Browse entries in the PDBbind-CN Database
HEADER HYDROLASE 11-JUN-04 1TO1 TITLE CRYSTAL STRUCTURE OF THE COMPLEX OF SUBTILISIN BPN' WITH CHYMOTRYPSIN TITLE 2 INHIBITOR 2 Y61A MUTANT COMPND MOL_ID: 1; COMPND 2 MOLECULE: SUBTILISIN BPN'; COMPND 3 CHAIN: E; COMPND 4 SYNONYM: SUBTILISIN NOVO, ALKALINE PROTEASE; COMPND 5 EC: 3.4.21.62; COMPND 6 ENGINEERED: YES; COMPND 7 MUTATION: YES; COMPND 8 MOL_ID: 2; COMPND 9 MOLECULE: CHYMOTRYPSIN INHIBITOR 2; COMPND 10 CHAIN: I; COMPND 11 ENGINEERED: YES; COMPND 12 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS AMYLOLIQUEFACIENS; SOURCE 3 ORGANISM_TAXID: 1390; SOURCE 4 GENE: APR; SOURCE 5 EXPRESSION_SYSTEM: BACILLUS SUBTILIS; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 1423; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BG2036; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PSER25; SOURCE 10 MOL_ID: 2; SOURCE 11 ORGANISM_SCIENTIFIC: HORDEUM VULGARE SUBSP. VULGARE; SOURCE 12 ORGANISM_COMMON: DOMESTICATED BARLEY; SOURCE 13 ORGANISM_TAXID: 112509; SOURCE 14 STRAIN: SUBSP. VULGARE; SOURCE 15 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 16 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 17 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3); SOURCE 18 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 19 EXPRESSION_SYSTEM_PLASMID: PCI2Y61A KEYWDS SERINE PROTEASE, INHIBITOR, HYDROLASE EXPDTA X-RAY DIFFRACTION AUTHOR E.S.RADISKY,G.KWAN,C.J.KAREN LU,D.E.KOSHLAND JR. REVDAT 3 11-OCT-17 1TO1 1 REMARK REVDAT 2 24-FEB-09 1TO1 1 VERSN REVDAT 1 09-NOV-04 1TO1 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. 1.68 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) : 1.68 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 81.65 REMARK 3 DATA CUTOFF (SIGMA(F)) : -3.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.4 REMARK 3 NUMBER OF REFLECTIONS : 52890 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) : 0.157 REMARK 3 R VALUE (WORKING SET) : 0.156 REMARK 3 FREE R VALUE : 0.182 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 2786 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) : 1.68 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.72 REMARK 3 REFLECTION IN BIN (WORKING SET) : 3765 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 BIN R VALUE (WORKING SET) : 0.2260 REMARK 3 BIN FREE R VALUE SET COUNT : 205 REMARK 3 BIN FREE R VALUE : 0.2170 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2496 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 75 REMARK 3 SOLVENT ATOMS : 501 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 17.93 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.21000 REMARK 3 B22 (A**2) : 0.21000 REMARK 3 B33 (A**2) : -0.32000 REMARK 3 B12 (A**2) : 0.11000 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): 0.074 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.076 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.050 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 1.540 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.967 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.955 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2663 ; 0.019 ; 0.021 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3608 ; 1.728 ; 1.957 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 345 ; 5.785 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): NULL ; NULL ; NULL REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 407 ; 0.128 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1985 ; 0.008 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 1397 ; 0.214 ; 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): 385 ; 0.166 ; 0.200 REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): 7 ; 0.063 ; 0.200 REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): 37 ; 0.398 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 40 ; 0.199 ; 0.200 REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 1715 ; 0.927 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2766 ; 1.524 ; 2.000 REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 948 ; 2.679 ; 3.000 REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 841 ; 4.559 ; 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 1TO1 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 23-JUN-04. REMARK 100 THE DEPOSITION ID IS D_1000022785. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 26-OCT-02 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 4.6 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ALS REMARK 200 BEAMLINE : 8.3.1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.0 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 4 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : MOSFLM REMARK 200 DATA SCALING SOFTWARE : CCP4 (SCALA, TRUNCATE REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 55676 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.680 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 : 4.700 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 0.09900 REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 10.3000 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 123.84600 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 61.92300 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 92.88450 REMARK 290 SMTRY1 5 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 5 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 30.96150 REMARK 290 SMTRY1 6 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 154.80750 REMARK 290 SMTRY1 7 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 7 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 123.84600 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 9 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 9 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 9 0.000000 0.000000 -1.000000 61.92300 REMARK 290 SMTRY1 10 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 10 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 10 0.000000 0.000000 -1.000000 30.96150 REMARK 290 SMTRY1 11 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 11 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 11 0.000000 0.000000 -1.000000 92.88450 REMARK 290 SMTRY1 12 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 12 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 12 0.000000 0.000000 -1.000000 154.80750 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 3190 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 13140 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -26.0 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 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 MET I 20 N CA CB CG SD CE REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O HOH E 730 O HOH E 822 2.15 REMARK 500 O HOH E 653 O HOH E 908 2.16 REMARK 500 NH1 ARG I 72 O HOH I 602 2.17 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 C26 1PE E 514 C26 1PE E 514 9765 1.90 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ASP E 32 -153.12 -168.32 REMARK 500 SER E 63 -21.85 107.75 REMARK 500 ALA E 73 26.01 -153.89 REMARK 500 ASN E 77 -154.50 -160.53 REMARK 500 ASP E 197 -60.31 -99.03 REMARK 500 LEU E 257 -129.44 -116.91 REMARK 500 MET I 59 40.34 -109.81 REMARK 500 REMARK 500 REMARK: NULL REMARK 600 REMARK 600 HETEROGEN REMARK 600 ONLY PARTS OF THE FOUR POLYETHYLENE REMARK 600 GLYCOL MOLECULES WERE MODELED. REMARK 610 REMARK 610 MISSING HETEROATOM REMARK 610 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 610 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 610 I=INSERTION CODE): REMARK 610 M RES C SSEQI REMARK 610 1PE E 514 REMARK 610 1PE E 517 REMARK 610 1PE I 516 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 510 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLN E 2 OE1 REMARK 620 2 ASP E 41 OD1 164.1 REMARK 620 3 LEU E 75 O 76.2 90.1 REMARK 620 4 ASN E 77 OD1 86.8 86.2 94.3 REMARK 620 5 ILE E 79 O 102.3 90.6 174.8 80.7 REMARK 620 6 VAL E 81 O 96.7 91.3 90.1 175.0 95.0 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 NA E 511 NA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLY E 169 O REMARK 620 2 TYR E 171 O 90.6 REMARK 620 3 VAL E 174 O 106.9 89.0 REMARK 620 4 HOH E 651 O 103.6 85.1 149.0 REMARK 620 5 HOH E 549 O 109.3 159.8 82.4 93.0 REMARK 620 N 1 2 3 4 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA E 510 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NA E 511 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CIT E 512 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CIT E 513 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 1PE E 514 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 1PE E 515 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 1PE I 516 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 1PE E 517 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1TM1 RELATED DB: PDB REMARK 900 RELATED ID: 1TM3 RELATED DB: PDB REMARK 900 RELATED ID: 1TM4 RELATED DB: PDB REMARK 900 RELATED ID: 1TM5 RELATED DB: PDB REMARK 900 RELATED ID: 1TM7 RELATED DB: PDB REMARK 900 RELATED ID: 1TMG RELATED DB: PDB REMARK 900 RELATED ID: 1T02 RELATED DB: PDB DBREF 1TO1 E 1 275 UNP P00782 SUBT_BACAM 108 382 DBREF 1TO1 I 21 83 UNP Q40059 Q40059_HORVU 22 84 SEQADV 1TO1 HIS E 276 UNP P00782 EXPRESSION TAG SEQADV 1TO1 HIS E 277 UNP P00782 EXPRESSION TAG SEQADV 1TO1 HIS E 278 UNP P00782 EXPRESSION TAG SEQADV 1TO1 HIS E 279 UNP P00782 EXPRESSION TAG SEQADV 1TO1 HIS E 280 UNP P00782 EXPRESSION TAG SEQADV 1TO1 HIS E 281 UNP P00782 EXPRESSION TAG SEQADV 1TO1 MET I 20 UNP Q40059 INITIATING METHIONINE SEQADV 1TO1 ALA I 61 UNP Q40059 TYR 62 ENGINEERED SEQRES 1 E 281 ALA GLN SER VAL PRO TYR GLY VAL SER GLN ILE LYS ALA SEQRES 2 E 281 PRO ALA LEU HIS SER GLN GLY TYR THR GLY SER ASN VAL SEQRES 3 E 281 LYS VAL ALA VAL ILE ASP SER GLY ILE ASP SER SER HIS SEQRES 4 E 281 PRO ASP LEU LYS VAL ALA GLY GLY ALA SER MET VAL PRO SEQRES 5 E 281 SER GLU THR ASN PRO PHE GLN ASP ASN ASN SER HIS GLY SEQRES 6 E 281 THR HIS VAL ALA GLY THR VAL ALA ALA LEU ASN ASN SER SEQRES 7 E 281 ILE GLY VAL LEU GLY VAL ALA PRO SER ALA SER LEU TYR SEQRES 8 E 281 ALA VAL LYS VAL LEU GLY ALA ASP GLY SER GLY GLN TYR SEQRES 9 E 281 SER TRP ILE ILE ASN GLY ILE GLU TRP ALA ILE ALA ASN SEQRES 10 E 281 ASN MET ASP VAL ILE ASN MET SER LEU GLY GLY PRO SER SEQRES 11 E 281 GLY SER ALA ALA LEU LYS ALA ALA VAL ASP LYS ALA VAL SEQRES 12 E 281 ALA SER GLY VAL VAL VAL VAL ALA ALA ALA GLY ASN GLU SEQRES 13 E 281 GLY THR SER GLY SER SER SER THR VAL GLY TYR PRO GLY SEQRES 14 E 281 LYS TYR PRO SER VAL ILE ALA VAL GLY ALA VAL ASP SER SEQRES 15 E 281 SER ASN GLN ARG ALA SER PHE SER SER VAL GLY PRO GLU SEQRES 16 E 281 LEU ASP VAL MET ALA PRO GLY VAL SER ILE GLN SER THR SEQRES 17 E 281 LEU PRO GLY ASN LYS TYR GLY ALA TYR ASN GLY THR SER SEQRES 18 E 281 MET ALA SER PRO HIS VAL ALA GLY ALA ALA ALA LEU ILE SEQRES 19 E 281 LEU SER LYS HIS PRO ASN TRP THR ASN THR GLN VAL ARG SEQRES 20 E 281 SER SER LEU GLU ASN THR THR THR LYS LEU GLY ASP SER SEQRES 21 E 281 PHE TYR TYR GLY LYS GLY LEU ILE ASN VAL GLN ALA ALA SEQRES 22 E 281 ALA GLN HIS HIS HIS HIS HIS HIS SEQRES 1 I 64 MET LYS THR GLU TRP PRO GLU LEU VAL GLY LYS SER VAL SEQRES 2 I 64 GLU GLU ALA LYS LYS VAL ILE LEU GLN ASP LYS PRO ALA SEQRES 3 I 64 ALA GLN ILE ILE VAL LEU PRO VAL GLY THR ILE VAL THR SEQRES 4 I 64 MET GLU ALA 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 510 1 HET NA E 511 1 HET CIT E 512 13 HET CIT E 513 13 HET 1PE E 514 11 HET 1PE E 515 16 HET 1PE E 517 13 HET 1PE I 516 7 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 4(C10 H22 O6) FORMUL 11 HOH *501(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 SER E 89 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 510 1555 1555 2.38 LINK OD1 ASP E 41 CA CA E 510 1555 1555 2.45 LINK O LEU E 75 CA CA E 510 1555 1555 2.35 LINK OD1 ASN E 77 CA CA E 510 1555 1555 2.33 LINK O ILE E 79 CA CA E 510 1555 1555 2.40 LINK O VAL E 81 CA CA E 510 1555 1555 2.45 LINK O GLY E 169 NA NA E 511 1555 1555 2.42 LINK O TYR E 171 NA NA E 511 1555 1555 2.37 LINK O VAL E 174 NA NA E 511 1555 1555 2.31 LINK NA NA E 511 O HOH E 651 1555 1555 2.38 LINK NA NA E 511 O HOH E 549 1555 1555 2.41 CISPEP 1 TYR E 167 PRO E 168 0 8.53 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 549 SITE 2 AC2 5 HOH E 651 SITE 1 AC3 14 ALA E 1 TYR E 21 LYS E 237 HIS E 238 SITE 2 AC3 14 ASN E 240 TRP E 241 HIS E 276 CIT E 513 SITE 3 AC3 14 HOH E 545 HOH E 598 HOH E 632 HOH E 824 SITE 4 AC3 14 HOH E 887 HOH E 888 SITE 1 AC4 9 TRP E 241 GLN E 245 SER E 249 HIS E 276 SITE 2 AC4 9 HIS E 278 CIT E 512 HOH E 740 HOH E 888 SITE 3 AC4 9 HOH E 913 SITE 1 AC5 4 HIS E 17 THR E 22 ASN E 76 SER E 87 SITE 1 AC6 7 ILE E 115 ASN E 118 MET E 119 SER E 145 SITE 2 AC6 7 VAL E 147 HOH E 676 HOH E 790 SITE 1 AC7 7 ASN E 218 ALA I 61 ARG I 62 ILE I 63 SITE 2 AC7 7 ASP I 64 HOH I 579 HOH I 597 SITE 1 AC8 6 VAL E 44 ALA E 45 GLY E 46 GLY E 47 SITE 2 AC8 6 PHE E 58 HOH E 829 CRYST1 94.087 94.087 185.769 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 0.010628 0.006136 0.000000 0.00000 SCALE2 0.000000 0.012273 0.000000 0.00000 SCALE3 0.000000 0.000000 0.005383 0.00000 ATOM 1 N ALA E 1 49.022 51.235 36.582 1.00 14.54 N ATOM 2 CA ALA E 1 50.466 51.296 36.149 1.00 14.01 C ATOM 3 C ALA E 1 50.507 51.074 34.652 1.00 13.43 C ATOM 4 O ALA E 1 49.687 50.311 34.097 1.00 15.21 O ATOM 5 CB ALA E 1 51.301 50.193 36.863 1.00 14.37 C ATOM 6 N GLN E 2 51.469 51.717 34.003 1.00 11.97 N ATOM 7 CA GLN E 2 51.768 51.517 32.579 1.00 12.25 C ATOM 8 C GLN E 2 52.653 50.301 32.355 1.00 11.11 C ATOM 9 O GLN E 2 53.471 49.928 33.202 1.00 12.72 O ATOM 10 CB GLN E 2 52.461 52.760 32.098 1.00 10.27 C ATOM 11 CG GLN E 2 52.991 52.718 30.656 1.00 12.85 C ATOM 12 CD GLN E 2 53.514 54.087 30.272 1.00 12.05 C ATOM 13 OE1 GLN E 2 52.765 54.884 29.706 1.00 12.45 O ATOM 14 NE2 GLN E 2 54.783 54.403 30.656 1.00 10.81 N ATOM 15 N SER E 3 52.431 49.626 31.227 1.00 11.63 N ATOM 16 CA SER E 3 53.229 48.459 30.828 1.00 12.36 C ATOM 17 C SER E 3 53.957 48.805 29.521 1.00 11.62 C ATOM 18 O SER E 3 53.416 49.553 28.678 1.00 11.72 O ATOM 19 CB SER E 3 52.286 47.268 30.571 1.00 13.22 C ATOM 20 OG ASER E 3 51.331 47.576 29.622 0.33 15.22 O ATOM 21 OG BSER E 3 52.894 46.261 29.792 0.33 10.78 O ATOM 22 OG CSER E 3 51.550 46.974 31.742 0.33 14.35 O ATOM 23 N VAL E 4 55.162 48.276 29.370 1.00 10.83 N ATOM 24 CA VAL E 4 55.933 48.569 28.155 1.00 11.15 C ATOM 25 C VAL E 4 55.830 47.264 27.333 1.00 11.12 C ATOM 26 O VAL E 4 56.420 46.225 27.723 1.00 12.13 O ATOM 27 CB VAL E 4 57.390 48.859 28.459 1.00 10.81 C ATOM 28 CG1 VAL E 4 58.160 49.147 27.133 1.00 10.67 C ATOM 29 CG2 VAL E 4 57.505 50.117 29.375 1.00 12.63 C ATOM 30 N PRO E 5 55.086 47.271 26.232 1.00 10.57 N ATOM 31 CA PRO E 5 54.986 46.056 25.415 1.00 11.64 C ATOM 32 C PRO E 5 56.388 45.578 24.997 1.00 12.25 C ATOM 33 O PRO E 5 57.290 46.417 24.730 1.00 11.01 O ATOM 34 CB PRO E 5 54.205 46.523 24.187 1.00 13.42 C ATOM 35 CG PRO E 5 53.345 47.719 24.715 1.00 12.38 C ATOM 36 CD PRO E 5 54.319 48.405 25.657 1.00 11.48 C ATOM 37 N TYR E 6 56.545 44.266 24.879 1.00 11.71 N ATOM 38 CA TYR E 6 57.882 43.708 24.623 1.00 13.12 C ATOM 39 C TYR E 6 58.514 44.294 23.360 1.00 12.33 C ATOM 40 O TYR E 6 59.722 44.476 23.332 1.00 12.75 O ATOM 41 CB TYR E 6 57.854 42.157 24.541 1.00 12.87 C ATOM 42 CG TYR E 6 57.484 41.614 23.163 1.00 14.94 C ATOM 43 CD1 TYR E 6 58.476 41.418 22.149 1.00 16.56 C ATOM 44 CD2 TYR E 6 56.153 41.268 22.861 1.00 16.58 C ATOM 45 CE1 TYR E 6 58.124 40.913 20.863 1.00 15.52 C ATOM 46 CE2 TYR E 6 55.806 40.782 21.586 1.00 12.08 C ATOM 47 CZ TYR E 6 56.815 40.589 20.611 1.00 16.00 C ATOM 48 OH TYR E 6 56.475 40.072 19.378 1.00 17.56 O ATOM 49 N GLY E 7 57.712 44.555 22.334 1.00 11.06 N ATOM 50 CA GLY E 7 58.265 45.004 21.058 1.00 10.99 C ATOM 51 C GLY E 7 58.917 46.380 21.188 1.00 11.59 C ATOM 52 O GLY E 7 59.909 46.668 20.504 1.00 11.97 O ATOM 53 N VAL E 8 58.365 47.236 22.065 1.00 11.06 N ATOM 54 CA VAL E 8 58.955 48.584 22.266 1.00 10.37 C ATOM 55 C VAL E 8 60.361 48.402 22.869 1.00 10.92 C ATOM 56 O VAL E 8 61.347 49.058 22.461 1.00 10.83 O ATOM 57 CB VAL E 8 58.028 49.432 23.201 1.00 11.12 C ATOM 58 CG1 VAL E 8 58.723 50.773 23.658 1.00 10.82 C ATOM 59 CG2 VAL E 8 56.672 49.667 22.476 1.00 10.57 C ATOM 60 N SER E 9 60.481 47.443 23.801 1.00 10.29 N ATOM 61 CA SER E 9 61.775 47.164 24.417 1.00 11.77 C ATOM 62 C SER E 9 62.726 46.495 23.430 1.00 11.07 C ATOM 63 O SER E 9 63.928 46.798 23.397 1.00 12.24 O ATOM 64 CB SER E 9 61.587 46.270 25.656 1.00 12.21 C ATOM 65 OG SER E 9 60.854 47.003 26.635 1.00 14.70 O ATOM 66 N GLN E 10 62.172 45.597 22.615 1.00 10.88 N ATOM 67 CA GLN E 10 62.969 44.832 21.674 1.00 10.32 C ATOM 68 C GLN E 10 63.688 45.697 20.640 1.00 12.52 C ATOM 69 O GLN E 10 64.817 45.336 20.206 1.00 12.48 O ATOM 70 CB GLN E 10 62.070 43.803 20.971 1.00 11.29 C ATOM 71 CG GLN E 10 62.842 42.810 20.069 1.00 11.97 C ATOM 72 CD GLN E 10 61.980 41.547 19.760 1.00 16.59 C ATOM 73 OE1 GLN E 10 61.153 41.196 20.559 1.00 22.45 O ATOM 74 NE2 GLN E 10 62.204 40.892 18.617 1.00 13.33 N ATOM 75 N ILE E 11 63.033 46.768 20.177 1.00 11.48 N ATOM 76 CA ILE E 11 63.681 47.668 19.209 1.00 11.37 C ATOM 77 C ILE E 11 