O HETATM 2763 O HOH E 602 35.229 46.456 31.052 1.00 38.64 O HETATM 2764 O HOH E 603 49.573 42.884 1.284 1.00 36.20 O HETATM 2765 O HOH E 604 61.804 48.348 28.822 1.00 23.28 O HETATM 2766 O HOH E 605 46.163 37.920 19.456 1.00 38.76 O HETATM 2767 O HOH E 606 49.215 41.678 -1.245 1.00 35.65 O HETATM 2768 O HOH E 607 32.617 55.206 1.987 1.00 31.20 O HETATM 2769 O HOH E 608 56.072 60.350 -10.113 1.00 31.85 O HETATM 2770 O HOH E 609 36.312 62.665 23.986 1.00 33.33 O HETATM 2771 O HOH E 610 30.887 48.392 7.159 1.00 41.19 O HETATM 2772 O HOH E 611 48.881 40.832 3.029 1.00 31.46 O HETATM 2773 O HOH E 612 52.091 39.458 24.257 1.00 38.25 O HETATM 2774 O HOH E 613 54.700 54.334 -12.523 1.00 36.21 O HETATM 2775 O HOH E 614 67.083 43.947 2.447 1.00 42.06 O HETATM 2776 O HOH E 615 69.966 43.146 2.502 1.00 37.47 O HETATM 2777 O HOH E 616 38.995 44.059 18.781 1.00 33.30 O HETATM 2778 O HOH E 617 62.338 67.957 -0.237 1.00 35.59 O HETATM 2779 O HOH E 618 61.271 65.775 9.335 1.00 27.51 O HETATM 2780 O HOH E 619 51.063 69.704 -1.248 1.00 36.22 O HETATM 2781 O HOH E 620 61.629 40.462 23.434 1.00 33.60 O HETATM 2782 O HOH E 621 57.772 40.710 -8.113 1.00 41.35 O HETATM 2783 O HOH E 622 52.019 62.006 28.631 1.00 38.61 O HETATM 2784 O HOH E 623 56.420 28.539 -0.409 1.00 40.34 O HETATM 2785 O HOH E 624 59.722 58.633 -8.950 1.00 37.81 O HETATM 2786 O HOH E 625 63.631 65.684 8.138 1.00 31.48 O HETATM 2787 O HOH E 626 54.358 61.005 -12.039 1.00 32.90 O HETATM 2788 O HOH E 627 51.007 68.324 18.871 1.00 37.61 O HETATM 2789 O HOH E 628 61.135 47.072 31.164 1.00 27.43 O HETATM 2790 O HOH E 629 57.800 68.478 12.930 1.00 32.65 O HETATM 2791 O HOH E 630 51.464 31.972 5.526 1.00 36.64 O HETATM 2792 O HOH E 631 60.514 40.912 -6.850 1.00 39.03 O HETATM 2793 O HOH E 632 49.542 39.499 25.222 1.00 41.55 O HETATM 2794 O HOH E 633 59.967 42.671 27.385 1.00 40.32 O HETATM 2795 O HOH E 634 33.466 52.861 3.187 1.00 29.86 O HETATM 2796 O HOH E 635 63.801 43.417 25.249 1.00 36.14 O HETATM 2797 O HOH E 636 51.379 40.421 -2.206 1.00 35.31 O HETATM 2798 O HOH E 637 33.816 47.627 0.933 1.00 37.00 O HETATM 2799 O HOH E 638 54.514 40.072 26.451 1.00 40.12 O HETATM 2800 O HOH E 639 71.074 37.517 3.057 1.00 36.72 O HETATM 2801 O HOH E 640 36.754 50.362 29.062 1.00 26.82 O HETATM 2802 O HOH E 641 56.562 30.441 6.399 1.00 31.08 O HETATM 2803 O HOH E 642 51.719 66.478 22.430 1.00 46.77 O HETATM 2804 O HOH E 643 55.989 33.037 17.890 1.00 38.46 O HETATM 2805 O HOH E 644 35.256 63.683 17.372 