64.584 48.721 19.891 1.00 12.46 C ATOM 78 O ILE E 11 65.218 49.537 19.195 1.00 12.39 O ATOM 79 CB ILE E 11 62.664 48.378 18.263 1.00 10.73 C ATOM 80 CG1 ILE E 11 61.771 49.354 19.079 1.00 10.19 C ATOM 81 CG2 ILE E 11 61.836 47.321 17.470 1.00 11.68 C ATOM 82 CD1 ILE E 11 61.037 50.338 18.149 1.00 11.05 C ATOM 83 N LYS E 12 64.694 48.643 21.217 1.00 11.60 N ATOM 84 CA LYS E 12 65.560 49.516 22.059 1.00 12.93 C ATOM 85 C LYS E 12 65.067 50.957 22.128 1.00 14.02 C ATOM 86 O LYS E 12 65.854 51.894 22.340 1.00 13.15 O ATOM 87 CB LYS E 12 67.038 49.426 21.643 1.00 13.49 C ATOM 88 CG LYS E 12 67.552 47.977 21.644 1.00 16.97 C ATOM 89 CD LYS E 12 69.076 47.913 21.574 1.00 22.57 C ATOM 90 CE LYS E 12 69.543 46.470 21.335 1.00 26.49 C ATOM 91 NZ LYS E 12 69.031 45.561 22.403 1.00 31.85 N ATOM 92 N ALA E 13 63.755 51.147 21.978 1.00 12.87 N ATOM 93 CA ALA E 13 63.177 52.485 22.192 1.00 12.63 C ATOM 94 C ALA E 13 63.436 53.050 23.592 1.00 11.84 C ATOM 95 O ALA E 13 63.706 54.249 23.695 1.00 11.67 O ATOM 96 CB ALA E 13 61.635 52.550 21.857 1.00 11.25 C ATOM 97 N PRO E 14 63.387 52.249 24.669 1.00 12.00 N ATOM 98 CA PRO E 14 63.669 52.822 26.014 1.00 12.07 C ATOM 99 C PRO E 14 65.053 53.497 26.086 1.00 11.86 C ATOM 100 O PRO E 14 65.213 54.436 26.883 1.00 12.15 O ATOM 101 CB PRO E 14 63.593 51.593 26.934 1.00 12.75 C ATOM 102 CG PRO E 14 62.489 50.696 26.204 1.00 12.67 C ATOM 103 CD PRO E 14 62.963 50.819 24.734 1.00 11.39 C ATOM 104 N ALA E 15 66.033 53.059 25.291 1.00 12.05 N ATOM 105 CA ALA E 15 67.347 53.758 25.303 1.00 12.59 C ATOM 106 C ALA E 15 67.193 55.205 24.817 1.00 13.09 C ATOM 107 O ALA E 15 67.850 56.107 25.343 1.00 13.45 O ATOM 108 CB ALA E 15 68.364 53.024 24.436 1.00 12.89 C ATOM 109 N LEU E 16 66.342 55.439 23.828 1.00 11.65 N ATOM 110 CA LEU E 16 66.115 56.808 23.388 1.00 11.87 C ATOM 111 C LEU E 16 65.320 57.575 24.457 1.00 11.49 C ATOM 112 O LEU E 16 65.647 58.733 24.752 1.00 11.90 O ATOM 113 CB LEU E 16 65.319 56.879 22.066 1.00 11.93 C ATOM 114 CG LEU E 16 66.124 56.838 20.760 1.00 13.53 C ATOM 115 CD1 LEU E 16 66.731 58.239 20.505 1.00 13.24 C ATOM 116 CD2 LEU E 16 67.219 55.732 20.782 1.00 14.93 C ATOM 117 N HIS E 17 64.284 56.944 25.045 1.00 11.22 N ATOM 118 CA HIS E 17 63.521 57.609 26.065 1.00 10.62 C ATOM 119 C HIS E 17 64.445 58.049 27.213 1.00 10.80 C ATOM 120 O HIS E 17 64.297 59.185 27.700 1.00 12.31 O ATOM 121 CB HIS E 17 62.458 56.654 26.643 1.00 10.96 C ATOM 122 CG HIS E 17 61.472 56.198 25.610 1.00 11.21 C ATOM 123 ND1 HIS E 17 60.565 55.190 25.859 1.00 12.83 N ATOM 124 CD2 HIS E 17 61.258 56.616 24.340 1.00 10.49 C ATOM 125 CE1 HIS E 17 59.849 54.987 24.757 1.00 14.52 C ATOM 126 NE2 HIS E 17 60.243 55.850 23.826 1.00 11.43 N ATOM 127 N SER E 18 65.400 57.196 27.604 1.00 10.82 N ATOM 128 CA SER E 18 66.295 57.533 28.745 1.00 11.22 C ATOM 129 C SER E 18 67.249 58.673 28.404 1.00 12.64 C ATOM 130 O SER E 18 67.720 59.350 29.298 1.00 12.23 O ATOM 131 CB SER E 18 67.095 56.328 29.244 1.00 11.41 C ATOM 132 OG ASER E 18 66.264 55.301 29.651 0.50 12.37 O ATOM 133 OG BSER E 18 68.040 55.876 28.304 0.50 10.58 O ATOM 134 N GLN E 19 67.560 58.831 27.114 1.00 12.67 N ATOM 135 CA GLN E 19 68.386 59.969 26.644 1.00 12.11 C ATOM 136 C GLN E 19 67.577 61.248 26.623 1.00 12.39 C ATOM 137 O GLN E 19 68.139 62.338 26.520 1.00 12.44 O ATOM 138 CB GLN E 19 68.925 59.711 25.221 1.00 12.95 C ATOM 139 CG GLN E 19 69.947 58.548 25.091 1.00 14.38 C ATOM 140 CD GLN E 19 70.267 58.287 23.597 1.00 18.33 C ATOM 141 OE1 GLN E 19 70.334 59.227 22.839 1.00 25.35 O ATOM 142 NE2 GLN E 19 70.362 57.029 23.175 1.00 18.55 N ATOM 143 N GLY E 20 66.237 61.142 26.724 1.00 11.75 N ATOM 144 CA GLY E 20 65.384 62.306 26.731 1.00 12.10 C ATOM 145 C GLY E 20 64.564 62.529 25.466 1.00 12.78 C ATOM 146 O GLY E 20 63.934 63.591 25.295 1.00 14.85 O ATOM 147 N TYR E 21 64.532 61.512 24.590 1.00 11.99 N ATOM 148 CA TYR E 21 63.932 61.689 23.259 1.00 11.79 C ATOM 149 C TYR E 21 62.753 60.736 23.071 1.00 12.52 C ATOM 150 O TYR E 21 62.884 59.522 23.301 1.00 12.54 O ATOM 151 CB TYR E 21 64.991 61.463 22.148 1.00 12.88 C ATOM 152 CG TYR E 21 66.051 62.544 22.226 1.00 13.17 C ATOM 153 CD1 TYR E 21 65.721 63.872 21.883 1.00 13.47 C ATOM 154 CD2 TYR E 21 67.347 62.255 22.662 1.00 13.81 C ATOM 155 CE1 TYR E 21 66.653 64.902 21.992 1.00 16.72 C ATOM 156 CE2 TYR E 21 68.310 63.307 22.780 1.00 14.46 C ATOM 157 CZ TYR E 21 67.941 64.585 22.454 1.00 16.05 C ATOM 158 OH TYR E 21 68.880 65.616 22.541 1.00 17.60 O ATOM 159 N THR E 22 61.597 61.313 22.723 1.00 11.78 N ATOM 160 CA THR E 22 60.316 60.593 22.741 1.00 12.28 C ATOM 161 C THR E 22 59.487 60.965 21.511 1.00 11.64 C ATOM 162 O THR E 22 58.297 60.675 21.454 1.00 11.32 O ATOM 163 CB THR E 22 59.501 60.957 23.976 1.00 13.90 C ATOM 164 OG1 THR E 22 59.411 62.406 24.095 1.00 13.83 O ATOM 165 CG2 THR E 22 60.156 60.417 25.243 1.00 15.09 C ATOM 166 N GLY E 23 60.111 61.576 20.511 1.00 10.97 N ATOM 167 CA GLY E 23 59.378 61.956 19.295 1.00 11.85 C ATOM 168 C GLY E 23 58.683 63.317 19.351 1.00 12.37 C ATOM 169 O GLY E 23 57.841 63.613 18.494 1.00 12.18 O ATOM 170 N SER E 24 59.042 64.164 20.327 1.00 11.73 N ATOM 171 CA SER E 24 58.353 65.458 20.441 1.00 13.64 C ATOM 172 C SER E 24 58.475 66.276 19.169 1.00 14.10 C ATOM 173 O SER E 24 59.551 66.351 18.570 1.00 14.98 O ATOM 174 CB SER E 24 59.007 66.313 21.539 1.00 14.23 C ATOM 175 OG ASER E 24 58.924 65.654 22.782 0.67 14.70 O ATOM 176 OG BSER E 24 58.083 67.329 21.937 0.33 12.47 O ATOM 177 N ASN E 25 57.369 66.886 18.774 1.00 16.32 N ATOM 178 CA ASN E 25 57.299 67.796 17.619 1.00 18.45 C ATOM 179 C ASN E 25 57.436 67.090 16.270 1.00 18.00 C ATOM 180 O ASN E 25 57.549 67.757 15.246 1.00 21.26 O ATOM 181 CB ASN E 25 58.340 68.925 17.679 1.00 19.43 C ATOM 182 CG ASN E 25 58.236 69.726 18.944 1.00 26.28 C ATOM 183 OD1 ASN E 25 57.129 70.086 19.370 1.00 30.66 O ATOM 184 ND2 ASN E 25 59.377 69.943 19.603 1.00 32.10 N ATOM 185 N VAL E 26 57.417 65.766 16.251 1.00 13.23 N ATOM 186 CA VAL E 26 57.478 65.040 14.993 1.00 12.39 C ATOM 187 C VAL E 26 56.047 64.651 14.616 1.00 12.05 C ATOM 188 O VAL E 26 55.317 64.046 15.411 1.00 12.94 O ATOM 189 CB VAL E 26 58.342 63.765 15.139 1.00 12.07 C ATOM 190 CG1 VAL E 26 58.431 62.976 13.746 1.00 12.95 C ATOM 191 CG2 VAL E 26 59.733 64.149 15.591 1.00 12.97 C ATOM 192 N LYS E 27 55.680 64.950 13.381 1.00 12.76 N ATOM 193 CA LYS E 27 54.294 64.722 12.932 1.00 12.45 C ATOM 194 C LYS E 27 54.240 63.397 12.189 1.00 13.35 C ATOM 195 O LYS E 27 54.944 63.213 11.162 1.00 13.14 O ATOM 196 CB LYS E 27 53.881 65.862 11.991 1.00 12.24 C ATOM 197 CG LYS E 27 53.890 67.229 12.669 1.00 16.13 C ATOM 198 CD LYS E 27 53.232 68.251 11.706 1.00 20.33 C ATOM 199 CE LYS E 27 53.033 69.584 12.386 1.00 26.24 C ATOM 200 NZ LYS E 27 54.398 70.179 12.404 1.00 32.01 N ATOM 201 N VAL E 28 53.429 62.476 12.740 1.00 12.40 N ATOM 202 CA VAL E 28 53.291 61.129 12.164 1.00 12.38 C ATOM 203 C VAL E 28 51.845 60.908 11.715 1.00 12.99 C ATOM 204 O VAL E 28 50.907 60.980 12.541 1.00 14.17 O ATOM 205 CB VAL E 28 53.677 60.028 13.202 1.00 12.05 C ATOM 206 CG1 VAL E 28 53.595 58.633 12.522 1.00 13.48 C ATOM 207 CG2 VAL E 28 55.104 60.308 13.733 1.00 12.60 C ATOM 208 N ALA E 29 51.669 60.629 10.425 1.00 12.87 N ATOM 209 CA ALA E 29 50.321 60.296 9.928 1.00 11.71 C ATOM 210 C ALA E 29 50.142 58.777 9.953 1.00 13.11 C ATOM 211 O ALA E 29 50.897 58.072 9.327 1.00 12.96 O ATOM 212 CB ALA E 29 50.113 60.810 8.498 1.00 12.25 C ATOM 213 N VAL E 30 49.101 58.327 10.627 1.00 12.53 N ATOM 214 CA VAL E 30 48.722 56.932 10.585 1.00 12.56 C ATOM 215 C VAL E 30 47.618 56.857 9.549 1.00 12.38 C ATOM 216 O VAL E 30 46.494 57.334 9.766 1.00 12.85 O ATOM 217 CB VAL E 30 48.279 56.474 11.979 1.00 12.42 C ATOM 218 CG1 VAL E 30 47.680 55.049 11.985 1.00 12.43 C ATOM 219 CG2 VAL E 30 49.527 56.527 12.923 1.00 13.08 C ATOM 220 N ILE E 31 47.991 56.322 8.394 1.00 13.21 N ATOM 221 CA ILE E 31 47.074 56.296 7.239 1.00 12.65 C ATOM 222 C ILE E 31 46.424 54.925 7.317 1.00 13.24 C ATOM 223 O ILE E 31 47.073 53.903 7.116 1.00 12.47 O ATOM 224 CB ILE E 31 47.861 56.531 5.935 1.00 13.28 C ATOM 225 CG1 ILE E 31 48.484 57.952 5.935 1.00 13.86 C ATOM 226 CG2 ILE E 31 46.941 56.280 4.697 1.00 12.70 C ATOM 227 CD1 ILE E 31 49.087 58.370 4.564 1.00 13.66 C ATOM 228 N ASP E 32 45.164 54.929 7.746 1.00 12.57 N ATOM 229 CA ASP E 32 44.607 53.671 8.266 1.00 13.03 C ATOM 230 C ASP E 32 43.083 53.836 8.421 1.00 13.69 C ATOM 231 O ASP E 32 42.464 54.591 7.668 1.00 14.20 O ATOM 232 CB ASP E 32 45.310 53.350 9.621 1.00 12.23 C ATOM 233 CG ASP E 32 45.414 51.853 9.881 1.00 14.37 C ATOM 234 OD1 ASP E 32 44.317 51.232 10.035 1.00 12.75 O ATOM 235 OD2 ASP E 32 46.537 51.251 9.952 1.00 14.60 O ATOM 236 N SER E 33 42.497 53.081 9.343 1.00 13.77 N ATOM 237 CA SER E 33 41.048 53.086 9.557 1.00 14.52 C ATOM 238 C SER E 33 40.537 54.161 10.496 1.00 15.02 C ATOM 239 O SER E 33 39.396 54.045 10.976 1.00 15.34 O ATOM 240 CB SER E 33 40.622 51.697 10.073 1.00 14.75 C ATOM 241 OG SER E 33 41.006 51.501 11.453 1.00 14.83 O ATOM 242 N GLY E 34 41.344 55.197 10.784 1.00 14.34 N ATOM 243 CA GLY E 34 40.914 56.156 11.790 1.00 13.72 C ATOM 244 C GLY E 34 41.703 55.951 13.081 1.00 15.21 C ATOM 245 O GLY E 34 42.450 54.984 13.199 1.00 13.99 O ATOM 246 N ILE E 35 41.513 56.841 14.046 1.00 14.34 N ATOM 247 CA ILE E 35 42.109 56.632 15.375 1.00 13.09 C ATOM 248 C ILE E 35 41.063 57.074 16.372 1.00 14.64 C ATOM 249 O ILE E 35 40.559 58.184 16.249 1.00 14.68 O ATOM 250 CB ILE E 35 43.424 57.474 15.611 1.00 12.90 C ATOM 251 CG1 ILE E 35 44.486 57.213 14.508 1.00 13.67 C ATOM 252 CG2 ILE E 35 43.971 57.112 17.022 1.00 12.71 C ATOM 253 CD1 ILE E 35 45.709 58.141 14.702 1.00 11.22 C ATOM 254 N ASP E 36 40.774 56.247 17.372 1.00 15.07 N ATOM 255 CA ASP E 36 39.806 56.616 18.391 1.00 14.94 C ATOM 256 C ASP E 36 40.438 57.659 19.307 1.00 16.41 C ATOM 257 O ASP E 36 41.166 57.342 20.252 1.00 15.50 O ATOM 258 CB ASP E 36 39.385 55.398 19.197 1.00 14.77 C ATOM 259 CG ASP E 36 38.387 55.752 20.309 1.00 18.41 C ATOM 260 OD1 ASP E 36 37.966 56.940 20.439 1.00 19.28 O ATOM 261 OD2 ASP E 36 37.975 54.904 21.091 1.00 21.12 O ATOM 262 N SER E 37 40.116 58.918 19.044 1.00 18.15 N ATOM 263 CA SER E 37 40.738 60.024 19.797 1.00 19.63 C ATOM 264 C SER E 37 40.244 60.143 21.233 1.00 20.11 C ATOM 265 O SER E 37 40.886 60.852 22.006 1.00 22.91 O ATOM 266 CB SER E 37 40.524 61.346 19.052 1.00 20.59 C ATOM 267 OG SER E 37 39.156 61.703 19.092 1.00 21.98 O ATOM 268 N SER E 38 39.174 59.442 21.613 1.00 17.91 N ATOM 269 CA SER E 38 38.714 59.481 23.013 1.00 17.76 C ATOM 270 C SER E 38 39.557 58.564 23.911 1.00 16.22 C ATOM 271 O SER E 38 39.340 58.534 25.123 1.00 16.24 O ATOM 272 CB SER E 38 37.243 59.046 23.170 1.00 17.23 C ATOM 273 OG ASER E 38 37.052 57.730 22.725 0.50 17.41 O ATOM 274 OG BSER E 38 36.365 60.021 22.643 0.50 20.53 O ATOM 275 N HIS E 39 40.462 57.767 23.325 1.00 13.98 N ATOM 276 CA HIS E 39 41.193 56.810 24.159 1.00 12.88 C ATOM 277 C HIS E 39 42.113 57.603 25.099 1.00 13.25 C ATOM 278 O HIS E 39 42.847 58.432 24.618 1.00 13.59 O ATOM 279 CB HIS E 39 42.029 55.867 23.274 1.00 12.64 C ATOM 280 CG HIS E 39 42.456 54.622 23.990 1.00 13.45 C ATOM 281 ND1 HIS E 39 43.321 54.645 25.068 1.00 12.71 N ATOM 282 CD2 HIS E 39 42.158 53.319 23.767 1.00 11.22 C ATOM 283 CE1 HIS E 39 43.481 53.414 25.516 1.00 12.08 C ATOM 284 NE2 HIS E 39 42.799 52.587 24.732 1.00 11.77 N ATOM 285 N PRO E 40 42.101 57.344 26.398 1.00 11.66 N ATOM 286 CA PRO E 40 42.936 58.148 27.303 1.00 12.17 C ATOM 287 C PRO E 40 44.428 57.858 27.176 1.00 12.82 C ATOM 288 O PRO E 40 45.214 58.623 27.725 1.00 14.04 O ATOM 289 CB PRO E 40 42.401 57.797 28.691 1.00 12.94 C ATOM 290 CG PRO E 40 41.957 56.323 28.549 1.00 12.23 C ATOM 291 CD PRO E 40 41.308 56.317 27.140 1.00 11.71 C ATOM 292 N ASP E 41 44.819 56.797 26.462 1.00 12.17 N ATOM 293 CA ASP E 41 46.255 56.532 26.268 1.00 12.82 C ATOM 294 C ASP E 41 46.743 57.023 24.900 1.00 12.26 C ATOM 295 O ASP E 41 47.850 56.660 24.474 1.00 12.63 O ATOM 296 CB ASP E 41 46.512 55.039 26.436 1.00 12.77 C ATOM 297 CG ASP E 41 47.952 54.727 26.895 1.00 14.86 C ATOM 298 OD1 ASP E 41 48.533 55.566 27.589 1.00 11.98 O ATOM 299 OD2 ASP E 41 48.510 53.660 26.581 1.00 15.29 O ATOM 300 N LEU E 42 45.958 57.878 24.237 1.00 12.05 N ATOM 301 CA LEU E 42 46.384 58.443 22.933 1.00 12.79 C ATOM 302 C LEU E 42 46.095 59.927 22.946 1.00 13.20 C ATOM 303 O LEU E 42 45.067 60.390 23.541 1.00 14.36 O ATOM 304 CB LEU E 42 45.559 57.819 21.771 1.00 12.99 C ATOM 305 CG LEU E 42 45.741 56.328 21.500 1.00 12.34 C ATOM 306 CD1 LEU E 42 44.826 55.843 20.353 1.00 10.59 C ATOM 307 CD2 LEU E 42 47.205 56.002 21.184 1.00 13.53 C ATOM 308 N LYS E 43 46.907 60.668 22.220 1.00 13.17 N ATOM 309 CA LYS E 43 46.585 62.082 21.987 1.00 14.86 C ATOM 310 C LYS E 43 46.640 62.320 20.501 1.00 14.92 C ATOM 311 O LYS E 43 47.697 62.205 19.889 1.00 17.47 O ATOM 312 CB LYS E 43 47.577 63.014 22.693 1.00 16.42 C ATOM 313 CG LYS E 43 47.220 64.499 22.447 1.00 19.87 C ATOM 314 CD LYS E 43 48.274 65.386 23.111 1.00 30.16 C ATOM 315 CE LYS E 43 47.783 66.817 23.356 1.00 36.65 C ATOM 316 NZ LYS E 43 48.919 67.601 24.032 1.00 41.08 N ATOM 317 N VAL E 44 45.493 62.584 19.891 1.00 14.14 N ATOM 318 CA VAL E 44 45.478 62.775 18.436 1.00 14.61 C ATOM 319 C VAL E 44 45.501 64.279 18.140 1.00 15.84 C ATOM 320 O VAL E 44 44.643 65.013 18.648 1.00 15.51 O ATOM 321 CB VAL E 44 44.227 62.117 17.806 1.00 14.78 C ATOM 322 CG1 VAL E 44 44.178 62.415 16.305 1.00 16.59 C ATOM 323 CG2 VAL E 44 44.221 60.590 18.074 1.00 16.82 C ATOM 324 N ALA E 45 46.486 64.714 17.344 1.00 15.33 N ATOM 325 CA ALA E 45 46.750 66.138 17.097 1.00 16.52 C ATOM 326 C ALA E 45 45.876 66.658 15.963 1.00 16.67 C ATOM 327 O ALA E 45 45.642 67.885 15.886 1.00 18.65 O ATOM 328 CB ALA E 45 48.231 66.367 16.714 1.00 16.96 C ATOM 329 N GLY E 46 45.427 65.780 15.056 1.00 15.79 N ATOM 330 CA GLY E 46 44.622 66.240 13.917 1.00 15.76 C ATOM 331 C GLY E 46 44.398 65.106 12.965 1.00 16.67 C ATOM 332 O GLY E 46 44.655 63.955 13.325 1.00 16.97 O ATOM 333 N GLY E 47 43.915 65.411 11.770 1.00 16.54 N ATOM 334 CA GLY E 47 43.724 64.388 10.761 1.00 16.59 C ATOM 335 C GLY E 47 42.612 64.779 9.806 1.00 16.52 C ATOM 336 O GLY E 47 42.129 65.920 9.814 1.00 17.44 O ATOM 337 N ALA E 48 42.223 63.820 8.983 1.00 16.77 N ATOM 338 CA ALA E 48 41.221 64.047 7.942 1.00 16.97 C ATOM 339 C ALA E 48 40.762 62.683 7.462 1.00 17.97 C ATOM 340 O ALA E 48 41.512 61.709 7.543 1.00 16.77 O ATOM 341 CB ALA E 48 41.857 64.832 6.809 1.00 16.52 C ATOM 342 N SER E 49 39.503 62.591 6.982 1.00 17.68 N ATOM 343 CA SER E 49 39.036 61.341 6.407 1.00 17.04 C ATOM 344 C SER E 49 38.836 61.455 4.911 1.00 18.43 C ATOM 345 O SER E 49 38.267 62.453 4.430 1.00 19.19 O ATOM 346 CB SER E 49 37.715 60.899 7.028 1.00 17.33 C ATOM 347 OG SER E 49 37.232 59.765 6.289 1.00 18.43 O ATOM 348 N MET E 50 39.305 60.440 4.186 1.00 17.96 N ATOM 349 CA MET E 50 39.157 60.307 2.733 1.00 18.52 C ATOM 350 C MET E 50 38.131 59.215 2.403 1.00 19.72 C ATOM 351 O MET E 50 38.060 58.754 1.236 1.00 21.51 O ATOM 352 CB MET E 50 40.477 59.898 2.114 1.00 17.65 C ATOM 353 CG MET E 50 41.661 60.726 2.601 1.00 18.95 C ATOM 354 SD MET E 50 41.409 62.445 2.183 1.00 23.67 S ATOM 355 CE MET E 50 42.327 63.247 3.439 1.00 25.11 C ATOM 356 N VAL E 51 37.441 58.712 3.425 1.00 19.30 N ATOM 357 CA VAL E 51 36.426 57.654 3.227 1.00 21.18 C ATOM 358 C VAL E 51 35.055 58.332 3.056 1.00 21.67 C ATOM 359 O VAL E 51 34.537 58.967 3.997 1.00 22.26 O ATOM 360 CB VAL E 51 36.415 56.642 4.404 1.00 21.46 C ATOM 361 CG1 VAL E 51 35.269 55.622 4.256 1.00 19.92 C ATOM 362 CG2 VAL E 51 37.796 55.937 4.496 1.00 18.58 C ATOM 363 N PRO E 52 34.493 58.249 1.845 1.00 23.34 N ATOM 364 CA PRO E 52 33.261 58.985 1.520 1.00 23.84 C ATOM 365 C PRO E 52 32.131 58.796 2.545 1.00 24.21 C ATOM 366 O PRO E 52 31.491 59.783 2.928 1.00 25.45 O ATOM 367 CB PRO E 52 32.863 58.371 0.158 1.00 24.02 C ATOM 368 CG PRO E 52 34.186 58.058 -0.479 1.00 24.49 C ATOM 369 CD PRO E 52 34.977 57.460 0.692 1.00 22.56 C ATOM 370 N SER E 53 31.909 57.567 2.995 1.00 24.32 N ATOM 371 CA SER E 53 30.823 57.255 3.913 1.00 25.36 C ATOM 372 C SER E 53 31.195 57.247 5.411 1.00 25.46 C ATOM 373 O SER E 53 30.336 56.954 6.261 1.00 25.86 O ATOM 374 CB SER E 53 30.166 55.923 3.538 1.00 27.04 C ATOM 375 OG SER E 53 30.970 54.819 3.944 1.00 31.67 O ATOM 376 N GLU E 54 32.452 57.567 5.751 1.00 23.57 N ATOM 377 CA GLU E 54 32.833 57.680 7.165 1.00 23.15 C ATOM 378 C GLU E 54 33.692 58.917 7.310 1.00 22.97 C ATOM 379 O GLU E 54 34.925 58.839 7.219 1.00 23.46 O ATOM 380 CB GLU E 54 33.623 56.453 7.628 1.00 23.44 C ATOM 381 CG GLU E 54 32.893 55.143 7.521 1.00 24.85 C ATOM 382 CD GLU E 54 33.709 54.002 8.120 1.00 27.30 C ATOM 383 OE1 GLU E 54 34.647 54.310 8.905 1.00 27.46 O ATOM 384 OE2 GLU E 54 33.433 52.821 7.784 1.00 27.88 O ATOM 385 N THR E 55 33.053 60.054 7.547 1.00 22.33 N ATOM 386 CA THR E 55 33.722 61.334 7.403 1.00 23.21 C ATOM 387 C THR E 55 34.483 61.781 8.637 1.00 21.39 C ATOM 388 O THR E 55 35.150 62.815 8.594 1.00 21.40 O ATOM 389 CB THR E 55 32.707 62.453 7.024 1.00 24.19 C ATOM 390 OG1 THR E 55 31.769 62.620 8.103 1.00 25.27 O ATOM 391 CG2 THR E 55 31.865 62.044 5.798 1.00 26.83 C ATOM 392 N