1.00 39.49 O HETATM 2806 O HOH E 645 80.350 52.752 13.144 1.00 47.40 O HETATM 2807 O HOH E 646 71.385 53.071 27.389 1.00 39.51 O HETATM 2808 O HOH E 647 46.342 60.808 -7.973 1.00 36.77 O HETATM 2809 O HOH E 648 62.212 67.069 11.958 1.00 37.46 O HETATM 2810 O HOH E 649 46.922 39.922 -1.309 1.00 46.84 O HETATM 2811 O HOH E 650 50.222 70.128 10.456 1.00 37.69 O HETATM 2812 O HOH E 651 52.933 58.398 -12.785 1.00 37.24 O HETATM 2813 O HOH E 652 49.690 60.757 -10.319 1.00 35.43 O HETATM 2814 O HOH E 653 55.225 34.329 20.356 1.00 40.15 O HETATM 2815 O HOH E 654 57.308 38.265 25.527 1.00 37.79 O HETATM 2816 O HOH E 655 47.460 69.939 10.058 1.00 41.31 O HETATM 2817 O HOH E 656 58.943 47.481 -6.810 1.00 35.01 O HETATM 2818 O HOH E 657 50.249 58.623 -12.026 1.00 34.00 O HETATM 2819 O HOH E 658 63.298 65.692 26.899 1.00 40.96 O HETATM 2820 O HOH E 659 48.506 52.285 -13.191 1.00 36.78 O HETATM 2821 O HOH E 660 72.504 42.432 18.882 1.00 35.56 O HETATM 2822 O HOH E 661 63.209 31.681 9.475 1.00 41.17 O HETATM 2823 O HOH E 662 53.767 52.103 -11.680 1.00 42.77 O HETATM 2824 O HOH E 663 61.326 67.953 14.212 1.00 37.37 O HETATM 2825 O HOH E 664 35.156 50.578 17.104 1.00 42.37 O HETATM 2826 O HOH E 665 51.376 33.641 -0.982 1.00 46.58 O HETATM 2827 O HOH E 666 66.664 34.105 13.693 1.00 42.10 O HETATM 2828 O HOH E 667 34.133 57.334 24.724 1.00 38.84 O HETATM 2829 O HOH E 668 48.464 70.413 14.110 1.00 36.93 O HETATM 2830 O HOH E 669 64.299 47.766 28.276 1.00 33.33 O HETATM 2831 O HOH E 670 45.146 62.678 25.892 1.00 42.41 O HETATM 2832 O HOH E 671 36.108 50.120 -0.214 1.00 42.63 O HETATM 2833 O HOH E 672 54.070 69.175 16.112 1.00 43.90 O HETATM 2834 O HOH E 673 54.874 40.824 -4.561 1.00 36.42 O HETATM 2835 O HOH E 674 47.864 48.801 36.986 1.00 40.41 O HETATM 2836 O HOH E 675 54.775 32.157 13.172 1.00 32.40 O HETATM 2837 O HOH E 676 53.698 43.236 -8.916 1.00 42.65 O HETATM 2838 O HOH E 677 70.830 39.546 6.012 1.00 44.81 O HETATM 2839 O HOH E 678 67.111 40.420 -0.581 1.00 43.95 O HETATM 2840 O HOH E 679 46.244 59.375 32.908 1.00 49.71 O HETATM 2841 O HOH E 680 59.773 31.508 17.906 1.00 36.97 O HETATM 2842 O HOH E 681 58.207 49.776 -8.365 1.00 41.78 O HETATM 2843 O HOH E 682 74.473 61.714 3.717 1.00 42.45 O HETATM 2844 O HOH E 683 52.375 34.600 20.900 1.00 41.38 O HETATM 2845 O HOH E 684 64.129 66.477 24.178 1.00 39.26 O HETATM 2846 O HOH E 685 60.617 31.372 8.565 1.00 39.33 O HETATM 2847 O HOH E 686 61.153 53.796 -8.076 1.00 39.70 O HETATM 2848 O HOH E 687 64.697 66.910 3.679 1.00 32.41 O HETATM 2849 O HOH E 688 71.344 40.642 0.840 1.00 43.66 O HETATM 2850 O HOH E 689 45.906 58.545 35.880 1.00 35.70 O HETATM 2851 O HOH E 690 71.383 44.422 19.913 1.00 47.33 O HETATM 2852 O HOH E 691 64.092 67.845 19.072 1.00 45.56 O HETATM 2853 O HOH E 692 47.555 68.137 20.569 1.00 49.05 O HETATM 2854 O HOH E 693 45.566 70.043 14.278 1.00 35.94 O HETATM 2855 O HOH E 694 75.879 38.421 17.543 1.00 37.90 O HETATM 2856 O HOH E 695 53.431 63.331 -8.312 1.00 43.79 O HETATM 2857 O HOH E 696 47.530 64.262 26.665 1.00 45.91 O HETATM 2858 O HOH E 697 41.517 68.358 8.617 1.00 44.53 O HETATM 2859 O HOH E 698 58.275 70.606 7.282 1.00 35.90 O HETATM 2860 O HOH E 699 50.423 47.086 35.043 1.00 45.48 O HETATM 2861 O HOH E 700 51.130 69.537 -4.357 1.00 43.43 O HETATM 2862 O HOH E 701 73.133 37.247 9.265 1.00 43.35 O HETATM 2863 O HOH E 702 44.490 71.054 7.648 1.00 42.05 O HETATM 2864 O HOH E 703 72.408 50.660 26.967 1.00 44.92 O HETATM 2865 O HOH E 704 51.773 31.700 1.595 1.00 49.38 O HETATM 2866 O HOH E 705 62.942 45.172 31.314 1.00 32.32 O HETATM 2867 O HOH E 706 60.159 30.286 0.165 1.00 42.19 O HETATM 2868 O HOH E 707 34.361 53.366 18.357 1.00 42.48 O HETATM 2869 O HOH E 708 63.403 47.773 -3.073 1.00 40.51 O HETATM 2870 O HOH E 709 46.496 69.625 18.213 1.00 41.43 O HETATM 2871 O HOH E 710 55.485 68.778 -2.437 1.00 38.71 O HETATM 2872 O HOH E 711 45.481 67.785 0.515 1.00 46.89 O HETATM 2873 O HOH E 712 30.031 60.069 8.296 1.00 37.33 O HETATM 2874 O HOH E 713 53.114 47.430 37.845 1.00 40.10 O HETATM 2875 O HOH E 714 52.004 62.444 -10.920 1.00 41.84 O HETATM 2876 O HOH E 715 46.724 68.714 -1.660 1.00 39.68 O HETATM 2877 O HOH E 716 43.888 59.112 -7.628 1.00 42.62 O HETATM 2878 O HOH E 717 54.504 45.365 33.379 1.00 40.05 O HETATM 2879 O HOH E 718 43.667 51.585 -8.910 1.00 47.20 O HETATM 2880 O HOH E 719 47.959 57.382 -13.272 1.00 37.11 O HETATM 2881 O HOH E 720 63.952 56.474 -1.897 1.00 44.21 O HETATM 2882 O HOH E 721 49.704 62.376 29.614 1.00 43.91 O HETATM 2883 O HOH E 722 49.971 72.940 2.115 1.00 44.33 O HETATM 2884 O HOH E 723 42.932 60.508 -5.583 1.00 40.33 O HETATM 2885 O HOH E 724 49.894 35.013 17.936 1.00 46.38 O HETATM 2886 O HOH E 725 57.539 32.992 14.451 1.00 44.30 O HETATM 2887 O HOH E 726 72.934 46.366 21.162 1.00 44.89 O HETATM 2888 O HOH E 727 68.436 37.016 17.537 1.00 39.64 O HETATM 2889 O HOH E 728 46.801 63.179 -6.255 1.00 43.07 O HETATM 2890 O HOH E 729 52.078 41.601 -4.375 1.00 45.15 O HETATM 2891 