ASN E 56 34.386 61.023 9.733 1.00 20.52 N ATOM 393 CA ASN E 56 35.069 61.379 10.963 1.00 20.07 C ATOM 394 C ASN E 56 36.351 60.519 11.146 1.00 18.84 C ATOM 395 O ASN E 56 36.241 59.323 11.426 1.00 17.53 O ATOM 396 CB ASN E 56 34.138 61.153 12.174 1.00 20.41 C ATOM 397 CG ASN E 56 34.743 61.696 13.473 1.00 22.71 C ATOM 398 OD1 ASN E 56 35.892 62.103 13.504 1.00 20.56 O ATOM 399 ND2 ASN E 56 33.951 61.740 14.534 1.00 25.93 N ATOM 400 N PRO E 57 37.541 61.108 10.998 1.00 18.16 N ATOM 401 CA PRO E 57 38.790 60.317 11.141 1.00 18.28 C ATOM 402 C PRO E 57 39.076 59.915 12.595 1.00 17.21 C ATOM 403 O PRO E 57 39.938 59.045 12.803 1.00 16.70 O ATOM 404 CB PRO E 57 39.884 61.282 10.635 1.00 16.91 C ATOM 405 CG PRO E 57 39.321 62.671 10.993 1.00 18.60 C ATOM 406 CD PRO E 57 37.813 62.530 10.738 1.00 17.84 C ATOM 407 N PHE E 58 38.342 60.490 13.552 1.00 17.54 N ATOM 408 CA PHE E 58 38.561 60.273 14.993 1.00 17.61 C ATOM 409 C PHE E 58 37.616 59.242 15.552 1.00 17.95 C ATOM 410 O PHE E 58 37.544 59.063 16.756 1.00 18.94 O ATOM 411 CB PHE E 58 38.413 61.616 15.703 1.00 16.85 C ATOM 412 CG PHE E 58 39.242 62.700 15.064 1.00 19.00 C ATOM 413 CD1 PHE E 58 40.619 62.511 14.877 1.00 18.04 C ATOM 414 CD2 PHE E 58 38.639 63.886 14.592 1.00 18.59 C ATOM 415 CE1 PHE E 58 41.408 63.501 14.288 1.00 16.42 C ATOM 416 CE2 PHE E 58 39.412 64.889 13.994 1.00 19.28 C ATOM 417 CZ PHE E 58 40.804 64.696 13.828 1.00 20.15 C ATOM 418 N GLN E 59 36.886 58.591 14.646 1.00 18.06 N ATOM 419 CA GLN E 59 36.067 57.451 14.958 1.00 19.21 C ATOM 420 C GLN E 59 36.680 56.293 14.186 1.00 18.98 C ATOM 421 O GLN E 59 36.723 56.301 12.942 1.00 19.64 O ATOM 422 CB GLN E 59 34.612 57.675 14.527 1.00 21.73 C ATOM 423 CG GLN E 59 33.714 56.491 14.944 1.00 24.96 C ATOM 424 CD GLN E 59 32.257 56.839 14.772 1.00 35.03 C ATOM 425 OE1 GLN E 59 31.838 57.968 15.107 1.00 38.97 O ATOM 426 NE2 GLN E 59 31.479 55.903 14.232 1.00 36.53 N ATOM 427 N ASP E 60 37.150 55.295 14.922 1.00 16.23 N ATOM 428 CA ASP E 60 37.703 54.105 14.301 1.00 16.79 C ATOM 429 C ASP E 60 36.720 52.947 14.460 1.00 16.61 C ATOM 430 O ASP E 60 36.611 52.323 15.504 1.00 16.85 O ATOM 431 CB ASP E 60 39.073 53.771 14.942 1.00 16.75 C ATOM 432 CG ASP E 60 39.652 52.465 14.436 1.00 17.14 C ATOM 433 OD1 ASP E 60 39.175 51.840 13.428 1.00 14.60 O ATOM 434 OD2 ASP E 60 40.641 51.972 14.998 1.00 14.18 O ATOM 435 N ASN E 61 35.980 52.688 13.380 1.00 18.28 N ATOM 436 CA ASN E 61 34.998 51.601 13.369 1.00 18.77 C ATOM 437 C ASN E 61 35.542 50.208 13.098 1.00 19.15 C ATOM 438 O ASN E 61 34.775 49.239 13.060 1.00 19.95 O ATOM 439 CB ASN E 61 33.943 51.940 12.302 1.00 20.09 C ATOM 440 CG ASN E 61 33.252 53.231 12.612 1.00 21.48 C ATOM 441 OD1 ASN E 61 32.704 53.386 13.697 1.00 26.04 O ATOM 442 ND2 ASN E 61 33.294 54.171 11.680 1.00 24.90 N ATOM 443 N ASN E 62 36.846 50.082 12.917 1.00 16.18 N ATOM 444 CA ASN E 62 37.450 48.771 12.654 1.00 15.02 C ATOM 445 C ASN E 62 38.227 48.267 13.878 1.00 15.35 C ATOM 446 O ASN E 62 38.079 47.104 14.273 1.00 16.22 O ATOM 447 CB ASN E 62 38.381 48.895 11.425 1.00 13.99 C ATOM 448 CG ASN E 62 39.111 47.651 11.128 1.00 15.24 C ATOM 449 OD1 ASN E 62 40.035 47.294 11.843 1.00 16.52 O ATOM 450 ND2 ASN E 62 38.666 46.905 10.099 1.00 16.26 N ATOM 451 N SER E 63 39.041 49.178 14.438 1.00 14.12 N ATOM 452 CA SER E 63 39.986 48.979 15.581 1.00 13.69 C ATOM 453 C SER E 63 41.455 48.971 15.165 1.00 12.98 C ATOM 454 O SER E 63 42.337 49.286 15.994 1.00 13.48 O ATOM 455 CB SER E 63 39.746 47.679 16.369 1.00 13.50 C ATOM 456 OG SER E 63 40.330 46.570 15.716 1.00 16.74 O ATOM 457 N HIS E 64 41.713 48.691 13.906 1.00 11.67 N ATOM 458 CA HIS E 64 43.081 48.466 13.447 1.00 12.13 C ATOM 459 C HIS E 64 43.890 49.772 13.536 1.00 12.18 C ATOM 460 O HIS E 64 45.038 49.732 14.040 1.00 12.34 O ATOM 461 CB HIS E 64 43.016 47.948 12.027 1.00 12.70 C ATOM 462 CG HIS E 64 44.344 47.701 11.377 1.00 12.99 C ATOM 463 ND1 HIS E 64 45.017 48.668 10.662 1.00 12.88 N ATOM 464 CD2 HIS E 64 45.060 46.557 11.229 1.00 13.51 C ATOM 465 CE1 HIS E 64 46.094 48.133 10.110 1.00 10.32 C ATOM 466 NE2 HIS E 64 46.159 46.861 10.462 1.00 14.48 N ATOM 467 N GLY E 65 43.342 50.891 13.057 1.00 11.89 N ATOM 468 CA GLY E 65 44.088 52.160 13.070 1.00 11.59 C ATOM 469 C GLY E 65 44.466 52.590 14.488 1.00 12.24 C ATOM 470 O GLY E 65 45.528 53.169 14.723 1.00 12.61 O ATOM 471 N THR E 66 43.579 52.337 15.450 1.00 12.85 N ATOM 472 CA THR E 66 43.834 52.685 16.846 1.00 12.90 C ATOM 473 C THR E 66 44.967 51.809 17.435 1.00 12.80 C ATOM 474 O THR E 66 45.821 52.285 18.177 1.00 12.31 O ATOM 475 CB THR E 66 42.516 52.483 17.631 1.00 13.68 C ATOM 476 OG1 THR E 66 41.555 53.411 17.119 1.00 14.94 O ATOM 477 CG2 THR E 66 42.679 52.828 19.147 1.00 12.97 C ATOM 478 N HIS E 67 44.982 50.544 17.070 1.00 11.65 N ATOM 479 CA HIS E 67 46.054 49.681 17.566 1.00 11.82 C ATOM 480 C HIS E 67 47.417 50.131 16.984 1.00 11.58 C ATOM 481 O HIS E 67 48.433 50.250 17.726 1.00 11.51 O ATOM 482 CB HIS E 67 45.720 48.227 17.171 1.00 11.83 C ATOM 483 CG HIS E 67 46.565 47.213 17.855 1.00 11.63 C ATOM 484 ND1 HIS E 67 47.855 46.909 17.463 1.00 11.42 N ATOM 485 CD2 HIS E 67 46.306 46.446 18.939 1.00 9.49 C ATOM 486 CE1 HIS E 67 48.352 45.996 18.279 1.00 10.36 C ATOM 487 NE2 HIS E 67 47.434 45.699 19.183 1.00 10.86 N ATOM 488 N VAL E 68 47.455 50.329 15.653 1.00 10.77 N ATOM 489 CA VAL E 68 48.647 50.834 15.003 1.00 11.15 C ATOM 490 C VAL E 68 49.089 52.141 15.646 1.00 11.40 C ATOM 491 O VAL E 68 50.298 52.321 15.896 1.00 11.68 O ATOM 492 CB VAL E 68 48.417 51.017 13.486 1.00 10.78 C ATOM 493 CG1 VAL E 68 49.560 51.767 12.769 1.00 10.77 C ATOM 494 CG2 VAL E 68 48.233 49.599 12.861 1.00 9.23 C ATOM 495 N ALA E 69 48.130 53.042 15.878 1.00 11.95 N ATOM 496 CA ALA E 69 48.495 54.336 16.472 1.00 11.13 C ATOM 497 C ALA E 69 49.143 54.184 17.835 1.00 11.98 C ATOM 498 O ALA E 69 50.044 54.946 18.170 1.00 10.98 O ATOM 499 CB ALA E 69 47.250 55.299 16.553 1.00 12.34 C ATOM 500 N GLY E 70 48.608 53.286 18.689 1.00 10.91 N ATOM 501 CA GLY E 70 49.216 53.061 19.998 1.00 10.25 C ATOM 502 C GLY E 70 50.639 52.535 19.959 1.00 11.46 C ATOM 503 O GLY E 70 51.424 52.805 20.870 1.00 10.94 O ATOM 504 N THR E 71 50.979 51.718 18.961 1.00 10.87 N ATOM 505 CA THR E 71 52.357 51.273 18.878 1.00 9.73 C ATOM 506 C THR E 71 53.244 52.477 18.518 1.00 9.71 C ATOM 507 O THR E 71 54.340 52.634 19.090 1.00 10.46 O ATOM 508 CB THR E 71 52.448 50.209 17.792 1.00 10.25 C ATOM 509 OG1 THR E 71 51.716 49.058 18.255 1.00 11.08 O ATOM 510 CG2 THR E 71 53.925 49.745 17.612 1.00 9.55 C ATOM 511 N VAL E 72 52.778 53.318 17.607 1.00 9.13 N ATOM 512 CA VAL E 72 53.565 54.532 17.262 1.00 9.27 C ATOM 513 C VAL E 72 53.758 55.405 18.516 1.00 10.30 C ATOM 514 O VAL E 72 54.871 55.904 18.776 1.00 10.88 O ATOM 515 CB VAL E 72 52.884 55.393 16.168 1.00 9.68 C ATOM 516 CG1 VAL E 72 53.777 56.651 15.841 1.00 11.78 C ATOM 517 CG2 VAL E 72 52.658 54.568 14.891 1.00 10.90 C ATOM 518 N ALA E 73 52.655 55.667 19.230 1.00 10.01 N ATOM 519 CA ALA E 73 52.648 56.863 20.082 1.00 11.04 C ATOM 520 C ALA E 73 51.714 56.803 21.284 1.00 11.74 C ATOM 521 O ALA E 73 51.363 57.872 21.837 1.00 11.21 O ATOM 522 CB ALA E 73 52.301 58.102 19.222 1.00 11.61 C ATOM 523 N ALA E 74 51.388 55.604 21.806 1.00 10.35 N ATOM 524 CA ALA E 74 50.645 55.591 23.076 1.00 10.37 C ATOM 525 C ALA E 74 51.403 56.424 24.138 1.00 10.72 C ATOM 526 O ALA E 74 52.635 56.389 24.233 1.00 10.34 O ATOM 527 CB ALA E 74 50.400 54.169 23.578 1.00 9.62 C ATOM 528 N LEU E 75 50.637 57.151 24.932 1.00 10.79 N ATOM 529 CA LEU E 75 51.221 58.195 25.833 1.00 11.38 C ATOM 530 C LEU E 75 52.050 57.586 26.981 1.00 11.55 C ATOM 531 O LEU E 75 51.808 56.466 27.450 1.00 11.72 O ATOM 532 CB LEU E 75 50.086 59.041 26.453 1.00 10.29 C ATOM 533 CG LEU E 75 49.264 59.835 25.421 1.00 11.18 C ATOM 534 CD1 LEU E 75 48.029 60.458 26.128 1.00 12.86 C ATOM 535 CD2 LEU E 75 50.165 60.938 24.704 1.00 11.39 C ATOM 536 N ASN E 76 53.071 58.343 27.367 1.00 11.41 N ATOM 537 CA ASN E 76 53.847 58.001 28.536 1.00 12.71 C ATOM 538 C ASN E 76 53.174 58.568 29.798 1.00 12.61 C ATOM 539 O ASN E 76 53.209 59.800 30.045 1.00 13.32 O ATOM 540 CB ASN E 76 55.247 58.590 28.378 1.00 12.16 C ATOM 541 CG ASN E 76 56.179 58.199 29.539 1.00 13.32 C ATOM 542 OD1 ASN E 76 55.960 57.173 30.213 1.00 13.46 O ATOM 543 ND2 ASN E 76 57.217 59.057 29.801 1.00 14.62 N ATOM 544 N ASN E 77 52.594 57.686 30.587 1.00 11.48 N ATOM 545 CA ASN E 77 51.813 58.092 31.766 1.00 11.58 C ATOM 546 C ASN E 77 51.727 56.861 32.675 1.00 12.98 C ATOM 547 O ASN E 77 52.611 56.027 32.623 1.00 12.00 O ATOM 548 CB ASN E 77 50.422 58.611 31.342 1.00 12.00 C ATOM 549 CG ASN E 77 49.716 57.646 30.381 1.00 11.18 C ATOM 550 OD1 ASN E 77 50.009 56.441 30.374 1.00 10.29 O ATOM 551 ND2 ASN E 77 48.791 58.177 29.563 1.00 13.41 N ATOM 552 N SER E 78 50.701 56.757 33.521 1.00 12.84 N ATOM 553 CA SER E 78 50.609 55.641 34.462 1.00 13.64 C ATOM 554 C SER E 78 49.554 54.630 34.019 1.00 12.95 C ATOM 555 O SER E 78 49.081 53.822 34.828 1.00 12.72 O ATOM 556 CB SER E 78 50.353 56.165 35.928 1.00 15.29 C ATOM 557 OG SER E 78 49.102 56.863 35.981 1.00 16.43 O ATOM 558 N ILE E 79 49.183 54.663 32.746 1.00 13.03 N ATOM 559 CA ILE E 79 48.153 53.745 32.239 1.00 13.52 C ATOM 560 C ILE E 79 48.520 52.998 30.968 1.00 13.20 C ATOM 561 O ILE E 79 49.365 53.448 30.186 1.00 12.19 O ATOM 562 CB ILE E 79 46.773 54.457 32.001 1.00 13.72 C ATOM 563 CG1 ILE E 79 46.886 55.516 30.905 1.00 13.75 C ATOM 564 CG2 ILE E 79 46.228 55.085 33.322 1.00 15.57 C ATOM 565 CD1 ILE E 79 45.526 55.864 30.227 1.00 16.97 C ATOM 566 N GLY E 80 47.839 51.863 30.782 1.00 13.52 N ATOM 567 CA GLY E 80 47.840 51.217 29.483 1.00 11.93 C ATOM 568 C GLY E 80 49.224 50.788 29.014 1.00 12.26 C ATOM 569 O GLY E 80 49.990 50.220 29.783 1.00 12.85 O ATOM 570 N VAL E 81 49.510 51.084 27.753 1.00 11.67 N ATOM 571 CA VAL E 81 50.816 50.761 27.189 1.00 11.90 C ATOM 572 C VAL E 81 51.601 52.056 26.980 1.00 12.11 C ATOM 573 O VAL E 81 51.040 53.186 27.038 1.00 14.33 O ATOM 574 CB VAL E 81 50.678 50.021 25.852 1.00 11.54 C ATOM 575 CG1 VAL E 81 50.066 48.583 26.073 1.00 12.28 C ATOM 576 CG2 VAL E 81 49.789 50.815 24.841 1.00 12.37 C ATOM 577 N LEU E 82 52.881 51.892 26.705 1.00 12.82 N ATOM 578 CA LEU E 82 53.770 52.981 26.254 1.00 11.74 C ATOM 579 C LEU E 82 54.063 52.807 24.778 1.00 11.64 C ATOM 580 O LEU E 82 54.391 51.683 24.348 1.00 12.79 O ATOM 581 CB LEU E 82 55.074 52.846 27.036 1.00 11.04 C ATOM 582 CG LEU E 82 56.202 53.844 26.678 1.00 11.08 C ATOM 583 CD1 LEU E 82 55.732 55.258 27.031 1.00 10.53 C ATOM 584 CD2 LEU E 82 57.513 53.470 27.508 1.00 13.13 C ATOM 585 N GLY E 83 53.997 53.902 24.015 1.00 10.94 N ATOM 586 CA GLY E 83 54.321 53.876 22.592 1.00 10.41 C ATOM 587 C GLY E 83 55.809 53.985 22.343 1.00 10.78 C ATOM 588 O GLY E 83 56.588 54.342 23.242 1.00 10.93 O ATOM 589 N VAL E 84 56.209 53.625 21.127 1.00 10.87 N ATOM 590 CA VAL E 84 57.591 53.875 20.706 1.00 10.40 C ATOM 591 C VAL E 84 58.003 55.357 20.813 1.00 10.23 C ATOM 592 O VAL E 84 59.106 55.635 21.296 1.00 11.03 O ATOM 593 CB VAL E 84 57.814 53.373 19.273 1.00 10.99 C ATOM 594 CG1 VAL E 84 59.234 53.684 18.774 1.00 10.67 C ATOM 595 CG2 VAL E 84 57.660 51.787 19.247 1.00 12.15 C ATOM 596 N ALA E 85 57.141 56.270 20.334 1.00 9.99 N ATOM 597 CA ALA E 85 57.420 57.729 20.276 1.00 10.67 C ATOM 598 C ALA E 85 56.275 58.457 20.987 1.00 9.30 C ATOM 599 O ALA E 85 55.377 59.007 20.308 1.00 9.52 O ATOM 600 CB ALA E 85 57.556 58.208 18.764 1.00 9.89 C ATOM 601 N PRO E 86 56.237 58.349 22.319 1.00 9.78 N ATOM 602 CA PRO E 86 55.023 58.724 23.091 1.00 10.84 C ATOM 603 C PRO E 86 54.724 60.222 23.048 1.00 12.04 C ATOM 604 O PRO E 86 53.621 60.602 23.403 1.00 12.01 O ATOM 605 CB PRO E 86 55.328 58.228 24.516 1.00 12.37 C ATOM 606 CG PRO E 86 56.850 58.204 24.564 1.00 11.44 C ATOM 607 CD PRO E 86 57.259 57.739 23.197 1.00 10.63 C ATOM 608 N SER E 87 55.683 61.043 22.623 1.00 12.32 N ATOM 609 CA SER E 87 55.396 62.483 22.455 1.00 12.18 C ATOM 610 C SER E 87 55.123 62.904 21.010 1.00 12.32 C ATOM 611 O SER E 87 54.971 64.095 20.714 1.00 12.75 O ATOM 612 CB SER E 87 56.551 63.362 22.996 1.00 12.08 C ATOM 613 OG SER E 87 56.788 63.066 24.355 1.00 13.26 O ATOM 614 N ALA E 88 55.053 61.961 20.087 1.00 11.71 N ATOM 615 CA ALA E 88 54.855 62.348 18.692 1.00 12.32 C ATOM 616 C ALA E 88 53.489 62.987 18.484 1.00 13.13 C ATOM 617 O ALA E 88 52.538 62.724 19.248 1.00 14.83 O ATOM 618 CB ALA E 88 54.998 61.111 17.755 1.00 13.80 C ATOM 619 N SER E 89 53.410 63.865 17.473 1.00 13.03 N ATOM 620 CA SER E 89 52.138 64.488 17.090 1.00 13.33 C ATOM 621 C SER E 89 51.485 63.533 16.137 1.00 13.92 C ATOM 622 O SER E 89 51.960 63.307 15.013 1.00 13.79 O ATOM 623 CB SER E 89 52.369 65.864 16.404 1.00 13.45 C ATOM 624 OG SER E 89 52.993 66.752 17.327 1.00 15.29 O ATOM 625 N LEU E 90 50.408 62.940 16.609 1.00 13.90 N ATOM 626 CA LEU E 90 49.752 61.854 15.907 1.00 13.88 C ATOM 627 C LEU E 90 48.584 62.335 15.044 1.00 14.83 C ATOM 628 O LEU E 90 47.680 62.975 15.563 1.00 14.32 O ATOM 629 CB LEU E 90 49.235 60.906 17.006 1.00 15.47 C ATOM 630 CG LEU E 90 48.641 59.558 16.709 1.00 17.83 C ATOM 631 CD1 LEU E 90 49.647 58.678 15.915 1.00 19.03 C ATOM 632 CD2 LEU E 90 48.174 58.848 18.016 1.00 16.40 C ATOM 633 N TYR E 91 48.551 61.979 13.758 1.00 13.33 N ATOM 634 CA TYR E 91 47.456 62.405 12.890 1.00 13.22 C ATOM 635 C TYR E 91 46.668 61.203 12.384 1.00 13.80 C ATOM 636 O TYR E 91 47.254 60.247 11.889 1.00 13.91 O ATOM 637 CB TYR E 91 48.001 63.242 11.723 1.00 13.76 C ATOM 638 CG TYR E 91 48.572 64.537 12.244 1.00 12.69 C ATOM 639 CD1 TYR E 91 49.852 64.557 12.832 1.00 14.26 C ATOM 640 CD2 TYR E 91 47.825 65.719 12.201 1.00 15.62 C ATOM 641 CE1 TYR E 91 50.366 65.711 13.375 1.00 15.07 C ATOM 642 CE2 TYR E 91 48.342 66.904 12.759 1.00 16.29 C ATOM 643 CZ TYR E 91 49.613 66.877 13.300 1.00 18.87 C ATOM 644 OH TYR E 91 50.181 67.999 13.836 1.00 20.48 O ATOM 645 N ALA E 92 45.341 61.235 12.564 1.00 13.60 N ATOM 646 CA ALA E 92 44.468 60.176 12.022 1.00 13.69 C ATOM 647 C ALA E 92 44.089 60.495 10.577 1.00 14.80 C ATOM 648 O ALA E 92 43.320 61.430 10.329 1.00 14.59 O ATOM 649 CB ALA E 92 43.184 60.105 12.850 1.00 12.79 C ATOM 650 N VAL E 93 44.640 59.735 9.637 1.00 14.20 N ATOM 651 CA VAL E 93 44.374 59.964 8.213 1.00 14.85 C ATOM 652 C VAL E 93 43.585 58.752 7.769 1.00 14.96 C ATOM 653 O VAL E 93 44.128 57.713 7.459 1.00 14.15 O ATOM 654 CB VAL E 93 45.662 60.198 7.393 1.00 14.72 C ATOM 655 CG1 VAL E 93 45.279 60.447 5.883 1.00 15.25 C ATOM 656 CG2 VAL E 93 46.416 61.424 7.960 1.00 14.66 C ATOM 657 N LYS E 94 42.262 58.879 7.827 1.00 14.59 N ATOM 658 CA LYS E 94 41.403 57.721 7.627 1.00 15.35 C ATOM 659 C LYS E 94 41.175 57.478 6.135 1.00 16.67 C ATOM 660 O LYS E 94 40.577 58.311 5.450 1.00 16.01 O ATOM 661 CB LYS E 94 40.048 57.926 8.328 1.00 16.35 C ATOM 662 CG LYS E 94 39.137 56.697 8.188 1.00 18.18 C ATOM 663 CD LYS E 94 37.738 57.039 8.634 1.00 24.45 C ATOM 664 CE LYS E 94 37.423 56.462 9.963 1.00 28.69 C ATOM 665 NZ LYS E 94 35.944 56.487 10.334 1.00 26.32 N ATOM 666 N VAL E 95 41.656 56.340 5.657 1.00 15.11 N ATOM 667 CA VAL E 95 41.493 55.951 4.267 1.00 15.89 C ATOM 668 C VAL E 95 40.873 54.554 4.115 1.00 16.49 C ATOM 669 O VAL E 95 40.635 54.114 2.976 1.00 16.67 O ATOM 670 CB VAL E 95 42.845 55.996 3.508 1.00 14.61 C ATOM 671 CG1 VAL E 95 43.527 57.434 3.684 1.00 14.83 C ATOM 672 CG2 VAL E 95 43.810 54.885 4.018 1.00 15.57 C ATOM 673 N LEU E 96 40.649 53.868 5.244 1.00 16.29 N ATOM 674 CA LEU E 96 40.004 52.535 5.279 1.00 16.35 C ATOM 675 C LEU E 96 38.693 52.642 6.044 1.00 16.52 C ATOM 676 O LEU E 96 38.610 53.335 7.073 1.00 16.27 O ATOM 677 CB LEU E 96 40.919 51.504 6.003 1.00 15.69 C ATOM 678 CG LEU E 96 42.359 51.408 5.441 1.00 15.97 C ATOM 679 CD1 LEU E 96 43.223 50.404 6.187 1.00 16.13 C ATOM 680 CD2 LEU E 96 42.391 51.073 3.894 1.00 14.60 C ATOM 681 N GLY E 97 37.645 51.973 5.528 1.00 18.03 N ATOM 682 CA GLY E 97 36.381 51.932 6.250 1.00 17.79 C ATOM 683 C GLY E 97 36.354 50.870 7.335 1.00 18.83 C ATOM 684 O GLY E 97 37.372 50.201 7.627 1.00 19.04 O ATOM 685 N ALA E 98 35.172 50.720 7.949 1.00 17.91 N ATOM 686 CA ALA E 98 34.956 49.713 8.996 1.00 18.71 C ATOM 687 C ALA E 98 35.426 48.303 8.610 1.00 18.10 C ATOM 688 O ALA E 98 35.944 47.542 9.460 1.00 17.30 O ATOM 689 CB ALA E 98 33.449 49.677 9.438 1.00 17.93 C ATOM 690 N ASP E 99 35.258 47.938 7.335 1.00 18.25 N ATOM 691 CA ASP E 99 35.600 46.586 6.922 1.00 18.18 C ATOM 692 C ASP E 99 37.077 46.377 6.630 1.00 18.24 C ATOM 693 O ASP E 99 37.478 45.324 6.182 1.00 17.42 O ATOM 694 CB ASP E 99 34.725 46.100 5.741 1.00 18.82 C ATOM 695 CG ASP E 99 34.986 46.843 4.445 1.00 22.84 C ATOM 696 OD1 ASP E 99 35.954 47.662 4.324 1.00 21.02 O ATOM 697 OD2 ASP E 99 34.206 46.675 3.473 1.00 25.03 O ATOM 698 N GLY E 100 37.890 47.392 6.895 1.00 17.69 N ATOM 699 CA GLY E 100 39.322 47.255 6.694 1.00 17.37 C ATOM 700 C GLY E 100 39.815 47.511 5.291 1.00 16.95 C ATOM 701 O GLY E 100 40.977 47.270 5.033 1.00 16.79 O ATOM 702 N SER E 101 38.964 47.977 4.371 1.00 17.10 N ATOM 703 CA SER E 101 39.402 48.140 2.976 1.00 16.87 C ATOM 704 C SER E 101 39.220 49.594 2.520 1.00 15.60 C ATOM 705 O SER E 101 38.397 50.325 3.050 1.00 16.75 O ATOM 706 CB SER E 101 