O HOH E 730 50.351 35.029 15.112 1.00 47.53 O HETATM 2892 O HOH E 731 36.326 55.667 25.490 1.00 43.62 O HETATM 2893 O HOH E 732 78.783 45.543 16.653 1.00 48.37 O HETATM 2894 O HOH E 733 50.985 31.404 8.652 1.00 43.84 O HETATM 2895 O HOH E 734 52.612 43.772 27.816 0.50 23.76 O HETATM 2896 O HOH E 735 47.781 34.108 14.480 1.00 44.49 O HETATM 2897 O HOH E 736 64.910 68.380 8.718 1.00 44.65 O HETATM 2898 O HOH E 737 33.559 58.152 19.636 1.00 50.46 O HETATM 2899 O HOH E 738 42.728 60.850 24.357 0.50 13.82 O HETATM 2900 O HOH E 739 31.960 54.743 -0.723 1.00 43.49 O HETATM 2901 O HOH E 740 35.667 49.079 -6.315 1.00 49.31 O HETATM 2902 O HOH E 741 43.566 56.304 -8.109 1.00 44.99 O HETATM 2903 O HOH E 742 58.863 43.049 31.812 1.00 38.54 O HETATM 2904 O HOH E 743 63.639 54.415 29.552 1.00 15.24 O HETATM 2905 O HOH E 744 76.724 42.620 18.536 1.00 38.64 O HETATM 2906 O HOH E 745 56.528 46.553 -8.858 1.00 46.44 O HETATM 2907 O HOH E 746 45.005 38.023 16.250 1.00 46.51 O HETATM 2908 O HOH E 747 74.341 57.918 6.626 1.00 37.70 O HETATM 2909 O HOH E 748 59.372 38.157 -7.423 1.00 51.97 O HETATM 2910 O HOH E 749 60.515 44.721 -7.193 1.00 43.06 O HETATM 2911 O HOH E 750 58.632 29.711 -7.200 1.00 43.82 O HETATM 2912 O HOH E 751 31.801 45.381 4.075 1.00 46.21 O HETATM 2913 O HOH E 752 78.358 57.299 17.243 1.00 26.86 O HETATM 2914 O HOH E 753 67.324 45.347 25.368 1.00 43.17 O HETATM 2915 O HOH E 754 56.657 67.222 23.902 1.00 41.86 O HETATM 2916 O HOH E 755 65.975 32.724 16.344 1.00 43.63 O HETATM 2917 O HOH E 756 53.797 54.347 -15.232 1.00 42.79 O HETATM 2918 O HOH E 757 43.248 63.324 24.259 1.00 50.49 O HETATM 2919 O HOH E 758 73.921 39.889 16.314 1.00 27.03 O HETATM 2920 O HOH E 759 35.038 57.123 -3.891 1.00 43.09 O HETATM 2921 O HOH E 760 75.298 59.057 10.024 1.00 40.62 O HETATM 2922 O HOH E 761 49.017 48.544 32.050 1.00 26.61 O HETATM 2923 O HOH E 762 33.037 46.267 28.629 1.00 36.59 O HETATM 2924 O HOH E 763 65.670 52.751 30.453 1.00 40.24 O HETATM 2925 O HOH E 764 31.438 62.910 2.092 1.00 37.38 O HETATM 2926 O HOH E 765 36.867 60.587 -2.862 1.00 41.23 O HETATM 2927 O HOH E 766 47.151 36.132 5.296 1.00 50.43 O HETATM 2928 O HOH E 767 60.612 51.111 -9.336 1.00 43.54 O HETATM 2929 O HOH E 768 49.696 70.348 17.450 1.00 49.54 O HETATM 2930 O HOH E 769 43.027 70.145 9.706 1.00 43.67 O HETATM 2931 O HOH E 770 55.865 70.065 15.160 1.00 42.63 O HETATM 2932 O HOH E 771 43.295 66.103 21.460 1.00 48.67 O HETATM 2933 O HOH E 772 74.015 60.331 22.064 1.00 45.06 O HETATM 2934 O HOH E 773 57.750 61.607 28.553 1.00 21.82 O HETATM 2935 O HOH E 774 66.325 53.937 -0.414 1.00 31.10 O HETATM 2936 O HOH E 775 45.020 54.984 -11.257 1.00 47.51 O HETATM 2937 O HOH E 776 66.121 49.011 29.622 0.50 28.62 O HETATM 2938 O HOH E 777 74.676 53.045 25.949 1.00 47.69 O HETATM 2939 O HOH E 778 77.158 66.595 8.170 1.00 43.99 O HETATM 2940 O HOH E 779 38.804 68.149 16.382 1.00 44.58 O HETATM 2941 O HOH E 780 65.051 50.202 30.551 0.50 23.53 O HETATM 2942 O HOH E 781 43.605 48.960 -8.186 1.00 49.42 O HETATM 2943 O HOH E 782 53.384 71.778 2.304 1.00 45.86 O HETATM 2944 O HOH E 783 80.150 59.345 17.597 1.00 50.27 O HETATM 2945 O HOH E 784 50.723 64.709 26.070 1.00 48.22 O HETATM 2946 O HOH E 785 41.493 61.274 25.610 0.50 26.94 O HETATM 2947 O HOH E 786 78.543 59.633 20.137 1.00 52.79 O HETATM 2948 O HOH E 787 49.830 45.133 4.106 1.00 36.18 O HETATM 2949 O HOH E 788 63.960 55.762 -4.466 1.00 50.05 O HETATM 2950 O HOH E 789 62.326 67.275 28.297 1.00 44.48 O HETATM 2951 O HOH E 790 39.063 63.918 24.363 1.00 47.66 O HETATM 2952 O HOH E 791 56.081 63.598 29.954 1.00 43.65 O HETATM 2953 O HOH E 792 70.576 42.825 22.630 1.00 47.43 O HETATM 2954 O HOH E 793 61.792 35.465 24.011 1.00 52.32 O HETATM 2955 O HOH E 794 38.231 55.570 -6.241 1.00 54.00 O HETATM 2956 O HOH E 795 73.883 49.581 25.323 1.00 53.78 O HETATM 2957 O HOH E 796 32.737 60.696 18.360 1.00 49.75 O HETATM 2958 O HOH E 797 61.658 37.661 -6.310 1.00 50.16 O HETATM 2959 O HOH E 798 60.009 31.531 11.154 1.00 45.38 O HETATM 2960 O HOH E 799 34.184 51.253 27.317 1.00 44.19 O HETATM 2961 O HOH E 800 74.944 62.875 14.157 0.50 16.42 O HETATM 2962 O HOH E 801 77.297 61.610 19.060 0.50 22.90 O HETATM 2963 O HOH E 802 59.352 69.033 3.227 1.00 20.32 O HETATM 2964 O HOH E 803 70.450 64.163 7.209 1.00 19.79 O HETATM 2965 O HOH I 84 29.970 29.080 -8.484 1.00 16.81 O HETATM 2966 O HOH I 85 27.448 22.939 3.346 1.00 15.55 O HETATM 2967 O HOH I 86 28.676 25.467 3.912 1.00 18.18 O HETATM 2968 O HOH I 87 26.735 30.595 0.035 1.00 16.63 O HETATM 2969 O HOH I 88 41.821 36.594 4.482 1.00 17.17 O HETATM 2970 O HOH I 89 39.623 36.217 -2.551 1.00 19.80 O HETATM 2971 O HOH I 90 41.695 36.015 1.143 1.00 20.20 O HETATM 2972 O HOH I 91 31.234 31.068 10.592 1.00 20.62 O HETATM 2973 O HOH I 92 30.860 25.560 -10.059 1.00 19.62 O HETATM 2974 O HOH I 93 46.395 39.010 6.711 1.00 22.51 O HETATM 2975 O HOH I 94 42.195 36.750 -1.499 1.00 28.46 O HETATM 2976 O HOH I 95 34.162 37.022 -13.614 1.00 