38.613 47.226 2.035 1.00 16.97 C ATOM 707 OG SER E 101 37.299 47.744 1.899 1.00 20.34 O ATOM 708 N GLY E 102 40.021 50.013 1.549 1.00 16.19 N ATOM 709 CA GLY E 102 39.800 51.311 0.927 1.00 16.09 C ATOM 710 C GLY E 102 40.163 51.263 -0.540 1.00 16.56 C ATOM 711 O GLY E 102 40.981 50.447 -0.975 1.00 16.70 O ATOM 712 N GLN E 103 39.584 52.184 -1.302 1.00 17.06 N ATOM 713 CA GLN E 103 39.927 52.287 -2.722 1.00 19.23 C ATOM 714 C GLN E 103 41.292 52.933 -2.853 1.00 18.94 C ATOM 715 O GLN E 103 41.683 53.749 -1.990 1.00 19.49 O ATOM 716 CB AGLN E 103 38.866 53.143 -3.432 0.50 19.28 C ATOM 717 CB BGLN E 103 38.869 53.128 -3.450 0.50 19.73 C ATOM 718 CG AGLN E 103 37.444 52.640 -3.156 0.50 20.44 C ATOM 719 CG BGLN E 103 37.562 52.360 -3.744 0.50 22.91 C ATOM 720 CD AGLN E 103 36.372 53.194 -4.077 0.50 22.24 C ATOM 721 CD BGLN E 103 37.730 51.276 -4.801 0.50 26.44 C ATOM 722 OE1AGLN E 103 36.606 54.113 -4.869 0.50 23.86 O ATOM 723 OE1BGLN E 103 38.470 51.452 -5.780 0.50 29.22 O ATOM 724 NE2AGLN E 103 35.179 52.632 -3.968 0.50 22.74 N ATOM 725 NE2BGLN E 103 37.039 50.154 -4.614 0.50 28.44 N ATOM 726 N TYR E 104 42.008 52.631 -3.933 1.00 18.98 N ATOM 727 CA TYR E 104 43.332 53.200 -4.119 1.00 19.43 C ATOM 728 C TYR E 104 43.310 54.727 -4.061 1.00 19.97 C ATOM 729 O TYR E 104 44.220 55.327 -3.496 1.00 19.09 O ATOM 730 CB TYR E 104 43.995 52.724 -5.430 1.00 20.18 C ATOM 731 CG TYR E 104 44.692 51.380 -5.326 1.00 20.38 C ATOM 732 CD1 TYR E 104 44.022 50.257 -4.839 1.00 23.87 C ATOM 733 CD2 TYR E 104 46.018 51.210 -5.744 1.00 21.98 C ATOM 734 CE1 TYR E 104 44.640 49.012 -4.766 1.00 24.30 C ATOM 735 CE2 TYR E 104 46.642 49.935 -5.679 1.00 22.35 C ATOM 736 CZ TYR E 104 45.944 48.854 -5.175 1.00 24.73 C ATOM 737 OH TYR E 104 46.517 47.596 -5.076 1.00 27.68 O ATOM 738 N SER E 105 42.291 55.342 -4.661 1.00 18.69 N ATOM 739 CA SER E 105 42.195 56.781 -4.643 1.00 19.61 C ATOM 740 C SER E 105 42.057 57.362 -3.222 1.00 18.84 C ATOM 741 O SER E 105 42.513 58.489 -2.983 1.00 18.33 O ATOM 742 CB SER E 105 41.032 57.248 -5.516 1.00 20.47 C ATOM 743 OG SER E 105 39.803 56.881 -4.915 1.00 21.65 O ATOM 744 N TRP E 106 41.434 56.621 -2.292 1.00 18.58 N ATOM 745 CA TRP E 106 41.343 57.106 -0.922 1.00 18.60 C ATOM 746 C TRP E 106 42.736 57.107 -0.283 1.00 17.68 C ATOM 747 O TRP E 106 43.078 58.057 0.423 1.00 18.50 O ATOM 748 CB TRP E 106 40.386 56.239 -0.080 1.00 18.51 C ATOM 749 CG TRP E 106 38.959 56.036 -0.661 1.00 20.80 C ATOM 750 CD1 TRP E 106 38.357 56.687 -1.748 1.00 23.04 C ATOM 751 CD2 TRP E 106 37.987 55.104 -0.175 1.00 21.00 C ATOM 752 NE1 TRP E 106 37.080 56.199 -1.926 1.00 23.00 N ATOM 753 CE2 TRP E 106 36.829 55.227 -0.985 1.00 21.29 C ATOM 754 CE3 TRP E 106 37.973 54.186 0.885 1.00 20.56 C ATOM 755 CZ2 TRP E 106 35.690 54.443 -0.780 1.00 22.95 C ATOM 756 CZ3 TRP E 106 36.837 53.402 1.087 1.00 21.26 C ATOM 757 CH2 TRP E 106 35.717 53.535 0.261 1.00 21.38 C ATOM 758 N ILE E 107 43.508 56.047 -0.524 1.00 18.11 N ATOM 759 CA ILE E 107 44.865 55.923 0.053 1.00 16.40 C ATOM 760 C ILE E 107 45.726 57.053 -0.519 1.00 17.32 C ATOM 761 O ILE E 107 46.446 57.747 0.219 1.00 16.54 O ATOM 762 CB ILE E 107 45.491 54.518 -0.225 1.00 17.72 C ATOM 763 CG1 ILE E 107 44.984 53.463 0.792 1.00 18.48 C ATOM 764 CG2 ILE E 107 47.036 54.584 -0.088 1.00 17.74 C ATOM 765 CD1 ILE E 107 43.514 53.109 0.747 1.00 19.44 C ATOM 766 N ILE E 108 45.601 57.275 -1.835 1.00 15.87 N ATOM 767 CA ILE E 108 46.374 58.340 -2.485 1.00 16.02 C ATOM 768 C ILE E 108 45.942 59.722 -1.936 1.00 16.59 C ATOM 769 O ILE E 108 46.789 60.573 -1.643 1.00 15.98 O ATOM 770 CB ILE E 108 46.181 58.260 -4.016 1.00 17.20 C ATOM 771 CG1 ILE E 108 46.886 57.016 -4.537 1.00 17.13 C ATOM 772 CG2 ILE E 108 46.736 59.567 -4.707 1.00 18.29 C ATOM 773 CD1 ILE E 108 46.375 56.562 -5.971 1.00 18.18 C ATOM 774 N ASN E 109 44.643 59.940 -1.771 1.00 15.78 N ATOM 775 CA ASN E 109 44.188 61.205 -1.190 1.00 16.53 C ATOM 776 C ASN E 109 44.766 61.433 0.228 1.00 17.42 C ATOM 777 O ASN E 109 45.108 62.551 0.598 1.00 17.07 O ATOM 778 CB ASN E 109 42.656 61.377 -1.167 1.00 17.88 C ATOM 779 CG ASN E 109 42.067 61.581 -2.564 1.00 21.33 C ATOM 780 OD1 ASN E 109 42.777 61.942 -3.478 1.00 24.83 O ATOM 781 ND2 ASN E 109 40.784 61.265 -2.732 1.00 23.51 N ATOM 782 N GLY E 110 44.900 60.354 0.999 1.00 16.63 N ATOM 783 CA GLY E 110 45.463 60.467 2.348 1.00 15.95 C ATOM 784 C GLY E 110 46.965 60.824 2.282 1.00 14.96 C ATOM 785 O GLY E 110 47.441 61.626 3.103 1.00 15.11 O ATOM 786 N ILE E 111 47.717 60.169 1.389 1.00 15.36 N ATOM 787 CA ILE E 111 49.126 60.489 1.223 1.00 15.32 C ATOM 788 C ILE E 111 49.276 61.955 0.788 1.00 16.03 C ATOM 789 O ILE E 111 50.109 62.682 1.340 1.00 15.48 O ATOM 790 CB ILE E 111 49.786 59.555 0.188 1.00 15.49 C ATOM 791 CG1 ILE E 111 49.740 58.101 0.684 1.00 13.95 C ATOM 792 CG2 ILE E 111 51.233 59.989 -0.124 1.00 15.63 C ATOM 793 CD1 ILE E 111 49.936 57.054 -0.456 1.00 12.75 C ATOM 794 N GLU E 112 48.411 62.412 -0.124 1.00 15.95 N ATOM 795 CA GLU E 112 48.469 63.815 -0.532 1.00 16.65 C ATOM 796 C GLU E 112 48.153 64.769 0.627 1.00 17.32 C ATOM 797 O GLU E 112 48.851 65.791 0.789 1.00 17.67 O ATOM 798 CB GLU E 112 47.523 64.084 -1.722 1.00 17.48 C ATOM 799 CG GLU E 112 47.942 63.366 -2.994 1.00 19.37 C ATOM 800 CD GLU E 112 49.072 64.041 -3.767 1.00 27.62 C ATOM 801 OE1 GLU E 112 49.652 65.052 -3.281 1.00 26.68 O ATOM 802 OE2 GLU E 112 49.392 63.538 -4.880 1.00 29.84 O ATOM 803 N TRP E 113 47.157 64.437 1.449 1.00 16.11 N ATOM 804 CA TRP E 113 46.860 65.229 2.648 1.00 16.05 C ATOM 805 C TRP E 113 48.123 65.293 3.551 1.00 15.55 C ATOM 806 O TRP E 113 48.490 66.369 4.089 1.00 15.54 O ATOM 807 CB TRP E 113 45.638 64.672 3.416 1.00 14.65 C ATOM 808 CG TRP E 113 45.242 65.498 4.587 1.00 16.96 C ATOM 809 CD1 TRP E 113 44.289 66.485 4.605 1.00 17.87 C ATOM 810 CD2 TRP E 113 45.820 65.475 5.915 1.00 17.74 C ATOM 811 NE1 TRP E 113 44.218 67.044 5.863 1.00 20.57 N ATOM 812 CE2 TRP E 113 45.155 66.454 6.681 1.00 18.16 C ATOM 813 CE3 TRP E 113 46.837 64.716 6.527 1.00 17.34 C ATOM 814 CZ2 TRP E 113 45.450 66.690 8.056 1.00 17.23 C ATOM 815 CZ3 TRP E 113 47.172 64.982 7.877 1.00 19.16 C ATOM 816 CH2 TRP E 113 46.468 65.953 8.625 1.00 17.88 C ATOM 817 N ALA E 114 48.772 64.139 3.732 1.00 16.18 N ATOM 818 CA ALA E 114 49.949 64.080 4.611 1.00 16.29 C ATOM 819 C ALA E 114 51.052 64.993 4.079 1.00 17.04 C ATOM 820 O ALA E 114 51.657 65.735 4.847 1.00 17.74 O ATOM 821 CB ALA E 114 50.424 62.612 4.763 1.00 16.26 C ATOM 822 N ILE E 115 51.266 64.997 2.756 1.00 16.83 N ATOM 823 CA ILE E 115 52.276 65.875 2.143 1.00 16.84 C ATOM 824 C ILE E 115 51.909 67.336 2.365 1.00 17.24 C ATOM 825 O ILE E 115 52.735 68.134 2.812 1.00 17.55 O ATOM 826 CB ILE E 115 52.431 65.573 0.650 1.00 15.90 C ATOM 827 CG1 ILE E 115 52.945 64.148 0.454 1.00 15.41 C ATOM 828 CG2 ILE E 115 53.387 66.566 -0.011 1.00 16.71 C ATOM 829 CD1 ILE E 115 52.827 63.646 -1.046 1.00 15.24 C ATOM 830 N ALA E 116 50.658 67.681 2.066 1.00 17.91 N ATOM 831 CA ALA E 116 50.165 69.060 2.189 1.00 18.75 C ATOM 832 C ALA E 116 50.196 69.604 3.615 1.00 19.81 C ATOM 833 O ALA E 116 50.299 70.810 3.812 1.00 20.27 O ATOM 834 CB ALA E 116 48.729 69.158 1.613 1.00 18.77 C ATOM 835 N ASN E 117 50.136 68.711 4.607 1.00 18.10 N ATOM 836 CA ASN E 117 50.099 69.099 5.994 1.00 18.54 C ATOM 837 C ASN E 117 51.440 68.873 6.708 1.00 17.26 C ATOM 838 O ASN E 117 51.499 68.883 7.944 1.00 18.27 O ATOM 839 CB ASN E 117 48.924 68.404 6.673 1.00 18.10 C ATOM 840 CG ASN E 117 47.596 69.054 6.281 1.00 20.34 C ATOM 841 OD1 ASN E 117 47.157 70.026 6.921 1.00 24.98 O ATOM 842 ND2 ASN E 117 46.987 68.580 5.209 1.00 17.67 N ATOM 843 N ASN E 118 52.485 68.685 5.904 1.00 17.25 N ATOM 844 CA ASN E 118 53.873 68.632 6.360 1.00 17.19 C ATOM 845 C ASN E 118 54.145 67.539 7.374 1.00 16.87 C ATOM 846 O ASN E 118 54.845 67.749 8.362 1.00 16.02 O ATOM 847 CB ASN E 118 54.343 69.992 6.932 1.00 19.01 C ATOM 848 CG ASN E 118 54.168 71.126 5.935 1.00 22.77 C ATOM 849 OD1 ASN E 118 54.729 71.105 4.848 1.00 26.65 O ATOM 850 ND2 ASN E 118 53.374 72.119 6.310 1.00 29.16 N ATOM 851 N MET E 119 53.580 66.353 7.126 1.00 15.19 N ATOM 852 CA MET E 119 53.885 65.219 7.994 1.00 14.32 C ATOM 853 C MET E 119 55.353 64.845 7.815 1.00 14.45 C ATOM 854 O MET E 119 55.900 64.932 6.685 1.00 15.29 O ATOM 855 CB MET E 119 53.021 64.020 7.584 1.00 14.42 C ATOM 856 CG MET E 119 51.532 64.244 7.848 1.00 15.02 C ATOM 857 SD MET E 119 51.096 64.418 9.593 1.00 15.07 S ATOM 858 CE MET E 119 50.572 66.197 9.679 1.00 13.99 C ATOM 859 N ASP E 120 55.987 64.444 8.912 1.00 12.82 N ATOM 860 CA ASP E 120 57.390 64.016 8.855 1.00 12.59 C ATOM 861 C ASP E 120 57.480 62.545 8.541 1.00 11.19 C ATOM 862 O ASP E 120 58.459 62.105 7.929 1.00 11.66 O ATOM 863 CB ASP E 120 58.044 64.249 10.216 1.00 12.97 C ATOM 864 CG ASP E 120 58.072 65.734 10.551 1.00 16.04 C ATOM 865 OD1 ASP E 120 58.653 66.506 9.720 1.00 15.96 O ATOM 866 OD2 ASP E 120 57.480 66.219 11.535 1.00 15.70 O ATOM 867 N VAL E 121 56.457 61.811 8.963 1.00 11.69 N ATOM 868 CA VAL E 121 56.462 60.328 8.836 1.00 10.76 C ATOM 869 C VAL E 121 55.063 59.892 8.418 1.00 11.26 C ATOM 870 O VAL E 121 54.089 60.426 8.936 1.00 13.16 O ATOM 871 CB VAL E 121 56.808 59.625 10.176 1.00 11.28 C ATOM 872 CG1 VAL E 121 56.907 58.074 10.004 1.00 11.64 C ATOM 873 CG2 VAL E 121 58.165 60.141 10.721 1.00 11.32 C ATOM 874 N ILE E 122 54.987 58.934 7.479 1.00 10.99 N ATOM 875 CA ILE E 122 53.744 58.231 7.205 1.00 11.52 C ATOM 876 C ILE E 122 53.908 56.776 7.572 1.00 11.88 C ATOM 877 O ILE E 122 54.922 56.162 7.238 1.00 12.70 O ATOM 878 CB ILE E 122 53.407 58.312 5.677 1.00 11.86 C ATOM 879 CG1 ILE E 122 52.917 59.723 5.367 1.00 12.40 C ATOM 880 CG2 ILE E 122 52.383 57.194 5.243 1.00 14.31 C ATOM 881 CD1 ILE E 122 52.899 59.987 3.811 1.00 13.13 C ATOM 882 N ASN E 123 52.896 56.234 8.254 1.00 11.50 N ATOM 883 CA ASN E 123 52.800 54.788 8.443 1.00 11.57 C ATOM 884 C ASN E 123 51.605 54.264 7.655 1.00 12.77 C ATOM 885 O ASN E 123 50.489 54.788 7.813 1.00 11.54 O ATOM 886 CB ASN E 123 52.574 54.441 9.915 1.00 10.72 C ATOM 887 CG ASN E 123 52.597 52.946 10.127 1.00 11.70 C ATOM 888 OD1 ASN E 123 53.662 52.358 10.289 1.00 11.12 O ATOM 889 ND2 ASN E 123 51.412 52.326 10.129 1.00 11.26 N ATOM 890 N MET E 124 51.847 53.233 6.840 1.00 12.11 N ATOM 891 CA MET E 124 50.767 52.554 6.107 1.00 12.12 C ATOM 892 C MET E 124 50.753 51.058 6.447 1.00 12.83 C ATOM 893 O MET E 124 51.417 50.284 5.785 1.00 12.16 O ATOM 894 CB MET E 124 50.939 52.764 4.601 1.00 12.45 C ATOM 895 CG MET E 124 50.386 54.166 4.219 1.00 14.68 C ATOM 896 SD MET E 124 50.544 54.521 2.456 1.00 15.67 S ATOM 897 CE MET E 124 52.276 54.582 2.303 1.00 14.11 C ATOM 898 N SER E 125 49.975 50.676 7.454 1.00 12.86 N ATOM 899 CA SER E 125 49.838 49.255 7.822 1.00 12.56 C ATOM 900 C SER E 125 48.737 48.605 6.949 1.00 13.44 C ATOM 901 O SER E 125 47.650 48.180 7.423 1.00 12.96 O ATOM 902 CB SER E 125 49.494 49.156 9.303 1.00 10.75 C ATOM 903 OG SER E 125 50.652 49.478 10.060 1.00 12.90 O ATOM 904 N LEU E 126 49.022 48.597 5.652 1.00 13.62 N ATOM 905 CA LEU E 126 47.998 48.261 4.671 1.00 14.83 C ATOM 906 C LEU E 126 48.695 47.813 3.401 1.00 15.44 C ATOM 907 O LEU E 126 49.917 48.005 3.225 1.00 14.99 O ATOM 908 CB LEU E 126 47.049 49.449 4.436 1.00 14.86 C ATOM 909 CG LEU E 126 47.645 50.851 4.214 1.00 13.83 C ATOM 910 CD1 LEU E 126 48.424 50.890 2.893 1.00 15.79 C ATOM 911 CD2 LEU E 126 46.503 51.906 4.242 1.00 14.96 C ATOM 912 N GLY E 127 47.935 47.191 2.503 1.00 17.10 N ATOM 913 CA GLY E 127 48.582 46.717 1.292 1.00 17.19 C ATOM 914 C GLY E 127 47.599 46.038 0.358 1.00 19.68 C ATOM 915 O GLY E 127 46.450 45.762 0.727 1.00 17.91 O ATOM 916 N GLY E 128 48.067 45.811 -0.863 1.00 19.58 N ATOM 917 CA GLY E 128 47.327 45.007 -1.836 1.00 20.72 C ATOM 918 C GLY E 128 48.342 44.415 -2.782 1.00 21.91 C ATOM 919 O GLY E 128 49.477 44.886 -2.863 1.00 20.59 O ATOM 920 N PRO E 129 47.947 43.362 -3.499 1.00 23.26 N ATOM 921 CA PRO E 129 48.879 42.640 -4.369 1.00 24.31 C ATOM 922 C PRO E 129 49.218 43.340 -5.673 1.00 24.97 C ATOM 923 O PRO E 129 50.164 42.897 -6.316 1.00 26.17 O ATOM 924 CB PRO E 129 48.131 41.330 -4.682 1.00 25.22 C ATOM 925 CG PRO E 129 46.688 41.700 -4.575 1.00 24.04 C ATOM 926 CD PRO E 129 46.605 42.729 -3.451 1.00 23.47 C ATOM 927 N SER E 130 48.493 44.364 -6.075 1.00 25.54 N ATOM 928 CA SER E 130 48.909 45.043 -7.286 1.00 27.27 C ATOM 929 C SER E 130 49.206 46.495 -6.952 1.00 27.41 C ATOM 930 O SER E 130 48.680 47.042 -5.977 1.00 29.48 O ATOM 931 CB SER E 130 47.831 44.985 -8.378 1.00 27.49 C ATOM 932 OG ASER E 130 46.556 45.254 -7.835 0.50 27.47 O ATOM 933 OG BSER E 130 47.102 43.777 -8.355 0.50 26.82 O ATOM 934 N GLY E 131 50.035 47.120 -7.759 1.00 27.63 N ATOM 935 CA GLY E 131 50.251 48.539 -7.557 1.00 26.83 C ATOM 936 C GLY E 131 49.449 49.319 -8.577 1.00 26.73 C ATOM 937 O GLY E 131 48.579 48.754 -9.292 1.00 27.34 O ATOM 938 N SER E 132 49.681 50.619 -8.619 1.00 25.00 N ATOM 939 CA SER E 132 49.190 51.463 -9.703 1.00 23.67 C ATOM 940 C SER E 132 50.187 52.596 -9.888 1.00 23.76 C ATOM 941 O SER E 132 50.902 53.010 -8.936 1.00 22.29 O ATOM 942 CB SER E 132 47.792 52.017 -9.409 1.00 24.37 C ATOM 943 OG SER E 132 47.785 53.108 -8.483 1.00 22.44 O ATOM 944 N ALA E 133 50.257 53.103 -11.112 1.00 23.03 N ATOM 945 CA ALA E 133 51.087 54.276 -11.360 1.00 22.74 C ATOM 946 C ALA E 133 50.771 55.418 -10.399 1.00 22.21 C ATOM 947 O ALA E 133 51.706 56.089 -9.935 1.00 22.24 O ATOM 948 CB ALA E 133 50.947 54.766 -12.848 1.00 22.51 C ATOM 949 N ALA E 134 49.486 55.656 -10.126 1.00 21.42 N ATOM 950 CA ALA E 134 49.086 56.791 -9.282 1.00 20.91 C ATOM 951 C ALA E 134 49.555 56.530 -7.830 1.00 20.67 C ATOM 952 O ALA E 134 49.961 57.469 -7.133 1.00 19.94 O ATOM 953 CB ALA E 134 47.574 57.026 -9.331 1.00 21.04 C ATOM 954 N LEU E 135 49.500 55.261 -7.396 1.00 19.59 N ATOM 955 CA LEU E 135 49.931 54.941 -6.036 1.00 19.20 C ATOM 956 C LEU E 135 51.435 55.147 -5.932 1.00 19.21 C ATOM 957 O LEU E 135 51.927 55.783 -4.970 1.00 18.10 O ATOM 958 CB LEU E 135 49.546 53.506 -5.631 1.00 18.76 C ATOM 959 CG LEU E 135 49.939 53.108 -4.188 1.00 19.31 C ATOM 960 CD1 LEU E 135 49.230 53.975 -3.147 1.00 18.21 C ATOM 961 CD2 LEU E 135 49.632 51.604 -3.943 1.00 17.21 C ATOM 962 N LYS E 136 52.183 54.631 -6.914 1.00 17.73 N ATOM 963 CA LYS E 136 53.630 54.832 -6.902 1.00 18.38 C ATOM 964 C LYS E 136 53.955 56.335 -6.948 1.00 18.19 C ATOM 965 O LYS E 136 54.846 56.799 -6.236 1.00 17.84 O ATOM 966 CB LYS E 136 54.321 54.095 -8.067 1.00 18.05 C ATOM 967 CG LYS E 136 55.866 54.115 -7.967 1.00 19.84 C ATOM 968 CD LYS E 136 56.521 53.403 -9.148 1.00 22.61 C ATOM 969 CE LYS E 136 58.010 53.201 -8.938 1.00 26.06 C ATOM 970 NZ LYS E 136 58.764 54.508 -8.917 1.00 26.13 N ATOM 971 N ALA E 137 53.228 57.100 -7.761 1.00 18.23 N ATOM 972 CA ALA E 137 53.512 58.536 -7.854 1.00 18.75 C ATOM 973 C ALA E 137 53.338 59.244 -6.505 1.00 18.52 C ATOM 974 O ALA E 137 54.160 60.108 -6.153 1.00 19.79 O ATOM 975 CB ALA E 137 52.631 59.184 -8.928 1.00 18.01 C ATOM 976 N ALA E 138 52.319 58.831 -5.739 1.00 17.60 N ATOM 977 CA ALA E 138 51.982 59.496 -4.463 1.00 16.88 C ATOM 978 C ALA E 138 53.096 59.196 -3.459 1.00 16.81 C ATOM 979 O ALA E 138 53.570 60.112 -2.752 1.00 16.19 O ATOM 980 CB ALA E 138 50.651 59.003 -3.943 1.00 17.99 C ATOM 981 N VAL E 139 53.483 57.923 -3.350 1.00 15.71 N ATOM 982 CA VAL E 139 54.551 57.637 -2.375 1.00 16.69 C ATOM 983 C VAL E 139 55.884 58.257 -2.785 1.00 16.88 C ATOM 984 O VAL E 139 56.674 58.724 -1.934 1.00 16.22 O ATOM 985 CB VAL E 139 54.704 56.136 -2.006 1.00 16.11 C ATOM 986 CG1 VAL E 139 53.455 55.615 -1.223 1.00 16.03 C ATOM 987 CG2 VAL E 139 54.995 55.245 -3.219 1.00 17.73 C ATOM 988 N ASP E 140 56.175 58.227 -4.083 1.00 17.30 N ATOM 989 CA ASP E 140 57.403 58.839 -4.552 1.00 17.79 C ATOM 990 C ASP E 140 57.390 60.325 -4.275 1.00 16.52 C ATOM 991 O ASP E 140 58.440 60.877 -3.950 1.00 18.34 O ATOM 992 CB ASP E 140 57.615 58.625 -6.055 1.00 17.91 C ATOM 993 CG ASP E 140 57.921 57.180 -6.409 1.00 20.28 C ATOM 994 OD1 ASP E 140 58.156 56.309 -5.506 1.00 18.51 O ATOM 995 OD2 ASP E 140 58.004 56.819 -7.629 1.00 18.80 O ATOM 996 N LYS E 141 56.236 60.962 -4.423 1.00 16.38 N ATOM 997 CA LYS E 141 56.125 62.392 -4.190 1.00 17.44 C ATOM 998 C LYS E 141 56.335 62.706 -2.711 1.00 16.77 C ATOM 999 O LYS E 141 57.015 63.699 -2.362 1.00 16.32 O ATOM 1000 CB LYS E 141 54.760 62.912 -4.682 1.00 17.35 C ATOM 1001 CG LYS E 141 54.489 64.397 -4.486 1.00 18.73 C ATOM 1002 CD LYS E 141 53.061 64.727 -4.904 1.00 24.46 C ATOM 1003 CE LYS E 141 52.681 66.195 -4.601 1.00 25.87 C ATOM 1004 NZ LYS E 141 51.242 66.394 -5.056 1.00 25.92 N ATOM 1005 N ALA E 142 55.722 61.880 -1.845 1.00 15.87 N ATOM 1006 CA ALA E 142 55.909 62.087 -0.393 1.00 15.44 C ATOM 1007 C ALA E 142 57.381 62.003 -0.033 1.00 14.39 C ATOM 1008 O ALA E 142 57.911 62.852 0.704 1.00 14.20 O ATOM 1009 CB ALA E 142 55.097 61.038 0.427 1.00 12.85 C ATOM 1010 N VAL E 143 58.057 60.994 -0.562 1.00 14.37 N ATOM 1011 CA VAL E 143 59.506 60.834 -0.295 1.00 14.47 C ATOM 1012 C VAL E 143 60.329 61.991 -0.871 1.00 15.50 C ATOM 1013 O VAL E 143 61.225 62.520 -0.193 1.00 14.39 O ATOM 1014 CB VAL E 143 60.028 59.431 -0.785 1.00 14.46 C ATOM 1015 CG1 VAL E 143 61.568 59.344 -0.746 1.00 15.75 C ATOM 1016 CG2 VAL E 143 59.385 58.340 0.085 1.00 13.53 C ATOM 1017 N ALA E 144 60.010 62.394 -2.102 1.00 16.21 N ATOM 1018 CA ALA E 144 60.701 63.536 -2.715 1.00 16.92 C ATOM 1019 C ALA E 144 60.519 64.795 -1.862 1.00 17.83 C ATOM 1020 O ALA E 144 61.388 65.699 -1.860 1.00 19.39 O ATOM 1021 CB ALA E 144 60.184 63.775 -4.149 1.00 16.73 C ATOM 1022 N SER E 145 59.398 64.864 -1.150 1.00 17.06 N ATOM 1023 CA SER E 145 59.061 66.050 -0.357 1.00 18.36 C ATOM 1024 C SER E 145 59.633 65.972 1.051 1.00 17.37 C ATOM 1025 O SER E 145 59.429 66.886 1.845 1.00 17.93 O ATOM 1026 CB SER E 145 57.566 66.280 -0.259 1.00 18.26 C ATOM 1027 OG SER E 145 56.980 66.386 -1.541 1.00 21.91 O ATOM 1028 N GLY E 146 60.341 64.890 1.379 1.00 16.29 N ATOM 1029 CA GLY E 146 61.019 64.813 2.661 1.00 14.35 C ATOM 1030 C GLY E 146 60.369 63.909 3.724 1.00 14.10 C ATOM 1031 O GLY E 146 60.855 63.872 4.833 1.00 13.66 O ATOM 1032 N VAL E 147 59.278 63.223 3.373 1.00 12.91 N ATOM 1033 CA VAL E 147 58.550 62.383 4.354 1.00 12.39 C ATOM 1034 C VAL E 147 59.199 60.999 4.415 1.00 12.44 C ATOM 1035 O VAL E 147 59.552 60.408 3.383 1.00 13.52 O ATOM 1036 CB VAL E 147 57.061 62.204 3.923 1.00 12.70 C ATOM 1037 CG1 VAL E 147 56.232 61.426 5.023 1.00 11.99 C ATOM 1038 CG2 VAL E 147 56.419 63.569 3.589 1.00 13.70 C ATOM 1039 N VAL E 148 59.350 60.472 5.634 1.00 11.99 N ATOM 1040 CA VAL E 148 59.741 59.074 5.808 1.00 11.93 C ATOM 1041 C VAL E 148 58.474 58.232 5.637 1.00 12.66 C ATOM 1042 O VAL E 148 57.543 58.385 6.405 1.00 13.43 O ATOM 1043 CB VAL E 148 60.271 58.846 7.238 1.00 12.48 C ATOM 1044 CG1 VAL E 148 60.583 57.360 7.443 1.00 12.03 C ATOM 1045 CG2 VAL E 148 61.586 59.656 7.508 1.00 11.27 C ATOM 1046 N VAL E 149 58.467 57.330 4.661 1.00 11.21 N ATOM 1047 CA VAL E 149 57.261 56.521 4.398 1.00 11.35 C ATOM 1048 C VAL E 149 57.544 55.077 4.730 1.00 11.01 C ATOM 1049 O VAL E 149 58.446 54.457 4.163 1.00 11.58 O ATOM 1050 CB VAL E 149 56.830 56.645 2.892 1.00 10.66 C ATOM 1051 CG1 VAL E 149 55.507 55.885 2.647 1.00 10.83 C ATOM 1052 CG2 VAL E 149 56.624 58.106 2.519 1.00 12.90 C ATOM 1053 N VAL E 150 56.720 54.514 5.616 1.00 12.00 N ATOM 1054 CA VAL E 150 56.945 53.163 6.149 1.00 11.21 C ATOM 1055 C VAL E 150 55.663 52.380 5.893 1.00 11.96 C ATOM 1056 O VAL E 150 54.558 52.894 6.094 1.00 12.33 O ATOM 1057 CB VAL E 150 57.161 53.207 7.663 1.00 12.02 C ATOM 1058 CG1 VAL E 150 57.472 51.768 8.223 1.00 11.44 C ATOM 1059 CG2 VAL E 150 58.293 54.235 8.044 1.00 9.41 C ATOM 1060 N ALA E 151 55.806 51.138 5.462 1.00 11.59 N ATOM 1061 CA ALA E 151 54.595 50.302 5.260 1.00 12.59 C ATOM 1062 C ALA E 151 54.812 48.855 5.676 1.00 12.40 C ATOM 1063 O ALA E 151 55.938 48.387 5.739 1.00 12.88 O ATOM 1064 CB ALA E 151 54.168 50.348 3.785 1.00 11.25 C ATOM 1065 N ALA E 152 53.717 48.173 5.989 1.00 12.49 N ATOM 1066 CA ALA E 152 53.734 46.709 6.224 1.00 11.92 C ATOM 1067 C ALA E 152 54.186 46.023 4.925 1.00 12.20 C ATOM 1068 O ALA E 152 53.743 46.398 3.828 1.00 14.43 O ATOM 1069 CB ALA E 152 52.289 46.247 6.621 1.00 12.48 C ATOM 1070 N ALA E 153 55.042 45.027 5.070 1.00 12.14 N ATOM 1071 CA ALA E 153 55.567 44.307 3.906 1.00 12.94 C ATOM 1072 C ALA E 153 54.465 43.412 3.343 1.00 14.49 C ATOM 1073 O ALA E 153 54.481 43.097 2.152 1.00 15.03 O ATOM 1074 CB ALA E 153 56.805 43.432 4.278 1.00 13.19 C ATOM 1075 N GLY E 154 53.506 43.050 4.197 1.00 14.14 N ATOM 1076 CA GLY E 154 52.392 42.164 3.792 1.00 14.35 C ATOM 1077 C GLY E 154 52.408 40.854 4.583 1.00 14.41 C ATOM 1078 O GLY E 154 53.428 40.474 5.169 1.00 14.34 O ATOM 1079 N ASN E 155 51.260 40.139 4.548 1.00 14.67 N ATOM 1080 CA ASN E 155 51.098 38.928 5.331 1.00 15.17 C ATOM 1081 C ASN E 155 50.904 37.738 4.395 1.00 17.73 C ATOM 1082 O ASN E 155 50.114 36.833 4.718 1.00 15.68 O ATOM 1083 CB ASN E 155 49.834 39.028 6.200 1.00 16.07 C ATOM 1084 CG ASN E 155 50.001 40.015 7.359 1.00 16.67 C ATOM 1085 OD1 ASN E 155 51.118 40.519 7.628 1.00 13.33 O ATOM 1086 ND2 ASN E 155 48.924 40.231 8.076 1.00 15.68 N ATOM 1087 N GLU E 156 51.681 37.714 3.306 1.00 17.49 N ATOM 1088 CA GLU E 156 51.458 36.669 2.268 1.00 19.49 C ATOM 1089 C GLU E 156 52.357 35.439 2.441 1.00 20.43 C ATOM 1090 O GLU E 156 52.229 34.435 1.685 1.00 21.90 O ATOM 1091 CB GLU E 156 51.575 37.254 0.859 1.00 19.16 C ATOM 1092 CG GLU E 156 50.513 38.254 0.494 1.00 23.63 C ATOM 1093 CD GLU E 156 49.122 37.636 0.554 1.00 31.60 C ATOM 1094 OE1 GLU E 156 48.963 36.461 0.136 1.00 33.39 O ATOM 1095 OE2 GLU E 156 48.189 38.302 1.043 1.00 30.61 O ATOM 1096 N GLY E 157 53.249 35.457 3.424 1.00 19.27 N ATOM 1097 CA GLY E 157 54.051 34.291 3.738 1.00 20.39 C ATOM 1098 C GLY E 157 54.989 34.005 2.567 1.00 22.37 C ATOM 1099 O GLY E 157 55.409 34.938 1.884 1.00 21.39 O ATOM 1100 N THR E 158 55.331 32.734 2.341 1.00 23.84 N ATOM 1101 CA THR E 158 56.299 32.382 1.275 1.00 25.99 C ATOM 1102 C THR E 158 55.579 31.799 0.070 1.00 27.38 C ATOM 1103 O THR E 158 54.483 31.256 0.207 1.00 28.33 O ATOM 1104 CB THR E 158 57.341 31.346 1.751 1.00 25.97 C ATOM 1105 OG1 THR E 158 56.652 30.162 2.161 1.00 28.40 O ATOM 1106 CG2 THR E 158 58.063 31.805 3.014 1.00 25.12 C ATOM 1107 N SER E 159 56.203 31.908 -1.102 1.00 28.92 N ATOM 1108 CA SER E 159 55.664 31.305 -2.319 1.00 30.37 C ATOM 1109 C SER E 159 56.885 30.897 -3.133 1.00 30.19 C ATOM 1110 O SER E 159 57.224 31.547 -4.115 1.00 30.67 O ATOM 1111 CB SER E 159 54.862 32.348 -3.079 1.00 30.53 C ATOM 1112 OG SER E 159 54.238 31.778 -4.217 1.00 35.49 O ATOM 1113 N GLY E 160 57.592 29.881 -2.661 1.00 30.51 N ATOM 1114 CA GLY E 160 58.792 29.413 -3.321 1.00 31.16 C ATOM 1115 C GLY E 160 59.843 30.496 -3.377 1.00 31.74 C ATOM 1116 O GLY E 160 60.240 31.053 -2.347 1.00 32.19 O ATOM 1117 N SER E 161 60.306 30.807 -4.580 1.00 31.28 N ATOM 1118 CA SER E 161 61.313 31.849 -4.740 1.00 30.98 C ATOM 1119 C SER E 161 60.707 33.193 -5.166 1.00 29.72 C ATOM 1120 O SER E 161 61.452 34.125 -5.452 1.00 30.13 O ATOM 1121 CB SER E 161 62.374 31.384 -5.746 1.00 32.55 C ATOM 1122 OG ASER E 161 61.783 31.235 -7.022 0.67 32.21 O ATOM 1123 OG BSER E 161 63.127 30.301 -5.224 0.33 31.13 O ATOM 1124 N SER E 162 59.374 33.316 -5.176 1.00 28.11 N ATOM 1125 CA SER E 162 58.724 34.553 -5.600 1.00 27.64 C ATOM 1126 C SER E 162 58.649 35.549 -4.442 1.00 25.71 C ATOM 1127 O SER E 162 58.498 35.151 -3.294 1.00 24.94 O ATOM 1128 CB SER E 162 57.286 34.321 -6.068 1.00 29.17 C ATOM 1129 OG SER E 162 57.218 33.326 -7.093 1.00 32.97 O ATOM 1130 N SER E 163 58.703 36.829 -4.782 1.00 23.29 N ATOM 1131 CA SER E 163 58.452 37.865 -3.792 1.00 21.62 C ATOM 1132 C SER E 163 56.982 37.878 -3.484 1.00 21.72 C ATOM 1133 O SER E 163 56.161 37.746 -4.386 1.00 20.83 O ATOM 1134 CB SER E 163 58.859 39.214 -4.358 1.00 21.74 C ATOM 1135 OG SER E 163 58.375 40.277 -3.518 1.00 20.25 O ATOM 1136 N THR E 164 56.624 38.105 -2.217 1.00 19.65 N ATOM 1137 CA THR E 164 55.230 38.245 -1.851 1.00 18.21 C ATOM 1138 C THR E 164 54.984 39.559 -1.126 1.00 17.29 C ATOM 1139 O THR E 164 53.909 39.769 -0.546 1.00 17.17 O ATOM 1140 CB THR E 164 54.795 37.109 -0.939 1.00 18.61 C ATOM 1141 OG1 THR E 164 55.574 37.127 0.265 1.00 18.28 O ATOM 1142 CG2 THR E 164 55.116 35.741 -1.573 1.00 20.04 C ATOM 1143 N VAL E 165 55.969 40.453 -1.185 1.00 17.34 N ATOM 1144 CA VAL E 165 55.767 41.789 -0.628 1.00 17.77 C ATOM 1145 C VAL E 165 54.661 42.492 -1.398 1.00 18.42 C ATOM 1146 O VAL E 165 54.672 42.524 -2.648 1.00 20.40 O ATOM 1147 CB VAL E 165 57.095 42.580 -0.706 1.00 16.89 C ATOM 1148 CG1 VAL E 165 56.903 44.035 -0.242 1.00 15.57 C ATOM 1149 CG2 VAL E 165 58.216 41.870 0.083 1.00 17.29 C ATOM 1150 N GLY E 166 53.712 43.118 -0.697 1.00 17.90 N ATOM 1151 CA GLY E 166 52.643 43.820 -1.370 1.00 18.08 C ATOM 1152 C GLY E 166 52.927 45.304 -1.546 1.00 17.56 C ATOM 1153 O GLY E 166 53.976 45.786 -1.122 1.00 18.02 O ATOM 1154 N TYR E 167 51.990 46.006 -2.164 1.00 16.67 N ATOM 1155 CA TYR E 167 52.111 47.445 -2.421 1.00 16.94 C ATOM 1156 C TYR E 167 51.311 48.195 -1.359 1.00 16.41 C ATOM 1157 O TYR E 167 50.217 47.737 -0.953 1.00 16.28 O ATOM 1158 CB TYR E 167 51.493 47.766 -3.778 1.00 15.71 C ATOM 1159 CG TYR E 167 52.256 47.136 -4.917 1.00 18.12 C ATOM 1160 CD1 TYR E 167 53.280 47.835 -5.547 1.00 20.35 C ATOM 1161 CD2 TYR E 167 51.967 45.827 -5.336 1.00 21.72 C ATOM 1162 CE1 TYR E 167 54.021 47.259 -6.588 1.00 22.46 C ATOM 1163 CE2 TYR E 167 52.667 45.252 -6.447 1.00 20.94 C ATOM 1164 CZ TYR E 167 53.700 45.996 -7.044 1.00 24.90 C ATOM 1165 OH TYR E 167 54.449 45.454 -8.075 1.00 26.22 O ATOM 1166 N PRO E 168 51.768 49.358 -0.907 1.00 15.96 N ATOM 1167 CA PRO E 168 52.911 50.114 -1.455 1.00 15.76 C ATOM 1168 C PRO E 168 54.304 49.751 -0.896 1.00 15.03 C ATOM 1169 O PRO E 168 55.316 50.343 -1.330 1.00 14.55 O ATOM 1170 CB PRO E 168 52.548 51.550 -1.093 1.00 16.25 C ATOM 1171 CG PRO E 168 51.837 51.391 0.263 1.00 15.41 C ATOM 1172 CD PRO E 168 51.044 50.083 0.168 1.00 16.09 C ATOM 1173 N GLY E 169 54.376 48.790 0.022 1.00 14.69 N ATOM 1174 CA GLY E 169 55.659 48.357 0.567 1.00 14.29 C ATOM 1175 C GLY E 169 56.665 47.987 -0.522 1.00 16.42 C ATOM 1176 O GLY E 169 57.852 48.284 -0.375 1.00 15.10 O ATOM 1177 N LYS E 170 56.191 47.378 -1.621 1.00 16.14 N ATOM 1178 CA LYS E 170 57.098 46.866 -2.656 1.00 16.47 C ATOM 1179 C LYS E 170 57.818 47.962 -3.448 1.00 16.98 C ATOM 1180 O LYS E 170 58.828 47.688 -4.104 1.00 16.88 O ATOM 1181 CB LYS E 170 56.304 45.981 -3.628 1.00 17.24 C ATOM 1182 CG LYS E 170 57.154 44.964 -4.400 1.00 18.69 C ATOM 1183 CD LYS E 170 56.261 44.188 -5.377 1.00 19.49 C ATOM 1184 CE LYS E 170 57.069 43.017 -5.969 1.00 27.96 C ATOM 1185 NZ LYS E 170 56.191 42.140 -6.806 1.00 30.60 N ATOM 1186 N TYR E 171 57.293 49.185 -3.436 1.00 16.53 N ATOM 1187 CA TYR E 171 57.978 50.314 -4.110 1.00 16.59 C ATOM 1188 C TYR E 171 59.292 50.670 -3.408 1.00 17.72 C ATOM 1189 O TYR E 171 59.346 50.763 -2.165 1.00 15.51 O ATOM 1190 CB TYR E 171 57.070 51.534 -4.117 1.00 18.00 C ATOM 1191 CG TYR E 171 55.800 51.380 -4.935 1.00 16.04 C ATOM 1192 CD1 TYR E 171 55.859 50.903 -6.253 1.00 17.63 C ATOM 1193 CD2 TYR E 171 54.543 51.667 -4.387 1.00 15.87 C ATOM 1194 CE1 TYR E 171 54.695 50.767 -7.014 1.00 19.33 C ATOM 1195 CE2 TYR E 171 53.356 51.541 -5.148 1.00 17.71 C ATOM 1196 CZ TYR E 171 53.469 51.093 -6.469 1.00 19.70 C ATOM 1197 OH TYR E 171 52.346 50.952 -7.245 1.00 23.76 O ATOM 1198 N PRO E 172 60.357 50.877 -4.188 1.00 16.71 N ATOM 1199 CA PRO E 172 61.666 51.267 -3.639 1.00 17.12 C ATOM 1200 C PRO E 172 61.619 52.477 -2.676 1.00 16.79 C ATOM 1201 O PRO E 172 62.433 52.527 -1.737 1.00 17.33 O ATOM 1202 CB PRO E 172 62.477 51.594 -4.906 1.00 18.42 C ATOM 1203 CG PRO E 172 61.875 50.630 -5.961 1.00 19.13 C ATOM 1204 CD PRO E 172 60.380 50.697 -5.671 1.00 18.49 C ATOM 1205 N SER E 173 60.711 53.423 -2.903 1.00 15.99 N ATOM 1206 CA SER E 173 60.742 54.647 -2.075 1.00 15.75 C ATOM 1207 C SER E 173 60.181 54.411 -0.658 1.00 14.92 C ATOM 1208 O SER E 173 60.286 55.284 0.221 1.00 13.54 O ATOM 1209 CB SER E 173 59.991 55.796 -2.737 1.00 16.50 C ATOM 1210 OG SER E 173 58.612 55.463 -2.867 1.00 18.84 O ATOM 1211 N VAL E 174 59.510 53.283 -0.481 1.00 13.88 N ATOM 1212 CA VAL E 174 58.829 52.957 0.780 1.00 13.77 C ATOM 1213 C VAL E 174 59.640 51.939 1.570 1.00 14.65 C ATOM 1214 O VAL E 174 60.159 50.967 1.001 1.00 13.70 O ATOM 1215 CB VAL E 174 57.373 52.389 0.473 1.00 14.14 C ATOM 1216 CG1 VAL E 174 56.630 51.957 1.752 1.00 13.82 C ATOM 1217 CG2 VAL E 174 56.535 53.436 -0.273 1.00 13.61 C ATOM 1218 N ILE E 175 59.714 52.115 2.879 1.00 12.50 N ATOM 1219 CA ILE E 175 60.412 51.135 3.697 1.00 12.63 C ATOM 1220 C ILE E 175 59.428 49.995 4.009 1.00 12.47 C ATOM 1221 O ILE E 175 58.413 50.224 4.697 1.00 12.60 O ATOM 1222 CB ILE E 175 60.874 51.766 5.019 1.00 12.23 C ATOM 1223 CG1 ILE E 175 61.924 52.885 4.768 1.00 11.95 C ATOM 1224 CG2 ILE E 175 61.396 50.649 5.990 1.00 12.04 C ATOM 1225 CD1 ILE E 175 61.957 53.843 6.006 1.00 14.18 C ATOM 1226 N ALA E 176 59.685 48.801 3.446 1.00 11.17 N ATOM 1227 CA ALA E 176 58.801 47.643 3.698 1.00 11.91 C ATOM 1228 C ALA E 176 59.222 46.832 4.930 1.00 11.88 C ATOM 1229 O ALA E 176 60.363 46.390 5.047 1.00 11.90 O ATOM 1230 CB ALA E 176 58.761 46.694 2.454 1.00 12.07 C ATOM 1231 N VAL E 177 58.270 46.680 5.870 1.00 11.59 N ATOM 1232 CA VAL E 177 58.585 46.099 7.180 1.00 11.85 C ATOM 1233 C VAL E 177 57.946 44.733 7.392 1.00 12.43 C ATOM 1234 O VAL E 177 56.707 44.604 7.377 1.00 12.73 O ATOM 1235 CB VAL E 177 58.143 47.056 8.360 1.00 11.00 C ATOM 1236 CG1 VAL E 177 58.603 46.475 9.773 1.00 11.72 C ATOM 1237 CG2 VAL E 177 58.701 48.532 8.058 1.00 10.97 C ATOM 1238 N GLY E 178 58.797 43.723 7.629 1.00 12.25 N ATOM 1239 CA GLY E 178 58.304 42.387 7.981 1.00 12.19 C ATOM 1240 C GLY E 178 58.196 42.203 9.486 1.00 12.86 C ATOM 1241 O GLY E 178 58.651 43.060 10.301 1.00 11.34 O ATOM 1242 N ALA E 179 57.656 41.055 9.896 1.00 12.25 N ATOM 1243 CA ALA E 179 57.356 40.788 11.287 1.00 11.65 C ATOM 1244 C ALA E 179 58.187 39.652 11.866 1.00 13.33 C ATOM 1245 O ALA E 179 58.272 38.580 11.273 1.00 14.43 O ATOM 1246 CB ALA E 179 55.873 40.444 11.488 1.00 12.09 C ATOM 1247 N VAL E 180 58.756 39.916 13.036 1.00 13.66 N ATOM 1248 CA VAL E 180 59.350 38.868 13.861 1.00 13.89 C ATOM 1249 C VAL E 180 58.619 38.746 15.187 1.00 14.61 C ATOM 1250 O VAL E 180 57.835 39.623 15.586 1.00 13.29 O ATOM 1251 CB VAL E 180 60.876 39.034 14.122 1.00 13.17 C ATOM 1252 CG1 VAL E 180 61.663 38.950 12.798 1.00 14.11 C ATOM 1253 CG2 VAL E 180 61.159 40.383 14.859 1.00 13.80 C ATOM 1254 N ASP E 181 58.874 37.629 15.871 1.00 15.24 N ATOM 1255 CA ASP E 181 58.354 37.464 17.231 1.00 15.61 C ATOM 1256 C ASP E 181 59.439 37.855 18.275 1.00 15.90 C ATOM 1257 O ASP E 181 60.500 38.426 17.905 1.00 14.40 O ATOM 1258 CB ASP E 181 57.822 36.029 17.399 1.00 16.66 C ATOM 1259 CG ASP E 181 58.920 34.971 17.340 1.00 19.20 C ATOM 1260 OD1 ASP E 181 60.137 35.293 17.494 1.00 16.17 O ATOM 1261 OD2 ASP E 181 58.604 33.754 17.159 1.00 22.06 O ATOM 1262 N SER E 182 59.203 37.550 19.551 1.00 16.80 N ATOM 1263 CA SER E 182 60.080 37.995 20.654 1.00 18.02 C ATOM 1264 C SER E 182 61.417 37.281 20.661 1.00 18.50 C ATOM 1265 O SER E 182 62.332 37.699 21.348 1.00 19.82 O ATOM 1266 CB SER E 182 59.391 37.811 22.036 1.00 20.02 C ATOM 1267 OG SER E 182 59.091 36.422 22.233 1.00 21.03 O ATOM 1268 N SER E 183 61.540 36.224 19.862 1.00 18.25 N ATOM 1269 CA SER E 183 62.782 35.468 19.754 1.00 17.82 C ATOM 1270 C SER E 183 63.505 35.824 18.440 1.00 17.85 C ATOM 1271 O SER E 183 64.521 35.154 18.045 1.00 18.32 O ATOM 1272 CB SER E 183 62.497 33.948 19.797 1.00 18.43 C ATOM 1273 OG ASER E 183 61.846 33.551 21.030 0.67 18.65 O ATOM 1274 OG BSER E 183 62.080 33.474 18.532 0.33 18.45 O ATOM 1275 N ASN E 184 63.005 36.868 17.747 1.00 16.93 N ATOM 1276 CA ASN E 184 63.559 37.299 16.463 1.00 17.55 C ATOM 1277 C ASN E 184 63.339 36.320 15.306 1.00 17.62 C ATOM 1278 O ASN E 184 63.975 36.452 14.256 1.00 18.57 O ATOM 1279 CB ASN E 184 65.046 37.629 16.588 1.00 18.11 C ATOM 1280 CG ASN E 184 65.265 38.981 17.223 1.00 19.96 C ATOM 1281 OD1 ASN E 184 64.357 39.818 17.227 1.00 21.13 O ATOM 1282 ND2 ASN E 184 66.471 39.225 17.714 1.00 20.51 N ATOM 1283 N GLN E 185 62.385 35.398 15.467 1.00 18.69 N ATOM 1284 CA GLN E 185 61.996 34.498 14.365 1.00 19.22 C ATOM 1285 C GLN E 185 60.966 35.145 13.470 1.00 17.40 C ATOM 1286 O GLN E 185 60.026 35.736 13.963 1.00 16.67 O ATOM 1287 CB GLN E 185 61.358 33.204 14.925 1.00 20.59 C ATOM 1288 CG GLN E 185 62.341 32.218 15.452 1.00 30.43 C ATOM 1289 CD GLN E 185 63.173 31.573 14.334 1.00 39.43 C ATOM 1290 OE1 GLN E 185 62.623 31.089 13.322 1.00 43.43 O ATOM 1291 NE2 GLN E 185 64.500 31.573 14.512 1.00 42.49 N ATOM 1292 N ARG E 186 61.117 35.016 12.162 1.00 16.23 N ATOM 1293 CA ARG E 186 60.187 35.607 11.243 1.00 16.47 C ATOM 1294 C ARG E 186 58.821 34.946 11.530 1.00 17.30 C ATOM 1295 O ARG E 186 58.769 33.738 11.781 1.00 16.80 O ATOM 1296 CB ARG E 186 60.719 35.349 9.823 1.00 17.47 C ATOM 1297 CG ARG E 186 59.743 35.366 8.778 1.00 21.53 C ATOM 1298 CD ARG E 186 60.252 34.794 7.452 1.00 20.78 C ATOM 1299 NE ARG E 186 59.062 34.788 6.689 1.00 22.25 N ATOM 1300 CZ ARG E 186 58.259 33.749 6.576 1.00 19.69 C ATOM 1301 NH1 ARG E 186 58.599 32.569 7.083 1.00 20.60 N ATOM 1302 NH2 ARG E 186 57.138 33.909 5.915 1.00 20.04 N ATOM 1303 N ALA E 187 57.748 35.729 11.590 1.00 16.55 N ATOM 1304 CA ALA E 187 56.383 35.193 11.700 1.00 16.72 C ATOM 1305 C ALA E 187 56.034 34.446 10.419 1.00 16.94 C ATOM 1306 O ALA E 187 56.416 34.866 9.322 1.00 15.31 O ATOM 1307 CB ALA E 187 55.383 36.322 11.905 1.00 17.12 C ATOM 1308 N SER E 188 55.293 33.336 10.540 1.00 17.21 N ATOM 1309 CA SER E 188 55.072 32.504 9.323 1.00 18.49 C ATOM 1310 C SER E 188 54.297 33.234 8.235 1.00 18.33 C ATOM 1311 O SER E 188 54.492 32.956 7.060 1.00 19.16 O ATOM 1312 CB SER E 188 54.360 31.199 9.723 1.00 19.14 C ATOM 1313 OG SER E 188 53.091 31.580 10.244 1.00 23.58 O ATOM 1314 N PHE E 189 53.445 34.205 8.605 1.00 16.88 N ATOM 1315 CA PHE E 189 52.695 34.983 7.632 1.00 16.35 C ATOM 1316 C PHE E 189 53.520 36.120 6.996 1.00 15.61 C ATOM 1317 O PHE E 189 53.078 36.714 6.031 1.00 17.77 O ATOM 1318 CB PHE E 189 51.430 35.607 8.281 1.00 16.94 C ATOM 1319 CG PHE E 189 51.721 36.480 9.501 1.00 17.35 C ATOM 