25.12 O HETATM 2977 O HOH I 96 47.206 32.333 5.764 1.00 34.62 O HETATM 2978 O HOH I 97 45.213 35.371 -6.363 1.00 26.57 O HETATM 2979 O HOH I 98 27.270 30.122 2.813 1.00 30.66 O HETATM 2980 O HOH I 99 30.917 40.739 3.651 1.00 28.43 O HETATM 2981 O HOH I 100 25.126 22.271 1.743 1.00 28.29 O HETATM 2982 O HOH I 101 43.123 41.596 15.015 1.00 28.77 O HETATM 2983 O HOH I 102 25.627 20.721 -0.362 1.00 31.01 O HETATM 2984 O HOH I 103 43.553 38.142 3.290 1.00 36.00 O HETATM 2985 O HOH I 104 31.221 34.401 8.217 1.00 30.28 O HETATM 2986 O HOH I 105 37.700 42.318 9.172 1.00 31.03 O HETATM 2987 O HOH I 106 24.952 23.352 -3.522 1.00 32.47 O HETATM 2988 O HOH I 107 43.978 44.103 -0.971 1.00 41.25 O HETATM 2989 O HOH I 108 23.457 24.900 -0.548 1.00 39.29 O HETATM 2990 O HOH I 109 44.701 41.368 -0.568 1.00 36.01 O HETATM 2991 O HOH I 110 30.614 42.735 -7.136 1.00 29.91 O HETATM 2992 O HOH I 111 24.795 36.501 -2.477 1.00 32.70 O HETATM 2993 O HOH I 112 34.494 44.456 -7.316 1.00 32.88 O HETATM 2994 O HOH I 113 38.067 35.601 -11.613 1.00 38.22 O HETATM 2995 O HOH I 114 27.344 32.398 4.387 1.00 36.24 O HETATM 2996 O HOH I 115 34.595 22.034 1.171 1.00 35.10 O HETATM 2997 O HOH I 116 29.129 27.337 10.164 1.00 31.03 O HETATM 2998 O HOH I 117 37.933 29.411 12.086 1.00 37.65 O HETATM 2999 O HOH I 118 29.832 42.091 -3.444 1.00 33.61 O HETATM 3000 O HOH I 119 37.763 38.172 -12.382 1.00 34.07 O HETATM 3001 O HOH I 120 25.576 33.079 0.060 1.00 43.99 O HETATM 3002 O HOH I 121 29.551 33.937 5.250 1.00 38.39 O HETATM 3003 O HOH I 122 38.715 21.111 7.363 1.00 34.73 O HETATM 3004 O HOH I 123 38.293 25.050 11.305 1.00 35.93 O HETATM 3005 O HOH I 124 23.731 31.129 -1.494 1.00 33.26 O HETATM 3006 O HOH I 125 40.471 45.111 12.988 1.00 37.81 O HETATM 3007 O HOH I 126 45.466 35.824 14.407 1.00 32.19 O HETATM 3008 O HOH I 127 43.739 29.530 -8.787 1.00 30.83 O HETATM 3009 O HOH I 128 35.775 43.847 -11.841 1.00 35.83 O HETATM 3010 O HOH I 129 28.070 42.565 -8.265 1.00 44.48 O HETATM 3011 O HOH I 130 28.624 31.649 9.325 1.00 44.20 O HETATM 3012 O HOH I 131 42.650 42.943 -4.360 1.00 33.94 O HETATM 3013 O HOH I 132 44.150 40.657 2.140 1.00 48.97 O HETATM 3014 O HOH I 133 31.849 44.052 -3.190 1.00 43.65 O HETATM 3015 O HOH I 134 34.830 32.901 -13.952 1.00 37.91 O HETATM 3016 O HOH I 135 45.644 41.630 6.264 1.00 26.68 O HETATM 3017 O HOH I 136 28.295 20.001 -0.276 1.00 36.70 O HETATM 3018 O HOH I 137 45.618 35.392 -2.121 1.00 36.51 O HETATM 3019 O HOH I 138 27.183 24.279 -4.299 