1320 CD1 PHE E 189 52.297 37.746 9.344 1.00 18.00 C ATOM 1321 CD2 PHE E 189 51.484 36.008 10.798 1.00 17.32 C ATOM 1322 CE1 PHE E 189 52.618 38.518 10.449 1.00 15.15 C ATOM 1323 CE2 PHE E 189 51.773 36.787 11.922 1.00 17.96 C ATOM 1324 CZ PHE E 189 52.330 38.034 11.755 1.00 16.33 C ATOM 1325 N SER E 190 54.670 36.476 7.557 1.00 15.83 N ATOM 1326 CA SER E 190 55.407 37.669 7.080 1.00 15.35 C ATOM 1327 C SER E 190 55.868 37.525 5.614 1.00 15.49 C ATOM 1328 O SER E 190 56.526 36.521 5.261 1.00 15.93 O ATOM 1329 CB SER E 190 56.608 37.926 8.026 1.00 15.53 C ATOM 1330 OG SER E 190 57.268 39.135 7.643 1.00 17.05 O ATOM 1331 N SER E 191 55.511 38.497 4.768 1.00 15.03 N ATOM 1332 CA SER E 191 55.888 38.507 3.341 1.00 15.34 C ATOM 1333 C SER E 191 57.399 38.494 3.166 1.00 16.07 C ATOM 1334 O SER E 191 58.132 38.897 4.077 1.00 17.04 O ATOM 1335 CB SER E 191 55.270 39.682 2.585 1.00 16.28 C ATOM 1336 OG SER E 191 53.879 39.457 2.308 1.00 16.06 O ATOM 1337 N VAL E 192 57.857 38.018 2.006 1.00 16.47 N ATOM 1338 CA VAL E 192 59.271 37.766 1.727 1.00 16.93 C ATOM 1339 C VAL E 192 59.615 38.307 0.353 1.00 16.91 C ATOM 1340 O VAL E 192 58.719 38.576 -0.475 1.00 17.13 O ATOM 1341 CB VAL E 192 59.623 36.257 1.809 1.00 17.27 C ATOM 1342 CG1 VAL E 192 59.499 35.761 3.261 1.00 16.23 C ATOM 1343 CG2 VAL E 192 58.757 35.444 0.822 1.00 15.96 C ATOM 1344 N GLY E 193 60.904 38.507 0.110 1.00 17.10 N ATOM 1345 CA GLY E 193 61.305 39.042 -1.182 1.00 17.98 C ATOM 1346 C GLY E 193 62.438 40.044 -1.060 1.00 18.89 C ATOM 1347 O GLY E 193 62.763 40.540 0.035 1.00 18.41 O ATOM 1348 N PRO E 194 63.077 40.347 -2.177 1.00 19.43 N ATOM 1349 CA PRO E 194 64.186 41.310 -2.138 1.00 19.27 C ATOM 1350 C PRO E 194 63.703 42.700 -1.711 1.00 19.42 C ATOM 1351 O PRO E 194 64.551 43.490 -1.281 1.00 18.53 O ATOM 1352 CB PRO E 194 64.710 41.316 -3.570 1.00 20.45 C ATOM 1353 CG PRO E 194 63.662 40.726 -4.396 1.00 20.93 C ATOM 1354 CD PRO E 194 62.860 39.783 -3.533 1.00 20.25 C ATOM 1355 N GLU E 195 62.406 42.993 -1.819 1.00 17.61 N ATOM 1356 CA GLU E 195 61.861 44.310 -1.385 1.00 17.42 C ATOM 1357 C GLU E 195 61.657 44.406 0.120 1.00 16.55 C ATOM 1358 O GLU E 195 61.399 45.510 0.638 1.00 17.53 O ATOM 1359 CB GLU E 195 60.564 44.640 -2.103 1.00 17.82 C ATOM 1360 CG GLU E 195 60.650 44.499 -3.624 1.00 20.07 C ATOM 1361 CD GLU E 195 60.360 43.084 -4.133 1.00 25.37 C ATOM 1362 OE1 GLU E 195 60.237 42.108 -3.332 1.00 19.79 O ATOM 1363 OE2 GLU E 195 60.286 42.949 -5.383 1.00 28.20 O ATOM 1364 N LEU E 196 61.799 43.298 0.836 1.00 15.45 N ATOM 1365 CA LEU E 196 61.687 43.349 2.307 1.00 15.57 C ATOM 1366 C LEU E 196 62.883 44.138 2.831 1.00 16.01 C ATOM 1367 O LEU E 196 64.013 43.793 2.508 1.00 16.46 O ATOM 1368 CB LEU E 196 61.743 41.924 2.856 1.00 17.27 C ATOM 1369 CG LEU E 196 61.623 41.687 4.344 1.00 18.12 C ATOM 1370 CD1 LEU E 196 60.338 42.372 4.852 1.00 17.80 C ATOM 1371 CD2 LEU E 196 61.541 40.146 4.578 1.00 14.98 C ATOM 1372 N ASP E 197 62.641 45.203 3.616 1.00 14.01 N ATOM 1373 CA ASP E 197 63.736 46.061 4.015 1.00 14.55 C ATOM 1374 C ASP E 197 64.235 45.740 5.422 1.00 14.24 C ATOM 1375 O ASP E 197 65.419 45.450 5.616 1.00 15.11 O ATOM 1376 CB ASP E 197 63.305 47.519 3.902 1.00 13.42 C ATOM 1377 CG ASP E 197 64.471 48.475 3.955 1.00 16.85 C ATOM 1378 OD1 ASP E 197 65.642 48.014 3.916 1.00 19.61 O ATOM 1379 OD2 ASP E 197 64.285 49.708 4.048 1.00 20.23 O ATOM 1380 N VAL E 198 63.356 45.861 6.430 1.00 13.70 N ATOM 1381 CA VAL E 198 63.753 45.609 7.816 1.00 12.80 C ATOM 1382 C VAL E 198 62.619 44.836 8.491 1.00 12.22 C ATOM 1383 O VAL E 198 61.506 44.763 7.948 1.00 13.25 O ATOM 1384 CB VAL E 198 63.978 46.952 8.608 1.00 13.27 C ATOM 1385 CG1 VAL E 198 65.169 47.768 7.977 1.00 13.99 C ATOM 1386 CG2 VAL E 198 62.673 47.797 8.653 1.00 12.92 C ATOM 1387 N MET E 199 62.890 44.327 9.673 1.00 11.67 N ATOM 1388 CA MET E 199 61.881 43.611 10.458 1.00 12.70 C ATOM 1389 C MET E 199 61.642 44.340 11.777 1.00 12.11 C ATOM 1390 O MET E 199 62.526 45.046 12.299 1.00 12.60 O ATOM 1391 CB MET E 199 62.405 42.221 10.857 1.00 11.83 C ATOM 1392 CG MET E 199 62.929 41.352 9.678 1.00 13.35 C ATOM 1393 SD MET E 199 61.684 41.013 8.468 1.00 14.73 S ATOM 1394 CE MET E 199 60.865 39.563 9.176 1.00 13.08 C ATOM 1395 N ALA E 200 60.460 44.115 12.351 1.00 10.93 N ATOM 1396 CA ALA E 200 60.165 44.647 13.698 1.00 11.37 C ATOM 1397 C ALA E 200 59.156 43.683 14.334 1.00 12.01 C ATOM 1398 O ALA E 200 58.629 42.800 13.634 1.00 11.80 O ATOM 1399 CB ALA E 200 59.580 46.076 13.604 1.00 10.56 C ATOM 1400 N PRO E 201 58.889 43.821 15.630 1.00 12.00 N ATOM 1401 CA PRO E 201 57.970 42.885 16.343 1.00 11.00 C ATOM 1402 C PRO E 201 56.565 42.974 15.774 1.00 11.96 C ATOM 1403 O PRO E 201 56.031 44.079 15.632 1.00 12.21 O ATOM 1404 CB PRO E 201 58.001 43.399 17.780 1.00 11.50 C ATOM 1405 CG PRO E 201 59.505 43.977 17.874 1.00 11.10 C ATOM 1406 CD PRO E 201 59.553 44.771 16.552 1.00 11.42 C ATOM 1407 N GLY E 202 55.967 41.811 15.482 1.00 11.10 N ATOM 1408 CA GLY E 202 54.668 41.797 14.820 1.00 10.59 C ATOM 1409 C GLY E 202 53.850 40.622 15.318 1.00 12.16 C ATOM 1410 O GLY E 202 52.852 40.276 14.703 1.00 13.30 O ATOM 1411 N VAL E 203 54.293 40.021 16.419 1.00 12.25 N ATOM 1412 CA VAL E 203 53.543 38.889 17.005 1.00 13.65 C ATOM 1413 C VAL E 203 53.108 39.216 18.438 1.00 14.04 C ATOM 1414 O VAL E 203 53.948 39.513 19.287 1.00 13.97 O ATOM 1415 CB VAL E 203 54.401 37.582 16.964 1.00 15.32 C ATOM 1416 CG1 VAL E 203 53.654 36.402 17.638 1.00 15.04 C ATOM 1417 CG2 VAL E 203 54.815 37.222 15.527 1.00 15.38 C ATOM 1418 N SER E 204 51.798 39.107 18.719 1.00 12.93 N ATOM 1419 CA SER E 204 51.263 39.317 20.064 1.00 13.16 C ATOM 1420 C SER E 204 51.642 40.719 20.601 1.00 11.82 C ATOM 1421 O SER E 204 52.206 40.863 21.669 1.00 13.43 O ATOM 1422 CB SER E 204 51.787 38.241 21.023 1.00 15.19 C ATOM 1423 OG ASER E 204 51.230 37.004 20.598 0.67 15.62 O ATOM 1424 OG BSER E 204 51.000 38.239 22.196 0.33 13.59 O ATOM 1425 N ILE E 205 51.328 41.719 19.790 1.00 11.96 N ATOM 1426 CA ILE E 205 51.693 43.098 20.114 1.00 10.88 C ATOM 1427 C ILE E 205 50.519 43.771 20.816 1.00 11.35 C ATOM 1428 O ILE E 205 49.451 43.985 20.212 1.00 11.67 O ATOM 1429 CB ILE E 205 52.010 43.863 18.813 1.00 10.51 C ATOM 1430 CG1 ILE E 205 53.159 43.149 18.018 1.00 9.78 C ATOM 1431 CG2 ILE E 205 52.313 45.347 19.110 1.00 10.94 C ATOM 1432 CD1 ILE E 205 54.504 42.973 18.808 1.00 10.67 C ATOM 1433 N GLN E 206 50.710 44.079 22.093 1.00 11.44 N ATOM 1434 CA GLN E 206 49.698 44.797 22.900 1.00 11.37 C ATOM 1435 C GLN E 206 49.681 46.264 22.515 1.00 12.35 C ATOM 1436 O GLN E 206 50.745 46.888 22.424 1.00 10.72 O ATOM 1437 CB GLN E 206 50.025 44.691 24.402 1.00 13.36 C ATOM 1438 CG GLN E 206 49.721 43.318 24.975 1.00 14.57 C ATOM 1439 CD GLN E 206 48.179 43.069 25.106 1.00 13.60 C ATOM 1440 OE1 GLN E 206 47.348 44.004 24.949 1.00 15.89 O ATOM 1441 NE2 GLN E 206 47.816 41.821 25.418 1.00 16.36 N ATOM 1442 N SER E 207 48.483 46.772 22.267 1.00 10.74 N ATOM 1443 CA SER E 207 48.314 48.203 21.993 1.00 10.94 C ATOM 1444 C SER E 207 46.878 48.641 22.316 1.00 11.70 C ATOM 1445 O SER E 207 46.030 47.847 22.781 1.00 11.91 O ATOM 1446 CB SER E 207 48.682 48.517 20.527 1.00 10.51 C ATOM 1447 OG SER E 207 48.662 49.917 20.323 1.00 10.99 O ATOM 1448 N THR E 208 46.606 49.898 22.039 1.00 11.16 N ATOM 1449 CA THR E 208 45.287 50.534 22.292 1.00 11.06 C ATOM 1450 C THR E 208 44.247 50.029 21.302 1.00 11.32 C ATOM 1451 O THR E 208 44.531 49.830 20.138 1.00 13.17 O ATOM 1452 CB THR E 208 45.414 52.055 22.101 1.00 10.66 C ATOM 1453 OG1 THR E 208 46.218 52.334 20.925 1.00 10.70 O ATOM 1454 CG2 THR E 208 46.199 52.663 23.288 1.00 11.21 C ATOM 1455 N LEU E 209 43.033 49.904 21.795 1.00 12.90 N ATOM 1456 CA LEU E 209 41.850 49.546 20.963 1.00 13.65 C ATOM 1457 C LEU E 209 40.682 50.473 21.327 1.00 13.40 C ATOM 1458 O LEU E 209 40.615 50.991 22.442 1.00 13.17 O ATOM 1459 CB LEU E 209 41.450 48.075 21.197 1.00 13.42 C ATOM 1460 CG LEU E 209 42.438 47.022 20.667 1.00 13.83 C ATOM 1461 CD1 LEU E 209 42.109 45.603 21.214 1.00 13.99 C ATOM 1462 CD2 LEU E 209 42.477 47.044 19.160 1.00 11.07 C ATOM 1463 N PRO E 210 39.753 50.699 20.398 1.00 13.70 N ATOM 1464 CA PRO E 210 38.666 51.643 20.668 1.00 14.47 C ATOM 1465 C PRO E 210 37.829 51.304 21.906 1.00 14.52 C ATOM 1466 O PRO E 210 37.697 50.128 22.294 1.00 14.93 O ATOM 1467 CB PRO E 210 37.828 51.588 19.388 1.00 14.72 C ATOM 1468 CG PRO E 210 38.862 51.125 18.276 1.00 15.28 C ATOM 1469 CD PRO E 210 39.687 50.128 19.026 1.00 13.23 C ATOM 1470 N GLY E 211 37.242 52.356 22.474 1.00 14.61 N ATOM 1471 CA GLY E 211 36.486 52.272 23.718 1.00 15.45 C ATOM 1472 C GLY E 211 37.322 51.983 24.943 1.00 14.81 C ATOM 1473 O GLY E 211 36.915 51.175 25.807 1.00 15.64 O ATOM 1474 N ASN E 212 38.529 52.580 24.977 1.00 14.54 N ATOM 1475 CA ASN E 212 39.410 52.493 26.141 1.00 14.02 C ATOM 1476 C ASN E 212 39.781 51.049 26.464 1.00 13.73 C ATOM 1477 O ASN E 212 39.666 50.562 27.609 1.00 15.00 O ATOM 1478 CB ASN E 212 38.765 53.188 27.364 1.00 14.87 C ATOM 1479 CG ASN E 212 39.728 53.303 28.518 1.00 16.91 C ATOM 1480 OD1 ASN E 212 40.939 53.295 28.312 1.00 16.73 O ATOM 1481 ND2 ASN E 212 39.197 53.333 29.736 1.00 18.83 N ATOM 1482 N LYS E 213 40.202 50.322 25.430 1.00 13.23 N ATOM 1483 CA LYS E 213 40.559 48.912 25.613 1.00 13.34 C ATOM 1484 C LYS E 213 42.011 48.758 25.157 1.00 13.00 C ATOM 1485 O LYS E 213 42.629 49.721 24.644 1.00 11.65 O ATOM 1486 CB LYS E 213 39.637 47.982 24.767 1.00 14.23 C ATOM 1487 CG LYS E 213 38.109 48.009 25.157 1.00 17.56 C ATOM 1488 CD LYS E 213 37.890 47.432 26.576 1.00 23.92 C ATOM 1489 CE LYS E 213 36.398 47.399 27.079 1.00 25.93 C ATOM 1490 NZ ALYS E 213 36.248 46.469 28.305 0.67 23.29 N ATOM 1491 NZ BLYS E 213 35.622 48.608 26.680 0.33 21.43 N ATOM 1492 N TYR E 214 42.550 47.567 25.368 1.00 12.25 N ATOM 1493 CA TYR E 214 43.904 47.208 24.897 1.00 12.84 C ATOM 1494 C TYR E 214 43.801 45.766 24.410 1.00 13.16 C ATOM 1495 O TYR E 214 42.926 44.992 24.850 1.00 13.39 O ATOM 1496 CB TYR E 214 44.897 47.236 26.078 1.00 11.96 C ATOM 1497 CG TYR E 214 44.951 48.617 26.693 1.00 12.22 C ATOM 1498 CD1 TYR E 214 45.796 49.608 26.141 1.00 12.44 C ATOM 1499 CD2 TYR E 214 44.102 48.971 27.764 1.00 13.52 C ATOM 1500 CE1 TYR E 214 45.847 50.895 26.716 1.00 10.68 C ATOM 1501 CE2 TYR E 214 44.132 50.265 28.308 1.00 13.48 C ATOM 1502 CZ TYR E 214 44.990 51.207 27.783 1.00 11.58 C ATOM 1503 OH TYR E 214 45.031 52.489 28.319 1.00 12.20 O ATOM 1504 N GLY E 215 44.726 45.363 23.559 1.00 12.59 N ATOM 1505 CA GLY E 215 44.731 43.976 23.167 1.00 11.35 C ATOM 1506 C GLY E 215 45.890 43.642 22.276 1.00 11.65 C ATOM 1507 O GLY E 215 46.470 44.530 21.663 1.00 12.02 O ATOM 1508 N ALA E 216 46.187 42.351 22.196 1.00 11.72 N ATOM 1509 CA ALA E 216 47.305 41.805 21.421 1.00 12.76 C ATOM 1510 C ALA E 216 46.884 41.459 19.974 1.00 12.35 C ATOM 1511 O ALA E 216 45.999 40.621 19.761 1.00 13.66 O ATOM 1512 CB ALA E 216 47.863 40.520 22.155 1.00 12.70 C ATOM 1513 N TYR E 217 47.522 42.111 18.988 1.00 12.44 N ATOM 1514 CA TYR E 217 47.266 41.826 17.553 1.00 11.54 C ATOM 1515 C TYR E 217 48.567 41.288 16.943 1.00 12.42 C ATOM 1516 O TYR E 217 49.667 41.437 17.519 1.00 11.31 O ATOM 1517 CB TYR E 217 46.820 43.097 16.784 1.00 12.90 C ATOM 1518 CG TYR E 217 45.374 43.513 16.927 1.00 11.33 C ATOM 1519 CD1 TYR E 217 44.512 42.905 17.861 1.00 12.97 C ATOM 1520 CD2 TYR E 217 44.835 44.442 16.038 1.00 11.87 C ATOM 1521 CE1 TYR E 217 43.152 43.292 17.926 1.00 13.28 C ATOM 1522 CE2 TYR E 217 43.478 44.827 16.095 1.00 14.93 C ATOM 1523 CZ TYR E 217 42.650 44.228 17.025 1.00 13.67 C ATOM 1524 OH TYR E 217 41.334 44.611 17.069 1.00 15.37 O ATOM 1525 N ASN E 218 48.421 40.609 15.805 1.00 12.41 N ATOM 1526 CA ASN E 218 49.527 40.037 15.017 1.00 13.04 C ATOM 1527 C ASN E 218 49.464 40.617 13.633 1.00 12.88 C ATOM 1528 O ASN E 218 48.368 40.880 13.123 1.00 13.38 O ATOM 1529 CB ASN E 218 49.361 38.506 14.883 1.00 13.04 C ATOM 1530 CG ASN E 218 49.271 37.821 16.244 1.00 16.15 C ATOM 1531 OD1 ASN E 218 50.191 37.863 17.044 1.00 19.93 O ATOM 1532 ND2 ASN E 218 48.099 37.260 16.539 1.00 25.39 N ATOM 1533 N GLY E 219 50.622 40.777 13.008 1.00 13.61 N ATOM 1534 CA GLY E 219 50.658 41.197 11.607 1.00 13.50 C ATOM 1535 C GLY E 219 51.870 42.032 11.248 1.00 13.48 C ATOM 1536 O GLY E 219 52.501 42.673 12.120 1.00 12.12 O ATOM 1537 N THR E 220 52.163 42.101 9.950 1.00 12.91 N ATOM 1538 CA THR E 220 53.138 43.127 9.538 1.00 12.85 C ATOM 1539 C THR E 220 52.562 44.542 9.768 1.00 11.69 C ATOM 1540 O THR E 220 53.311 45.505 9.876 1.00 12.59 O ATOM 1541 CB THR E 220 53.607 42.963 8.066 1.00 12.45 C ATOM 1542 OG1 THR E 220 52.483 42.966 7.135 1.00 12.17 O ATOM 1543 CG2 THR E 220 54.440 41.623 7.903 1.00 13.41 C ATOM 1544 N SER E 221 51.237 44.660 9.882 1.00 11.73 N ATOM 1545 CA SER E 221 50.619 45.926 10.342 1.00 11.46 C ATOM 1546 C SER E 221 51.143 46.389 11.696 1.00 10.76 C ATOM 1547 O SER E 221 51.127 47.569 11.986 1.00 10.96 O ATOM 1548 CB SER E 221 49.110 45.729 10.572 1.00 10.60 C ATOM 1549 OG SER E 221 48.395 45.836 9.339 1.00 10.83 O ATOM 1550 N MET E 222 51.453 45.443 12.565 1.00 11.02 N ATOM 1551 CA MET E 222 51.964 45.722 13.913 1.00 11.13 C ATOM 1552 C MET E 222 53.449 46.020 13.903 1.00 11.46 C ATOM 1553 O MET E 222 53.951 46.774 14.770 1.00 11.06 O ATOM 1554 CB MET E 222 51.679 44.525 14.861 1.00 11.74 C ATOM 1555 CG MET E 222 50.209 44.459 15.374 1.00 11.18 C ATOM 1556 SD MET E 222 48.938 44.225 14.035 1.00 12.71 S ATOM 1557 CE MET E 222 48.244 45.862 13.970 1.00 10.63 C ATOM 1558 N ALA E 223 54.159 45.422 12.946 1.00 11.00 N ATOM 1559 CA ALA E 223 55.585 45.670 12.815 1.00 11.23 C ATOM 1560 C ALA E 223 55.859 47.095 12.277 1.00 10.99 C ATOM 1561 O ALA E 223 56.718 47.803 12.806 1.00 11.40 O ATOM 1562 CB ALA E 223 56.214 44.590 11.885 1.00 11.94 C ATOM 1563 N SER E 224 55.150 47.487 11.207 1.00 10.63 N ATOM 1564 CA SER E 224 55.337 48.798 10.560 1.00 10.36 C ATOM 1565 C SER E 224 55.385 49.986 11.566 1.00 11.59 C ATOM 1566 O SER E 224 56.313 50.785 11.502 1.00 10.93 O ATOM 1567 CB SER E 224 54.263 49.035 9.483 1.00 11.30 C ATOM 1568 OG SER E 224 54.486 50.221 8.744 1.00 12.13 O ATOM 1569 N PRO E 225 54.427 50.118 12.480 1.00 10.39 N ATOM 1570 CA PRO E 225 54.446 51.306 13.365 1.00 9.58 C ATOM 1571 C PRO E 225 55.622 51.270 14.364 1.00 10.26 C ATOM 1572 O PRO E 225 55.936 52.356 14.884 1.00 10.77 O ATOM 1573 CB PRO E 225 53.094 51.253 14.100 1.00 10.79 C ATOM 1574 CG PRO E 225 52.712 49.733 14.012 1.00 9.39 C ATOM 1575 CD PRO E 225 53.181 49.348 12.637 1.00 10.31 C ATOM 1576 N HIS E 226 56.252 50.120 14.623 1.00 10.06 N ATOM 1577 CA HIS E 226 57.499 50.175 15.416 1.00 9.87 C ATOM 1578 C HIS E 226 58.549 50.998 14.663 1.00 10.09 C ATOM 1579 O HIS E 226 59.297 51.753 15.278 1.00 10.23 O ATOM 1580 CB HIS E 226 58.048 48.770 15.666 1.00 9.49 C ATOM 1581 CG HIS E 226 57.288 48.001 16.710 1.00 10.91 C ATOM 1582 ND1 HIS E 226 56.195 47.206 16.401 1.00 11.19 N ATOM 1583 CD2 HIS E 226 57.510 47.847 18.035 1.00 12.06 C ATOM 1584 CE1 HIS E 226 55.740 46.649 17.520 1.00 9.87 C ATOM 1585 NE2 HIS E 226 56.531 47.002 18.517 1.00 12.13 N ATOM 1586 N VAL E 227 58.608 50.808 13.349 1.00 10.75 N ATOM 1587 CA VAL E 227 59.599 51.491 12.522 1.00 10.54 C ATOM 1588 C VAL E 227 59.173 52.947 12.320 1.00 10.92 C ATOM 1589 O VAL E 227 60.037 53.848 12.309 1.00 11.45 O ATOM 1590 CB VAL E 227 59.763 50.720 11.185 1.00 11.34 C ATOM 1591 CG1 VAL E 227 60.723 51.460 10.203 1.00 11.32 C ATOM 1592 CG2 VAL E 227 60.261 49.289 11.460 1.00 11.14 C ATOM 1593 N ALA E 228 57.867 53.201 12.138 1.00 10.25 N ATOM 1594 CA ALA E 228 57.424 54.592 11.998 1.00 10.36 C ATOM 1595 C ALA E 228 57.715 55.331 13.313 1.00 10.83 C ATOM 1596 O ALA E 228 58.170 56.480 13.292 1.00 10.21 O ATOM 1597 CB ALA E 228 55.938 54.655 11.691 1.00 10.69 C ATOM 1598 N GLY E 229 57.399 54.711 14.454 1.00 10.48 N ATOM 1599 CA GLY E 229 57.727 55.311 15.751 1.00 11.17 C ATOM 1600 C GLY E 229 59.248 55.511 15.904 1.00 10.81 C ATOM 1601 O GLY E 229 59.723 56.561 16.410 1.00 10.52 O ATOM 1602 N ALA E 230 60.041 54.545 15.445 1.00 10.12 N ATOM 1603 CA ALA E 230 61.502 54.687 15.564 1.00 10.04 C ATOM 1604 C ALA E 230 61.955 55.904 14.745 1.00 10.25 C ATOM 1605 O ALA E 230 62.862 56.635 15.160 1.00 10.24 O ATOM 1606 CB ALA E 230 62.201 53.465 15.039 1.00 10.48 C ATOM 1607 N ALA E 231 61.390 56.068 13.573 1.00 9.56 N ATOM 1608 CA ALA E 231 61.728 57.231 12.749 1.00 9.70 C ATOM 1609 C ALA E 231 61.410 58.530 13.504 1.00 11.05 C ATOM 1610 O ALA E 231 62.195 59.502 13.428 1.00 12.16 O ATOM 1611 CB ALA E 231 60.909 57.206 11.404 1.00 9.19 C ATOM 1612 N ALA E 232 60.278 58.558 14.211 1.00 11.34 N ATOM 1613 CA ALA E 232 59.953 59.741 14.991 1.00 11.45 C ATOM 1614 C ALA E 232 60.966 59.966 16.137 1.00 11.91 C ATOM 1615 O ALA E 232 61.292 61.119 16.439 1.00 11.17 O ATOM 1616 CB ALA E 232 58.461 59.684 15.492 1.00 12.19 C ATOM 1617 N LEU E 233 61.408 58.895 16.821 1.00 11.01 N ATOM 1618 CA LEU E 233 62.421 59.021 17.887 1.00 11.50 C ATOM 1619 C LEU E 233 63.708 59.601 17.289 1.00 12.33 C ATOM 1620 O LEU E 233 64.277 60.536 17.861 1.00 12.89 O ATOM 1621 CB LEU E 233 62.774 57.647 18.509 1.00 10.98 C ATOM 1622 CG LEU E 233 61.628 57.042 19.357 1.00 10.73 C ATOM 1623 CD1 LEU E 233 