1.00 25.71 O HETATM 3020 O HOH I 139 37.673 22.419 -0.262 1.00 35.94 O HETATM 3021 O HOH I 140 36.557 46.114 -7.872 1.00 43.93 O HETATM 3022 O HOH I 141 32.068 44.589 -0.589 1.00 48.67 O HETATM 3023 O HOH I 142 30.866 23.091 -4.440 1.00 38.14 O HETATM 3024 O HOH I 143 31.623 20.858 -1.697 1.00 50.40 O HETATM 3025 O HOH I 144 29.157 22.800 -2.792 1.00 45.48 O HETATM 3026 O HOH I 145 39.908 25.619 13.294 1.00 42.09 O HETATM 3027 O HOH I 146 27.583 39.605 -2.794 1.00 43.44 O HETATM 3028 O HOH I 147 26.472 35.727 -0.532 1.00 49.72 O HETATM 3029 O HOH I 148 37.259 23.159 -2.718 1.00 41.37 O HETATM 3030 O HOH I 149 39.882 24.959 8.872 1.00 41.02 O HETATM 3031 O HOH I 150 44.833 24.410 -0.385 1.00 46.16 O HETATM 3032 O HOH I 151 38.843 41.231 -11.758 1.00 41.73 O HETATM 3033 O HOH I 152 27.836 43.704 -12.467 1.00 33.33 O HETATM 3034 O HOH I 153 39.102 41.313 17.183 1.00 42.52 O HETATM 3035 O HOH I 154 40.453 28.441 -9.948 1.00 43.41 O HETATM 3036 O HOH I 155 38.542 48.504 -6.549 1.00 45.81 O HETATM 3037 O HOH I 156 29.603 36.572 5.034 1.00 46.81 O HETATM 3038 O HOH I 157 41.535 40.144 16.775 1.00 37.86 O HETATM 3039 O HOH I 158 30.628 32.266 12.753 1.00 45.38 O HETATM 3040 O HOH I 159 45.448 39.993 14.916 1.00 22.97 O HETATM 3041 O HOH I 160 36.630 28.576 -11.939 1.00 47.08 O HETATM 3042 O HOH I 161 41.228 35.342 14.910 0.50 32.38 O HETATM 3043 O HOH I 162 35.366 32.193 14.624 1.00 49.45 O HETATM 3044 O HOH I 163 35.534 21.023 -1.068 1.00 46.43 O HETATM 3045 O HOH I 164 36.107 24.636 -7.279 1.00 47.81 O HETATM 3046 O HOH I 165 36.381 26.603 11.821 1.00 25.88 O HETATM 3047 O HOH I 166 45.864 25.009 2.515 1.00 41.34 O HETATM 3048 O HOH I 167 29.661 45.500 -14.139 1.00 52.76 O HETATM 3049 O HOH I 168 47.981 30.000 4.145 1.00 46.88 O HETATM 3050 O HOH I 169 41.149 42.652 13.152 0.50 21.52 O HETATM 3051 O HOH I 170 41.997 27.767 9.404 1.00 48.48 O HETATM 3052 O HOH I 171 44.908 28.547 10.260 1.00 57.09 O HETATM 3053 O HOH I 172 28.458 39.204 1.611 1.00 47.98 O HETATM 3054 O HOH I 173 47.244 44.205 3.609 1.00 32.84 O HETATM 3055 O HOH I 174 36.475 39.383 10.819 1.00 49.49 O HETATM 3056 O HOH I 175 44.188 40.580 -7.003 1.00 32.29 O CONECT 13 2551 CONECT 298 2551 CONECT 531 2551 CONECT 550 2551 CONECT 561 2551 CONECT 573 2551 CONECT 1176 2552 CONECT 1189 2552 CONECT 1214 2552 CONECT 2551 13 298 531 550 CONECT 2551 561 573 CONECT 2552 1176 1189 1214 2649 CONECT 2552 2753 CONECT 2553 2554 2555 2556 CONECT 2554 2553 CONECT 2555 2553 CONECT 2556 2553 