62.123 55.646 19.873 1.00 10.03 C ATOM 1624 CD2 LEU E 233 61.305 58.019 20.542 1.00 10.89 C ATOM 1625 N ILE E 234 64.118 59.064 16.143 1.00 11.61 N ATOM 1626 CA ILE E 234 65.331 59.520 15.487 1.00 10.87 C ATOM 1627 C ILE E 234 65.267 61.018 15.153 1.00 11.15 C ATOM 1628 O ILE E 234 66.195 61.772 15.452 1.00 12.25 O ATOM 1629 CB ILE E 234 65.635 58.663 14.238 1.00 10.96 C ATOM 1630 CG1 ILE E 234 65.980 57.272 14.706 1.00 9.72 C ATOM 1631 CG2 ILE E 234 66.834 59.245 13.431 1.00 11.38 C ATOM 1632 CD1 ILE E 234 65.881 56.167 13.623 1.00 10.58 C ATOM 1633 N LEU E 235 64.166 61.404 14.536 1.00 11.53 N ATOM 1634 CA LEU E 235 63.951 62.796 14.171 1.00 12.14 C ATOM 1635 C LEU E 235 63.894 63.704 15.397 1.00 13.74 C ATOM 1636 O LEU E 235 64.373 64.847 15.329 1.00 14.75 O ATOM 1637 CB LEU E 235 62.670 62.942 13.339 1.00 12.19 C ATOM 1638 CG LEU E 235 62.880 62.489 11.903 1.00 11.89 C ATOM 1639 CD1 LEU E 235 61.513 62.395 11.169 1.00 13.73 C ATOM 1640 CD2 LEU E 235 63.879 63.451 11.119 1.00 12.43 C ATOM 1641 N SER E 236 63.365 63.213 16.528 1.00 12.26 N ATOM 1642 CA SER E 236 63.344 64.065 17.732 1.00 13.07 C ATOM 1643 C SER E 236 64.747 64.291 18.278 1.00 12.75 C ATOM 1644 O SER E 236 65.031 65.360 18.853 1.00 15.31 O ATOM 1645 CB SER E 236 62.348 63.531 18.803 1.00 12.14 C ATOM 1646 OG SER E 236 62.819 62.360 19.468 1.00 11.27 O ATOM 1647 N LYS E 237 65.638 63.340 18.062 1.00 12.72 N ATOM 1648 CA LYS E 237 67.031 63.502 18.513 1.00 13.10 C ATOM 1649 C LYS E 237 67.849 64.267 17.439 1.00 14.56 C ATOM 1650 O LYS E 237 68.817 64.968 17.785 1.00 15.67 O ATOM 1651 CB LYS E 237 67.676 62.158 18.785 1.00 12.32 C ATOM 1652 CG LYS E 237 69.105 62.292 19.347 1.00 11.95 C ATOM 1653 CD LYS E 237 69.625 60.939 19.688 1.00 12.91 C ATOM 1654 CE LYS E 237 70.995 61.125 20.338 1.00 15.71 C ATOM 1655 NZ LYS E 237 71.760 59.845 20.595 1.00 18.37 N ATOM 1656 N HIS E 238 67.485 64.121 16.161 1.00 12.94 N ATOM 1657 CA HIS E 238 68.231 64.733 15.043 1.00 12.69 C ATOM 1658 C HIS E 238 67.247 65.443 14.130 1.00 13.51 C ATOM 1659 O HIS E 238 66.932 64.968 13.049 1.00 13.18 O ATOM 1660 CB HIS E 238 68.983 63.630 14.245 1.00 11.12 C ATOM 1661 CG HIS E 238 69.987 62.894 15.058 1.00 13.48 C ATOM 1662 ND1 HIS E 238 71.228 63.422 15.357 1.00 13.30 N ATOM 1663 CD2 HIS E 238 69.942 61.670 15.638 1.00 13.03 C ATOM 1664 CE1 HIS E 238 71.907 62.540 16.081 1.00 13.76 C ATOM 1665 NE2 HIS E 238 71.133 61.487 16.284 1.00 13.49 N ATOM 1666 N PRO E 239 66.697 66.568 14.563 1.00 14.83 N ATOM 1667 CA PRO E 239 65.579 67.194 13.831 1.00 15.50 C ATOM 1668 C PRO E 239 65.930 67.705 12.433 1.00 15.50 C ATOM 1669 O PRO E 239 65.008 67.914 11.639 1.00 17.92 O ATOM 1670 CB PRO E 239 65.120 68.351 14.740 1.00 16.05 C ATOM 1671 CG PRO E 239 66.018 68.377 15.862 1.00 17.65 C ATOM 1672 CD PRO E 239 67.039 67.241 15.835 1.00 16.52 C ATOM 1673 N ASN E 240 67.205 67.838 12.132 1.00 15.87 N ATOM 1674 CA ASN E 240 67.606 68.222 10.763 1.00 16.78 C ATOM 1675 C AASN E 240 67.878 67.087 9.830 0.50 16.34 C ATOM 1676 C BASN E 240 68.258 67.085 9.951 0.50 16.66 C ATOM 1677 O AASN E 240 68.122 67.325 8.631 0.50 15.95 O ATOM 1678 O BASN E 240 69.007 67.290 8.954 0.50 14.51 O ATOM 1679 CB AASN E 240 68.907 69.075 10.889 0.50 16.00 C ATOM 1680 CB BASN E 240 68.347 69.556 10.699 0.50 18.48 C ATOM 1681 CG AASN E 240 68.588 70.537 11.148 0.50 14.44 C ATOM 1682 CG BASN E 240 69.596 69.498 11.450 0.50 18.19 C ATOM 1683 OD1AASN E 240 67.504 70.956 10.853 0.50 13.29 O ATOM 1684 OD1BASN E 240 69.886 68.462 12.034 0.50 22.83 O ATOM 1685 ND2AASN E 240 69.525 71.299 11.693 0.50 9.43 N ATOM 1686 ND2BASN E 240 70.345 70.600 11.496 0.50 20.13 N ATOM 1687 N TRP E 241 67.943 65.864 10.367 1.00 15.71 N ATOM 1688 CA TRP E 241 68.154 64.703 9.489 1.00 15.98 C ATOM 1689 C TRP E 241 67.042 64.630 8.469 1.00 14.85 C ATOM 1690 O TRP E 241 65.883 64.900 8.770 1.00 15.51 O ATOM 1691 CB TRP E 241 68.219 63.385 10.285 1.00 14.28 C ATOM 1692 CG TRP E 241 69.574 63.149 10.919 1.00 15.39 C ATOM 1693 CD1 TRP E 241 70.620 64.059 11.031 1.00 14.79 C ATOM 1694 CD2 TRP E 241 70.028 61.945 11.539 1.00 14.71 C ATOM 1695 NE1 TRP E 241 71.679 63.473 11.683 1.00 15.24 N ATOM 1696 CE2 TRP E 241 71.355 62.176 11.996 1.00 15.64 C ATOM 1697 CE3 TRP E 241 69.445 60.684 11.785 1.00 13.38 C ATOM 1698 CZ2 TRP E 241 72.089 61.218 12.693 1.00 15.94 C ATOM 1699 CZ3 TRP E 241 70.199 59.715 12.449 1.00 12.16 C ATOM 1700 CH2 TRP E 241 71.501 59.997 12.915 1.00 13.92 C ATOM 1701 N THR E 242 67.421 64.353 7.222 1.00 13.87 N ATOM 1702 CA THR E 242 66.461 64.142 6.152 1.00 13.75 C ATOM 1703 C THR E 242 65.850 62.779 6.296 1.00 12.96 C ATOM 1704 O THR E 242 66.379 61.896 7.020 1.00 12.93 O ATOM 1705 CB THR E 242 67.176 64.142 4.783 1.00 13.30 C ATOM 1706 OG1 THR E 242 68.180 63.127 4.774 1.00 16.42 O ATOM 1707 CG2 THR E 242 67.942 65.504 4.607 1.00 16.14 C ATOM 1708 N ASN E 243 64.780 62.588 5.542 1.00 13.17 N ATOM 1709 CA ASN E 243 64.206 61.228 5.446 1.00 13.58 C ATOM 1710 C ASN E 243 65.232 60.230 4.919 1.00 12.61 C ATOM 1711 O ASN E 243 65.309 59.101 5.409 1.00 13.22 O ATOM 1712 CB ASN E 243 62.885 61.203 4.648 1.00 12.17 C ATOM 1713 CG ASN E 243 63.023 61.748 3.207 1.00 15.27 C ATOM 1714 OD1 ASN E 243 63.989 62.471 2.859 1.00 13.74 O ATOM 1715 ND2 ASN E 243 62.062 61.401 2.371 1.00 13.53 N ATOM 1716 N THR E 244 66.052 60.645 3.945 1.00 12.31 N ATOM 1717 CA THR E 244 67.136 59.778 3.457 1.00 12.59 C ATOM 1718 C THR E 244 68.007 59.282 4.589 1.00 13.47 C ATOM 1719 O THR E 244 68.371 58.102 4.647 1.00 14.17 O ATOM 1720 CB THR E 244 68.027 60.601 2.485 1.00 13.31 C ATOM 1721 OG1 THR E 244 67.157 61.251 1.548 1.00 14.82 O ATOM 1722 CG2 THR E 244 68.904 59.640 1.650 1.00 15.62 C ATOM 1723 N GLN E 245 68.375 60.211 5.485 1.00 12.67 N ATOM 1724 CA GLN E 245 69.256 59.895 6.585 1.00 12.36 C ATOM 1725 C GLN E 245 68.525 59.018 7.592 1.00 12.49 C ATOM 1726 O GLN E 245 69.135 58.101 8.174 1.00 14.28 O ATOM 1727 CB GLN E 245 69.738 61.162 7.265 1.00 13.37 C ATOM 1728 CG AGLN E 245 70.589 60.877 8.502 0.50 15.25 C ATOM 1729 CG BGLN E 245 70.847 61.885 6.488 0.50 11.77 C ATOM 1730 CD AGLN E 245 71.757 59.881 8.291 0.50 16.84 C ATOM 1731 CD BGLN E 245 71.287 63.203 7.122 0.50 10.90 C ATOM 1732 OE1AGLN E 245 71.989 58.999 9.120 0.50 17.78 O ATOM 1733 OE1BGLN E 245 70.497 64.108 7.333 0.50 11.99 O ATOM 1734 NE2AGLN E 245 72.463 60.017 7.190 0.50 14.09 N ATOM 1735 NE2BGLN E 245 72.575 63.309 7.405 0.50 17.08 N ATOM 1736 N VAL E 246 67.258 59.333 7.870 1.00 12.14 N ATOM 1737 CA VAL E 246 66.522 58.474 8.838 1.00 11.93 C ATOM 1738 C VAL E 246 66.454 57.044 8.317 1.00 11.53 C ATOM 1739 O VAL E 246 66.738 56.079 9.072 1.00 12.58 O ATOM 1740 CB VAL E 246 65.130 59.015 9.147 1.00 11.95 C ATOM 1741 CG1 VAL E 246 64.354 58.036 10.065 1.00 11.40 C ATOM 1742 CG2 VAL E 246 65.250 60.379 9.848 1.00 11.96 C ATOM 1743 N ARG E 247 66.096 56.892 7.047 1.00 12.30 N ATOM 1744 CA ARG E 247 65.991 55.575 6.466 1.00 13.18 C ATOM 1745 C ARG E 247 67.313 54.845 6.513 1.00 12.74 C ATOM 1746 O ARG E 247 67.360 53.698 6.953 1.00 12.86 O ATOM 1747 CB ARG E 247 65.545 55.697 5.016 1.00 12.85 C ATOM 1748 CG ARG E 247 65.462 54.355 4.327 1.00 13.37 C ATOM 1749 CD ARG E 247 64.700 54.419 3.015 1.00 13.77 C ATOM 1750 NE ARG E 247 64.675 53.079 2.434 1.00 15.90 N ATOM 1751 CZ ARG E 247 63.880 52.705 1.413 1.00 16.98 C ATOM 1752 NH1 ARG E 247 63.048 53.569 0.824 1.00 15.61 N ATOM 1753 NH2 ARG E 247 63.949 51.438 0.979 1.00 17.18 N ATOM 1754 N SER E 248 68.387 55.473 6.036 1.00 12.29 N ATOM 1755 CA SER E 248 69.702 54.823 6.127 1.00 13.69 C ATOM 1756 C SER E 248 70.098 54.502 7.556 1.00 13.98 C ATOM 1757 O SER E 248 70.675 53.446 7.774 1.00 14.12 O ATOM 1758 CB SER E 248 70.854 55.635 5.474 1.00 14.30 C ATOM 1759 OG ASER E 248 70.554 56.078 4.188 0.50 13.85 O ATOM 1760 OG BSER E 248 70.972 56.903 5.969 0.50 14.65 O ATOM 1761 N SER E 249 69.741 55.360 8.535 1.00 12.60 N ATOM 1762 CA SER E 249 70.152 55.063 9.904 1.00 13.12 C ATOM 1763 C SER E 249 69.518 53.783 10.416 1.00 12.27 C ATOM 1764 O SER E 249 70.156 52.997 11.118 1.00 13.31 O ATOM 1765 CB SER E 249 69.842 56.225 10.875 1.00 12.89 C ATOM 1766 OG ASER E 249 70.374 57.447 10.387 0.33 15.39 O ATOM 1767 OG BSER E 249 68.471 56.289 11.182 0.67 10.82 O ATOM 1768 N LEU E 250 68.267 53.577 10.040 1.00 12.09 N ATOM 1769 CA LEU E 250 67.558 52.351 10.436 1.00 12.56 C ATOM 1770 C LEU E 250 68.080 51.122 9.698 1.00 12.46 C ATOM 1771 O LEU E 250 68.282 50.060 10.299 1.00 13.05 O ATOM 1772 CB LEU E 250 66.070 52.528 10.145 1.00 12.85 C ATOM 1773 CG LEU E 250 65.365 53.463 11.164 1.00 14.77 C ATOM 1774 CD1 LEU E 250 64.025 53.921 10.618 1.00 14.54 C ATOM 1775 CD2 LEU E 250 65.168 52.727 12.525 1.00 14.35 C ATOM 1776 N GLU E 251 68.345 51.275 8.415 1.00 11.99 N ATOM 1777 CA GLU E 251 68.815 50.138 7.616 1.00 13.06 C ATOM 1778 C GLU E 251 70.210 49.719 7.998 1.00 12.75 C ATOM 1779 O GLU E 251 70.537 48.540 7.979 1.00 14.16 O ATOM 1780 CB GLU E 251 68.800 50.524 6.123 1.00 13.35 C ATOM 1781 CG GLU E 251 67.376 50.559 5.594 1.00 13.60 C ATOM 1782 CD GLU E 251 67.284 51.180 4.215 1.00 18.45 C ATOM 1783 OE1 GLU E 251 68.259 51.846 3.767 1.00 18.32 O ATOM 1784 OE2 GLU E 251 66.206 51.022 3.581 1.00 18.21 O ATOM 1785 N ASN E 252 71.047 50.708 8.345 1.00 12.53 N ATOM 1786 CA ASN E 252 72.454 50.467 8.552 1.00 12.28 C ATOM 1787 C ASN E 252 72.794 49.969 9.952 1.00 13.51 C ATOM 1788 O ASN E 252 73.988 49.678 10.222 1.00 13.48 O ATOM 1789 CB ASN E 252 73.251 51.753 8.285 1.00 12.27 C ATOM 1790 CG ASN E 252 73.215 52.195 6.819 1.00 11.76 C ATOM 1791 OD1 ASN E 252 73.752 53.288 6.493 1.00 17.09 O ATOM 1792 ND2 ASN E 252 72.569 51.418 5.945 1.00 10.50 N ATOM 1793 N THR E 253 71.790 49.929 10.849 1.00 12.23 N ATOM 1794 CA THR E 253 72.063 49.564 12.245 1.00 13.08 C ATOM 1795 C THR E 253 71.171 48.426 12.729 1.00 11.90 C ATOM 1796 O THR E 253 71.104 48.187 13.925 1.00 12.72 O ATOM 1797 CB THR E 253 71.855 50.755 13.202 1.00 12.97 C ATOM 1798 OG1 THR E 253 70.508 51.242 13.044 1.00 12.47 O ATOM 1799 CG2 THR E 253 72.788 51.959 12.774 1.00 11.58 C ATOM 1800 N THR E 254 70.512 47.741 11.818 1.00 12.69 N ATOM 1801 CA THR E 254 69.765 46.552 12.209 1.00 12.26 C ATOM 1802 C THR E 254 70.654 45.494 12.854 1.00 13.25 C ATOM 1803 O THR E 254 71.869 45.428 12.647 1.00 14.44 O ATOM 1804 CB THR E 254 69.127 45.863 10.993 1.00 12.10 C ATOM 1805 OG1 THR E 254 70.176 45.722 10.011 1.00 13.86 O ATOM 1806 CG2 THR E 254 67.992 46.732 10.355 1.00 10.47 C ATOM 1807 N THR E 255 70.018 44.651 13.636 1.00 12.59 N ATOM 1808 CA THR E 255 70.642 43.396 14.052 1.00 14.57 C ATOM 1809 C THR E 255 70.354 42.397 12.963 1.00 15.14 C ATOM 1810 O THR E 255 69.186 42.028 12.717 1.00 15.13 O ATOM 1811 CB THR E 255 70.035 42.965 15.375 1.00 14.98 C ATOM 1812 OG1 THR E 255 70.446 43.921 16.364 1.00 15.77 O ATOM 1813 CG2 THR E 255 70.624 41.607 15.860 1.00 17.07 C ATOM 1814 N LYS E 256 71.406 41.942 12.268 1.00 16.61 N ATOM 1815 CA LYS E 256 71.170 41.019 11.161 1.00 17.99 C ATOM 1816 C LYS E 256 70.654 39.673 11.707 1.00 18.26 C ATOM 1817 O LYS E 256 71.097 39.224 12.776 1.00 18.63 O ATOM 1818 CB LYS E 256 72.436 40.868 10.245 1.00 19.65 C ATOM 1819 CG LYS E 256 72.843 42.192 9.465 1.00 18.91 C ATOM 1820 CD LYS E 256 72.300 42.244 8.003 1.00 18.55 C ATOM 1821 CE LYS E 256 72.485 43.675 7.363 1.00 22.15 C ATOM 1822 NZ LYS E 256 72.844 43.676 5.882 1.00 16.40 N ATOM 1823 N LEU E 257 69.669 39.115 10.995 1.00 18.80 N ATOM 1824 CA LEU E 257 68.982 37.887 11.393 1.00 20.85 C ATOM 1825 C LEU E 257 69.301 36.872 10.278 1.00 23.47 C ATOM 1826 O LEU E 257 70.462 36.763 9.881 1.00 27.27 O ATOM 1827 CB LEU E 257 67.488 38.151 11.619 1.00 19.77 C ATOM 1828 CG LEU E 257 67.205 39.172 12.764 1.00 17.82 C ATOM 1829 CD1 LEU E 257 65.691 39.454 12.887 1.00 16.14 C ATOM 1830 CD2 LEU E 257 67.798 38.739 14.130 1.00 21.28 C ATOM 1831 N GLY E 258 68.349 36.185 9.692 1.00 25.18 N ATOM 1832 CA GLY E 258 68.741 35.315 8.577 1.00 25.78 C ATOM 1833 C GLY E 258 69.003 35.920 7.198 1.00 25.53 C ATOM 1834 O GLY E 258 69.314 37.107 7.025 1.00 26.90 O ATOM 1835 N ASP E 259 68.868 35.067 6.188 1.00 25.25 N ATOM 1836 CA ASP E 259 68.912 35.498 4.805 1.00 24.31 C ATOM 1837 C ASP E 259 67.945 36.653 4.535 1.00 22.82 C ATOM 1838 O ASP E 259 66.789 36.650 5.020 1.00 20.43 O ATOM 1839 CB ASP E 259 68.585 34.324 3.875 1.00 26.35 C ATOM 1840 CG ASP E 259 68.771 34.682 2.424 1.00 30.29 C ATOM 1841 OD1 ASP E 259 69.894 34.458 1.875 1.00 38.71 O ATOM 1842 OD2 ASP E 259 67.906 35.237 1.742 1.00 29.45 O ATOM 1843 N SER E 260 68.423 37.614 3.748 1.00 21.27 N ATOM 1844 CA SER E 260 67.708 38.868 3.499 1.00 21.00 C ATOM 1845 C SER E 260 66.410 38.679 2.741 1.00 20.00 C ATOM 1846 O SER E 260 65.496 39.486 2.828 1.00 20.14 O ATOM 1847 CB SER E 260 68.601 39.869 2.783 1.00 22.10 C ATOM 1848 OG SER E 260 68.971 39.397 1.494 1.00 24.78 O ATOM 1849 N PHE E 261 66.306 37.570 2.006 1.00 19.83 N ATOM 1850 CA PHE E 261 65.037 37.225 1.390 1.00 19.22 C ATOM 1851 C PHE E 261 63.909 37.096 2.413 1.00 17.97 C ATOM 1852 O PHE E 261 62.771 37.483 2.123 1.00 18.09 O ATOM 1853 CB PHE E 261 65.186 35.910 0.573 1.00 19.85 C ATOM 1854 CG PHE E 261 63.987 35.602 -0.300 1.00 19.39 C ATOM 1855 CD1 PHE E 261 63.852 36.167 -1.571 1.00 20.92 C ATOM 1856 CD2 PHE E 261 62.981 34.746 0.178 1.00 19.86 C ATOM 1857 CE1 PHE E 261 62.729 35.852 -2.376 1.00 20.94 C ATOM 1858 CE2 PHE E 261 61.856 34.419 -0.617 1.00 20.62 C ATOM 1859 CZ PHE E 261 61.731 34.996 -1.878 1.00 20.91 C ATOM 1860 N TYR E 262 64.238 36.574 3.590 1.00 17.46 N ATOM 1861 CA TYR E 262 63.237 36.286 4.630 1.00 18.11 C ATOM 1862 C TYR E 262 63.226 37.343 5.720 1.00 17.27 C ATOM 1863 O TYR E 262 62.215 37.512 6.386 1.00 17.36 O ATOM 1864 CB TYR E 262 63.524 34.942 5.278 1.00 18.33 C ATOM 1865 CG TYR E 262 63.380 33.837 4.264 1.00 21.05 C ATOM 1866 CD1 TYR E 262 62.103 33.382 3.886 1.00 25.28 C ATOM 1867 CD2 TYR E 262 64.510 33.268 3.655 1.00 25.07 C ATOM 1868 CE1 TYR E 262 61.949 32.378 2.928 1.00 27.53 C ATOM 1869 CE2 TYR E 262 64.358 32.261 2.701 1.00 28.23 C ATOM 1870 CZ TYR E 262 63.086 31.822 2.355 1.00 28.73 C ATOM 1871 OH TYR E 262 62.940 30.845 1.397 1.00 29.07 O ATOM 1872 N TYR E 263 64.355 38.019 5.895 1.00 16.30 N ATOM 1873 CA TYR E 263 64.514 38.926 7.034 1.00 15.57 C ATOM 1874 C TYR E 263 64.887 40.347 6.663 1.00 15.10 C ATOM 1875 O TYR E 263 65.122 41.151 7.544 1.00 15.58 O ATOM 1876 CB TYR E 263 65.594 38.368 7.988 1.00 15.37 C ATOM 1877 CG TYR E 263 65.094 37.184 8.796 1.00 17.08 C ATOM 1878 CD1 TYR E 263 64.456 37.386 10.033 1.00 14.91 C ATOM 1879 CD2 TYR E 263 65.258 35.856 8.339 1.00 18.84 C ATOM 1880 CE1 TYR E 263 63.984 36.300 10.806 1.00 18.17 C ATOM 1881 CE2 TYR E 263 64.801 34.744 9.103 1.00 20.18 C ATOM 1882 CZ TYR E 263 64.147 34.972 10.328 1.00 18.92 C ATOM 1883 OH TYR E 263 63.663 33.919 11.092 1.00 20.76 O ATOM 1884 N GLY E 264 65.044 40.637 5.378 1.00 16.01 N ATOM 1885 CA GLY E 264 65.667 41.907 4.962 1.00 15.96 C ATOM 1886 C GLY E 264 66.977 42.135 5.660 1.00 16.76 C ATOM 1887 O GLY E 264 67.754 41.195 5.893 1.00 15.77 O ATOM 1888 N LYS E 265 67.223 43.383 6.065 1.00 15.01 N ATOM 1889 CA LYS E 265 68.430 43.696 6.850 1.00 15.04 C ATOM 1890 C LYS E 265 68.436 43.253 8.314 1.00 14.22 C ATOM 1891 O LYS E 265 69.466 43.358 8.990 1.00 15.23 O ATOM 1892 CB LYS E 265 68.753 45.193 6.710 1.00 15.09 C ATOM 1893 CG LYS E 265 68.901 45.498 5.187 1.00 17.35 C ATOM 1894 CD LYS E 265 68.846 46.972 4.949 1.00 18.54 C ATOM 1895 CE LYS E 265 69.111 47.283 3.420 1.00 21.90 C ATOM 1896 NZ LYS E 265 67.924 46.863 2.563 1.00 26.86 N ATOM 1897 N GLY E 266 67.296 42.780 8.824 1.00 13.85 N ATOM 1898 CA GLY E 266 67.228 42.313 10.190 1.00 12.93 C ATOM 1899 C GLY E 266 66.331 43.226 11.039 1.00 13.27 C ATOM 1900 O GLY E 266 65.553 44.025 10.501 1.00 12.47 O ATOM 1901 N LEU E 267 66.512 43.099 12.344 1.00 12.31 N ATOM 1902 CA LEU E 267 65.656 43.759 13.329 1.00 12.27 C ATOM 1903 C LEU E 267 66.145 45.181 13.532 1.00 11.83 C ATOM 1904 O LEU E 267 67.323 45.406 13.781 1.00 12.30 O ATOM 1905 CB LEU E 267 65.700 43.003 14.659 1.00 12.00 C ATOM 1906 CG LEU E 267 64.994 43.725 15.821 1.00 11.47 C ATOM 1907 CD1 LEU E 267 63.483 43.637 15.655 1.00 11.92 C ATOM 1908 CD2 LEU E 267 65.438 42.993 17.077 1.00 13.54 C ATOM 1909 N ILE E 268 65.240 46.161 13.433 1.00 12.27 N ATOM 1910 CA ILE E 268 65.669 47.538 13.749 1.00 11.97 C ATOM 1911 C ILE E 268 66.116 47.703 15.186 1.00 12.70 C ATOM 1912 O ILE E 268 65.639 47.031 16.108 1.00 12.65 O ATOM 1913 CB ILE E 268 64.585 48.581 13.415 1.00 13.17 C ATOM 1914 CG1 ILE E 268 63.294 48.391 14.216 1.00 12.23 C ATOM 1915 CG2 ILE E 268 64.278 48.597 11.904 1.00 12.93 C ATOM 1916 CD1 ILE E 268 62.560 49.758 14.515 1.00 9.78 C ATOM 1917 N ASN E 269 67.059 48.626 15.366 1.00 12.04 N ATOM 1918 CA ASN E 269 67.632 48.949 16.645 1.00 11.07 C ATOM 1919 C ASN E 269 67.724 50.473 16.662 1.00 11.94 C ATOM 1920 O ASN E 269 68.634 51.055 16.078 1.00 11.54 O ATOM 1921 CB ASN E 269 69.029 48.303 16.751 1.00 11.42 C ATOM 1922 CG ASN E 269 69.792 48.782 17.974 1.00 12.26 C ATOM 1923 OD1 ASN E 269 69.356 49.714 18.683 1.00 13.09 O ATOM 1924 ND2 ASN E 269 70.907 48.103 18.284 1.00 13.14 N ATOM 1925 N VAL E 270 66.738 51.099 17.272 1.00 10.36 N ATOM 1926 CA VAL E 270 66.629 52.569 17.228 1.00 11.34 C ATOM 1927 