2557 CONECT 2557 2556 2558 2559 2563 CONECT 2558 2557 CONECT 2559 2557 2560 CONECT 2560 2559 2561 2562 CONECT 2561 2560 CONECT 2562 2560 CONECT 2563 2557 2564 2565 CONECT 2564 2563 CONECT 2565 2563 CONECT 2566 2567 2568 2569 CONECT 2567 2566 CONECT 2568 2566 CONECT 2569 2566 2570 CONECT 2570 2569 2571 2572 2576 CONECT 2571 2570 CONECT 2572 2570 2573 CONECT 2573 2572 2574 2575 CONECT 2574 2573 CONECT 2575 2573 CONECT 2576 2570 2577 2578 CONECT 2577 2576 CONECT 2578 2576 CONECT 2579 2580 CONECT 2580 2579 2582 CONECT 2581 2582 2583 CONECT 2582 2580 2581 CONECT 2583 2581 2585 CONECT 2584 2585 2586 CONECT 2585 2583 2584 CONECT 2586 2584 2588 CONECT 2587 2588 2589 CONECT 2588 2586 2587 CONECT 2589 2587 CONECT 2590 2591 CONECT 2591 2590 2592 CONECT 2592 2591 2593 CONECT 2593 2592 2595 CONECT 2594 2595 2596 CONECT 2595 2593 2594 CONECT 2596 2594 2598 CONECT 2597 2598 2599 CONECT 2598 2596 2597 CONECT 2599 2597 2601 CONECT 2600 2601 2602 CONECT 2601 2599 2600 CONECT 2602 2600 2604 CONECT 2603 2604 2605 CONECT 2604 2602 2603 CONECT 2605 2603 CONECT 2606 2608 CONECT 2607 2608 2609 CONECT 2608 2606 2607 CONECT 2609 2607 2611 CONECT 2610 2611 2612 CONECT 2611 2609 2610 CONECT 2612 2610 2614 CONECT 2613 2614 2615 CONECT 2614 2612 2613 CONECT 2615 2613 2617 CONECT 2616 2617 CONECT 2617 2615 2616 CONECT 2649 2552 CONECT 2753 2552 MASTER 435 0 7 11 15 0 17 6 3005 2 80 27 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
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RCSB PDB
PDBbind
64-mer
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RCSB PDB
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64-mer
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PDBbind
64-mer
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64-mer
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PDBbind
64-mer
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RCSB PDB
PDBbind
64-mer
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RCSB PDB
PDBbind
64-mer
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RCSB PDB
PDBbind
64-mer
1y3c
RCSB PDB
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RCSB PDB
PDBbind
64-mer
Entry Information
PDB ID
1tm4
Complex Type
Protein-Protein
PDBbind Subset
general set
Protein Name
subtilisin bpn' precursor
Ligand Name
64-mer
EC.Number
E.C.3.4.21.62
Resolution
1.7(Å)
Affinity (Kd/Ki/IC50)
Ki=0.13nM
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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