C VAL E 270 67.732 53.257 18.063 1.00 12.14 C ATOM 1928 O VAL E 270 68.157 54.352 17.717 1.00 12.71 O ATOM 1929 CB VAL E 270 65.175 53.044 17.589 1.00 11.90 C ATOM 1930 CG1 VAL E 270 64.856 52.813 19.033 1.00 14.08 C ATOM 1931 CG2 VAL E 270 65.029 54.525 17.225 1.00 13.91 C ATOM 1932 N GLN E 271 68.234 52.585 19.098 1.00 11.22 N ATOM 1933 CA GLN E 271 69.381 53.103 19.859 1.00 12.59 C ATOM 1934 C GLN E 271 70.580 53.315 18.932 1.00 12.49 C ATOM 1935 O GLN E 271 71.186 54.389 18.905 1.00 12.47 O ATOM 1936 CB GLN E 271 69.733 52.144 21.000 1.00 11.59 C ATOM 1937 CG GLN E 271 70.918 52.677 21.819 1.00 15.85 C ATOM 1938 CD GLN E 271 71.290 51.717 22.953 1.00 19.12 C ATOM 1939 OE1 GLN E 271 71.068 50.506 22.854 1.00 20.95 O ATOM 1940 NE2 GLN E 271 71.805 52.262 24.045 1.00 19.13 N ATOM 1941 N ALA E 272 70.898 52.278 18.187 1.00 12.49 N ATOM 1942 CA ALA E 272 72.046 52.328 17.270 1.00 12.54 C ATOM 1943 C ALA E 272 71.755 53.296 16.118 1.00 12.49 C ATOM 1944 O ALA E 272 72.656 54.049 15.714 1.00 14.17 O ATOM 1945 CB ALA E 272 72.379 50.950 16.743 1.00 11.44 C ATOM 1946 N ALA E 273 70.505 53.304 15.602 1.00 10.81 N ATOM 1947 CA ALA E 273 70.137 54.171 14.492 1.00 10.94 C ATOM 1948 C ALA E 273 70.349 55.647 14.870 1.00 12.79 C ATOM 1949 O ALA E 273 70.696 56.481 14.015 1.00 13.32 O ATOM 1950 CB ALA E 273 68.671 53.951 14.121 1.00 10.38 C ATOM 1951 N ALA E 274 70.100 55.974 16.141 1.00 12.82 N ATOM 1952 CA ALA E 274 70.091 57.392 16.523 1.00 13.64 C ATOM 1953 C ALA E 274 71.464 57.892 16.969 1.00 13.33 C ATOM 1954 O ALA E 274 71.582 59.034 17.465 1.00 15.07 O ATOM 1955 CB ALA E 274 69.020 57.656 17.588 1.00 12.10 C ATOM 1956 N GLN E 275 72.503 57.065 16.813 1.00 14.47 N ATOM 1957 CA GLN E 275 73.868 57.495 17.086 1.00 16.65 C ATOM 1958 C GLN E 275 74.382 58.182 15.821 1.00 17.21 C ATOM 1959 O GLN E 275 73.761 58.048 14.764 1.00 18.55 O ATOM 1960 CB GLN E 275 74.752 56.270 17.428 1.00 16.44 C ATOM 1961 CG GLN E 275 74.445 55.682 18.810 1.00 20.45 C ATOM 1962 CD GLN E 275 74.672 56.730 19.938 1.00 28.87 C ATOM 1963 OE1 GLN E 275 73.728 57.422 20.396 1.00 32.86 O ATOM 1964 NE2 GLN E 275 75.934 56.860 20.370 1.00 31.95 N ATOM 1965 N AHIS E 276 75.488 58.908 15.874 0.50 17.97 N ATOM 1966 N BHIS E 276 75.513 58.903 15.977 0.50 18.34 N ATOM 1967 CA AHIS E 276 75.990 59.444 14.605 0.50 17.77 C ATOM 1968 CA BHIS E 276 76.258 59.575 14.885 0.50 18.74 C ATOM 1969 C AHIS E 276 76.619 58.332 13.754 0.50 19.09 C ATOM 1970 C BHIS E 276 76.807 58.565 13.861 0.50 19.69 C ATOM 1971 O AHIS E 276 76.348 58.195 12.550 0.50 19.81 O ATOM 1972 O BHIS E 276 76.704 58.777 12.645 0.50 20.60 O ATOM 1973 CB AHIS E 276 76.964 60.583 14.845 0.50 17.31 C ATOM 1974 CB BHIS E 276 77.499 60.348 15.412 0.50 18.67 C ATOM 1975 CG AHIS E 276 76.285 61.862 15.191 0.50 16.28 C ATOM 1976 CG BHIS E 276 77.213 61.386 16.457 0.50 18.84 C ATOM 1977 ND1AHIS E 276 76.321 62.398 16.457 0.50 16.35 N ATOM 1978 ND1BHIS E 276 76.236 62.347 16.305 0.50 19.75 N ATOM 1979 CD2AHIS E 276 75.537 62.706 14.443 0.50 15.14 C ATOM 1980 CD2BHIS E 276 77.810 61.639 17.651 0.50 19.82 C ATOM 1981 CE1AHIS E 276 75.624 63.519 16.475 0.50 15.35 C ATOM 1982 CE1BHIS E 276 76.228 63.135 17.368 0.50 20.68 C ATOM 1983 NE2AHIS E 276 75.134 63.725 15.266 0.50 14.18 N ATOM 1984 NE2BHIS E 276 77.159 62.716 18.207 0.50 20.62 N ATOM 1985 N HIS E 277 77.430 57.513 14.393 1.00 19.28 N ATOM 1986 CA HIS E 277 78.111 56.440 13.655 1.00 21.24 C ATOM 1987 C HIS E 277 77.289 55.162 13.636 1.00 18.66 C ATOM 1988 O HIS E 277 76.747 54.735 14.648 1.00 20.30 O ATOM 1989 CB HIS E 277 79.501 56.249 14.262 1.00 23.65 C ATOM 1990 CG HIS E 277 80.307 57.518 14.169 1.00 32.43 C ATOM 1991 ND1 HIS E 277 80.847 58.152 15.272 1.00 39.28 N ATOM 1992 CD2 HIS E 277 80.545 58.333 13.107 1.00 36.28 C ATOM 1993 CE1 HIS E 277 81.430 59.276 14.883 1.00 40.34 C ATOM 1994 NE2 HIS E 277 81.255 59.411 13.578 1.00 38.93 N ATOM 1995 N HIS E 278 77.130 54.596 12.457 1.00 18.28 N ATOM 1996 CA HIS E 278 76.197 53.490 12.314 1.00 16.71 C ATOM 1997 C HIS E 278 76.894 52.207 11.953 1.00 16.09 C ATOM 1998 O HIS E 278 77.734 52.191 11.053 1.00 16.83 O ATOM 1999 CB HIS E 278 75.188 53.823 11.210 1.00 16.64 C ATOM 2000 CG HIS E 278 74.346 55.030 11.530 1.00 15.41 C ATOM 2001 ND1 HIS E 278 74.014 55.981 10.592 1.00 19.26 N ATOM 2002 CD2 HIS E 278 73.779 55.431 12.698 1.00 16.13 C ATOM 2003 CE1 HIS E 278 73.290 56.932 11.172 1.00 17.38 C ATOM 2004 NE2 HIS E 278 73.097 56.597 12.439 1.00 18.55 N ATOM 2005 N HIS E 279 76.555 51.134 12.644 1.00 15.79 N ATOM 2006 CA HIS E 279 76.936 49.785 12.189 1.00 16.33 C ATOM 2007 C HIS E 279 75.956 48.782 12.739 1.00 15.53 C ATOM 2008 O HIS E 279 75.162 49.124 13.632 1.00 15.14 O ATOM 2009 CB HIS E 279 78.378 49.434 12.621 1.00 18.75 C ATOM 2010 CG HIS E 279 78.607 49.571 14.094 1.00 24.60 C ATOM 2011 ND1 HIS E 279 78.974 50.766 14.680 1.00 31.26 N ATOM 2012 CD2 HIS E 279 78.504 48.674 15.102 1.00 29.00 C ATOM 2013 CE1 HIS E 279 79.089 50.595 15.988 1.00 33.66 C ATOM 2014 NE2 HIS E 279 78.812 49.333 16.270 1.00 30.72 N ATOM 2015 N HIS E 280 75.965 47.584 12.170 1.00 14.96 N ATOM 2016 CA HIS E 280 75.067 46.513 12.600 1.00 15.41 C ATOM 2017 C HIS E 280 75.535 45.906 13.918 1.00 17.04 C ATOM 2018 O HIS E 280 76.722 45.805 14.189 1.00 15.05 O ATOM 2019 CB HIS E 280 75.007 45.439 11.522 1.00 14.27 C ATOM 2020 CG HIS E 280 74.420 45.935 10.236 1.00 14.74 C ATOM 2021 ND1 HIS E 280 73.068 46.172 10.087 1.00 13.68 N ATOM 2022 CD2 HIS E 280 74.994 46.235 9.043 1.00 13.85 C ATOM 2023 CE1 HIS E 280 72.831 46.592 8.851 1.00 12.40 C ATOM 2024 NE2 HIS E 280 73.983 46.625 8.191 1.00 12.83 N ATOM 2025 N HIS E 281 74.574 45.491 14.739 1.00 19.27 N ATOM 2026 CA HIS E 281 74.936 44.710 15.946 1.00 22.20 C ATOM 2027 C HIS E 281 74.470 43.300 15.816 1.00 22.48 C ATOM 2028 O HIS E 281 74.585 42.592 16.863 1.00 26.50 O ATOM 2029 CB HIS E 281 74.366 45.343 17.224 1.00 21.42 C ATOM 2030 CG HIS E 281 74.898 46.709 17.511 1.00 24.09 C ATOM 2031 ND1 HIS E 281 75.718 46.969 18.585 1.00 30.57 N ATOM 2032 CD2 HIS E 281 74.710 47.894 16.882 1.00 24.54 C ATOM 2033 CE1 HIS E 281 76.020 48.257 18.600 1.00 33.84 C ATOM 2034 NE2 HIS E 281 75.433 48.838 17.566 1.00 29.98 N ATOM 2035 OXT HIS E 281 74.006 42.847 14.751 1.00 22.34 O TER 2036 HIS E 281 ATOM 2037 C MET I 20 44.553 23.125 6.584 1.00 36.01 C ATOM 2038 O MET I 20 45.659 23.399 6.089 1.00 37.64 O ATOM 2039 N LYS I 21 43.453 23.016 5.846 1.00 34.74 N ATOM 2040 CA LYS I 21 43.298 23.772 4.591 1.00 31.98 C ATOM 2041 C LYS I 21 43.264 25.267 4.896 1.00 29.52 C ATOM 2042 O LYS I 21 42.400 25.708 5.655 1.00 29.88 O ATOM 2043 CB LYS I 21 42.006 23.372 3.863 1.00 32.63 C ATOM 2044 CG LYS I 21 41.963 23.943 2.436 1.00 32.15 C ATOM 2045 CD LYS I 21 41.259 23.067 1.450 1.00 33.11 C ATOM 2046 CE LYS I 21 41.527 23.569 0.040 1.00 32.21 C ATOM 2047 NZ LYS I 21 40.788 22.798 -1.008 1.00 38.30 N ATOM 2048 N THR I 22 44.184 26.029 4.309 1.00 27.37 N ATOM 2049 CA THR I 22 44.223 27.486 4.522 1.00 25.54 C ATOM 2050 C THR I 22 44.173 28.321 3.240 1.00 23.72 C ATOM 2051 O THR I 22 44.189 29.560 3.315 1.00 21.52 O ATOM 2052 CB THR I 22 45.484 27.919 5.287 1.00 25.94 C ATOM 2053 OG1 THR I 22 46.637 27.428 4.606 1.00 28.91 O ATOM 2054 CG2 THR I 22 45.561 27.286 6.677 1.00 28.91 C ATOM 2055 N GLU I 23 44.142 27.669 2.069 1.00 21.71 N ATOM 2056 CA GLU I 23 44.035 28.377 0.799 1.00 21.57 C ATOM 2057 C GLU I 23 43.108 27.590 -0.113 1.00 20.00 C ATOM 2058 O GLU I 23 43.107 26.327 -0.057 1.00 19.99 O ATOM 2059 CB GLU I 23 45.389 28.477 0.088 1.00 23.46 C ATOM 2060 CG GLU I 23 46.574 28.816 0.980 1.00 31.80 C ATOM 2061 CD GLU I 23 47.804 29.154 0.153 1.00 41.07 C ATOM 2062 OE1 GLU I 23 48.301 30.306 0.285 1.00 44.70 O ATOM 2063 OE2 GLU I 23 48.253 28.276 -0.639 1.00 44.18 O ATOM 2064 N TRP I 24 42.382 28.305 -0.965 1.00 17.63 N ATOM 2065 CA TRP I 24 41.415 27.659 -1.870 1.00 17.83 C ATOM 2066 C TRP I 24 41.596 28.112 -3.313 1.00 17.73 C ATOM 2067 O TRP I 24 40.719 28.771 -3.914 1.00 16.92 O ATOM 2068 CB TRP I 24 39.980 27.935 -1.401 1.00 17.31 C ATOM 2069 CG TRP I 24 39.621 27.313 -0.076 1.00 15.97 C ATOM 2070 CD1 TRP I 24 38.931 26.145 0.117 1.00 17.31 C ATOM 2071 CD2 TRP I 24 39.870 27.845 1.234 1.00 14.64 C ATOM 2072 NE1 TRP I 24 38.739 25.911 1.463 1.00 18.18 N ATOM 2073 CE2 TRP I 24 39.332 26.917 2.178 1.00 15.98 C ATOM 2074 CE3 TRP I 24 40.493 29.020 1.723 1.00 13.60 C ATOM 2075 CZ2 TRP I 24 39.418 27.107 3.560 1.00 17.68 C ATOM 2076 CZ3 TRP I 24 40.588 29.203 3.092 1.00 18.03 C ATOM 2077 CH2 TRP I 24 40.055 28.257 3.996 1.00 16.06 C ATOM 2078 N PRO I 25 42.738 27.750 -3.918 1.00 19.07 N ATOM 2079 CA PRO I 25 42.982 28.188 -5.308 1.00 18.84 C ATOM 2080 C PRO I 25 41.891 27.710 -6.289 1.00 18.72 C ATOM 2081 O PRO I 25 41.657 28.404 -7.271 1.00 19.33 O ATOM 2082 CB PRO I 25 44.335 27.559 -5.658 1.00 19.35 C ATOM 2083 CG PRO I 25 44.522 26.434 -4.645 1.00 19.53 C ATOM 2084 CD PRO I 25 43.851 26.943 -3.366 1.00 18.83 C ATOM 2085 N GLU I 26 41.229 26.595 -5.992 1.00 19.15 N ATOM 2086 CA GLU I 26 40.243 26.005 -6.893 1.00 20.57 C ATOM 2087 C GLU I 26 38.982 26.885 -6.926 1.00 20.64 C ATOM 2088 O GLU I 26 38.112 26.710 -7.795 1.00 20.83 O ATOM 2089 CB GLU I 26 39.932 24.573 -6.441 1.00 21.30 C ATOM 2090 CG GLU I 26 39.179 24.475 -5.128 1.00 23.41 C ATOM 2091 CD GLU I 26 40.047 24.505 -3.851 1.00 27.30 C ATOM 2092 OE1 GLU I 26 41.256 24.808 -3.897 1.00 25.18 O ATOM 2093 OE2 GLU I 26 39.492 24.193 -2.774 1.00 29.87 O ATOM 2094 N LEU I 27 38.885 27.867 -6.011 1.00 17.90 N ATOM 2095 CA LEU I 27 37.679 28.726 -5.983 1.00 16.59 C ATOM 2096 C LEU I 27 37.785 29.988 -6.878 1.00 16.41 C ATOM 2097 O LEU I 27 36.824 30.713 -7.076 1.00 16.65 O ATOM 2098 CB LEU I 27 37.336 29.144 -4.522 1.00 15.62 C ATOM 2099 CG LEU I 27 36.762 28.023 -3.664 1.00 16.69 C ATOM 2100 CD1 LEU I 27 36.566 28.555 -2.209 1.00 15.92 C ATOM 2101 CD2 LEU I 27 35.410 27.398 -4.176 1.00 17.65 C ATOM 2102 N VAL I 28 38.964 30.273 -7.404 1.00 15.67 N ATOM 2103 CA VAL I 28 39.086 31.435 -8.266 1.00 16.01 C ATOM 2104 C VAL I 28 38.190 31.190 -9.488 1.00 15.64 C ATOM 2105 O VAL I 28 38.209 30.100 -10.083 1.00 16.76 O ATOM 2106 CB VAL I 28 40.558 31.668 -8.693 1.00 16.65 C ATOM 2107 CG1 VAL I 28 40.651 32.821 -9.734 1.00 16.30 C ATOM 2108 CG2 VAL I 28 41.385 31.980 -7.447 1.00 16.05 C ATOM 2109 N GLY I 29 37.412 32.192 -9.842 1.00 17.08 N ATOM 2110 CA GLY I 29 36.541 32.077 -11.003 1.00 17.38 C ATOM 2111 C GLY I 29 35.156 31.549 -10.660 1.00 17.76 C ATOM 2112 O GLY I 29 34.246 31.641 -11.499 1.00 18.48 O ATOM 2113 N LYS I 30 34.978 31.019 -9.448 1.00 16.83 N ATOM 2114 CA LYS I 30 33.638 30.587 -8.973 1.00 16.39 C ATOM 2115 C LYS I 30 32.857 31.740 -8.414 1.00 15.52 C ATOM 2116 O LYS I 30 33.433 32.803 -8.137 1.00 14.76 O ATOM 2117 CB LYS I 30 33.739 29.478 -7.902 1.00 16.40 C ATOM 2118 CG LYS I 30 34.581 28.247 -8.336 1.00 22.77 C ATOM 2119 CD LYS I 30 33.910 27.404 -9.349 1.00 30.18 C ATOM 2120 CE LYS I 30 34.726 26.116 -9.630 1.00 35.35 C ATOM 2121 NZ LYS I 30 34.170 24.932 -8.889 1.00 39.86 N ATOM 2122 N SER I 31 31.546 31.552 -8.236 1.00 14.18 N ATOM 2123 CA SER I 31 30.715 32.593 -7.592 1.00 13.84 C ATOM 2124 C SER I 31 31.133 32.777 -6.151 1.00 14.85 C ATOM 2125 O SER I 31 31.640 31.845 -5.494 1.00 13.76 O ATOM 2126 CB SER I 31 29.218 32.213 -7.602 1.00 13.54 C ATOM 2127 OG SER I 31 28.986 30.999 -6.856 1.00 13.60 O ATOM 2128 N VAL I 32 30.872 33.974 -5.637 1.00 14.09 N ATOM 2129 CA VAL I 32 31.131 34.206 -4.208 1.00 13.88 C ATOM 2130 C VAL I 32 30.249 33.264 -3.334 1.00 13.68 C ATOM 2131 O VAL I 32 30.673 32.845 -2.254 1.00 12.98 O ATOM 2132 CB VAL I 32 30.895 35.716 -3.849 1.00 14.27 C ATOM 2133 CG1 VAL I 32 29.388 36.107 -4.005 1.00 14.82 C ATOM 2134 CG2 VAL I 32 31.431 36.045 -2.418 1.00 13.83 C ATOM 2135 N GLU I 33 29.053 32.903 -3.821 1.00 12.29 N ATOM 2136 CA GLU I 33 28.156 32.010 -3.069 1.00 12.84 C ATOM 2137 C GLU I 33 28.785 30.624 -2.918 1.00 13.35 C ATOM 2138 O GLU I 33 28.791 30.042 -1.818 1.00 13.19 O ATOM 2139 CB GLU I 33 26.795 31.882 -3.785 1.00 11.96 C ATOM 2140 CG GLU I 33 25.960 33.167 -3.751 1.00 12.61 C ATOM 2141 CD GLU I 33 26.273 34.193 -4.850 1.00 14.19 C ATOM 2142 OE1 GLU I 33 27.136 33.959 -5.747 1.00 13.79 O ATOM 2143 OE2 GLU I 33 25.591 35.252 -4.842 1.00 16.70 O ATOM 2144 N GLU I 34 29.308 30.087 -4.015 1.00 12.49 N ATOM 2145 CA GLU I 34 29.931 28.766 -3.901 1.00 13.39 C ATOM 2146 C GLU I 34 31.160 28.840 -3.011 1.00 13.65 C ATOM 2147 O GLU I 34 31.391 27.954 -2.195 1.00 12.90 O ATOM 2148 CB GLU I 34 30.364 28.276 -5.283 1.00 14.08 C ATOM 2149 CG GLU I 34 30.894 26.850 -5.212 1.00 17.25 C ATOM 2150 CD GLU I 34 31.171 26.204 -6.558 1.00 24.67 C ATOM 2151 OE1 GLU I 34 30.574 26.577 -7.605 1.00 22.28 O ATOM 2152 OE2 GLU I 34 31.998 25.265 -6.549 1.00 28.04 O ATOM 2153 N ALA I 35 31.956 29.899 -3.183 1.00 12.68 N ATOM 2154 CA ALA I 35 33.157 30.045 -2.330 1.00 12.74 C ATOM 2155 C ALA I 35 32.813 30.056 -0.835 1.00 13.16 C ATOM 2156 O ALA I 35 33.462 29.371 -0.037 1.00 13.36 O ATOM 2157 CB ALA I 35 33.946 31.336 -2.728 1.00 12.86 C ATOM 2158 N LYS I 36 31.785 30.810 -0.437 1.00 13.05 N ATOM 2159 CA LYS I 36 31.402 30.843 0.989 1.00 13.84 C ATOM 2160 C LYS I 36 31.005 29.436 1.442 1.00 13.65 C ATOM 2161 O LYS I 36 31.370 29.004 2.543 1.00 13.82 O ATOM 2162 CB LYS I 36 30.226 31.769 1.241 1.00 13.66 C ATOM 2163 CG LYS I 36 30.593 33.269 1.179 1.00 18.31 C ATOM 2164 CD LYS I 36 29.247 34.093 1.255 1.00 23.77 C ATOM 2165 CE LYS I 36 29.477 35.566 1.029 1.00 30.88 C ATOM 2166 NZ LYS I 36 28.258 36.394 1.434 1.00 34.49 N ATOM 2167 N LYS I 37 30.252 28.728 0.600 1.00 13.09 N ATOM 2168 CA LYS I 37 29.744 27.393 0.978 1.00 12.68 C ATOM 2169 C LYS I 37 30.923 26.442 1.225 1.00 14.22 C ATOM 2170 O LYS I 37 30.986 25.759 2.271 1.00 13.61 O ATOM 2171 CB LYS I 37 28.814 26.826 -0.090 1.00 13.40 C ATOM 2172 CG LYS I 37 28.232 25.486 0.371 1.00 16.13 C ATOM 2173 CD LYS I 37 27.347 24.968 -0.729 1.00 21.32 C ATOM 2174 CE LYS I 37 26.876 23.594 -0.401 1.00 29.55 C ATOM 2175 NZ LYS I 37 25.724 23.220 -1.318 1.00 34.83 N ATOM 2176 N VAL I 38 31.863 26.423 0.274 1.00 13.48 N ATOM 2177 CA VAL I 38 32.998 25.523 0.348 1.00 14.30 C ATOM 2178 C VAL I 38 33.882 25.877 1.538 1.00 14.41 C ATOM 2179 O VAL I 38 34.263 25.008 2.332 1.00 14.90 O ATOM 2180 CB VAL I 38 33.801 25.579 -0.979 1.00 14.41 C ATOM 2181 CG1 VAL I 38 35.151 24.854 -0.803 1.00 17.36 C ATOM 2182 CG2 VAL I 38 32.955 24.905 -2.095 1.00 15.41 C ATOM 2183 N ILE I 39 34.188 27.154 1.684 1.00 13.53 N ATOM 2184 CA ILE I 39 35.046 27.561 2.813 1.00 13.34 C ATOM 2185 C ILE I 39 34.428 27.202 4.174 1.00 13.06 C ATOM 2186 O ILE I 39 35.116 26.732 5.088 1.00 14.78 O ATOM 2187 CB ILE I 39 35.346 29.081 2.708 1.00 14.07 C ATOM 2188 CG1 ILE I 39 36.352 29.328 1.557 1.00 16.80 C ATOM 2189 CG2 ILE I 39 35.900 29.597 4.063 1.00 14.59 C ATOM 2190 CD1 ILE I 39 36.246 30.765 0.950 1.00 17.39 C ATOM 2191 N LEU I 40 33.115 27.383 4.312 1.00 13.23 N ATOM 2192 CA LEU I 40 32.432 27.046 5.572 1.00 13.16 C ATOM 2193 C LEU I 40 32.345 25.534 5.814 1.00 13.98 C ATOM 2194 O LEU I 40 32.206 25.116 6.959 1.00 15.15 O ATOM 2195 CB LEU I 40 31.062 27.717 5.667 1.00 13.26 C ATOM 2196 CG LEU I 40 31.089 29.265 5.834 1.00 13.93 C ATOM 2197 CD1 LEU I 40 29.663 29.840 5.635 1.00 16.46 C ATOM 2198 CD2 LEU I 40 31.668 29.696 7.219 1.00 15.03 C ATOM 2199 N GLN I 41 32.474 24.721 4.760 1.00 13.29 N ATOM 2200 CA GLN I 41 32.568 23.257 4.957 1.00 13.39 C ATOM 2201 C GLN I 41 33.924 22.920 5.553 1.00 13.84 C ATOM 2202 O GLN I 41 34.041 22.072 6.466 1.00 14.82 O ATOM 2203 CB GLN I 41 32.372 22.523 3.631 1.00 12.93 C ATOM 2204 CG GLN I 41 30.943 22.585 3.186 1.00 14.16 C ATOM 2205 CD GLN I 41 30.663 21.776 1.929 1.00 17.95 C ATOM 2206 OE1 GLN I 41 29.480 21.493 1.633 1.00 16.84 O ATOM 2207 NE2 GLN I 41 31.708 21.473 1.134 1.00 17.64 N ATOM 2208 N ASP I 42 34.971 23.576 5.041 1.00 13.41 N ATOM 2209 CA ASP I 42 36.330 23.282 5.502 1.00 14.67 C ATOM 2210 C ASP I 42 36.644 23.952 6.829 1.00 14.65 C ATOM 2211 O ASP I 42 37.484 23.447 7.616 1.00 16.92 O ATOM 2212 CB ASP I 42 37.331 23.781 4.457 1.00 13.75 C ATOM 2213 CG ASP I 42 37.270 22.986 3.164 1.00 19.68 C ATOM 2214 OD1 ASP I 42 36.791 21.806 3.232 1.00 23.23 O ATOM 2215 OD2 ASP I 42 37.647 23.451 2.053 1.00 17.74 O ATOM 2216 N LYS I 43 36.027 25.101 7.080 1.00 14.13 N ATOM 2217 CA LYS I 43 36.361 25.932 8.219 1.00 15.45 C ATOM 2218 C LYS I 43 35.057 26.551 8.733 1.00 15.28 C ATOM 2219 O LYS I 43 34.736 27.694 8.401 1.00 15.82 O ATOM 2220 CB LYS I 43 37.352 27.031 7.740 1.00 16.25 C ATOM 2221 CG LYS I 43 37.931 27.890 8.867 1.00 17.77 C ATOM 2222 CD LYS I 43 38.963 28.901 8.266 1.00 21.30 C ATOM 2223 CE LYS I 43 39.293 30.032 9.258 1.00 20.29 C ATOM 2224 NZ LYS I 43 40.255 29.461 10.258 1.00 23.38 N ATOM 2225 N PRO I 44 34.222 25.774 9.424 1.00 15.03 N ATOM 2226 CA PRO I 44 32.876 26.227 9.777 1.00 15.83 C ATOM 2227 C PRO I 44 32.790 27.491 10.634 1.00 15.84 C ATOM 2228 O PRO I 44 31.741 28.132 10.592 1.00 16.72 O ATOM 2229 CB PRO I 44 32.293 25.021 10.559 1.00 16.35 C ATOM 2230 CG PRO I 44 33.074 23.846 10.004 1.00 16.88 C ATOM 2231 CD PRO I 44 34.485 24.379 9.829 1.00 14.72 C ATOM 2232 N ALA I 45 33.849 27.833 11.365 1.00 17.51 N ATOM 2233 CA ALA I 45 33.853 29.006 12.228 1.00 19.18 C ATOM 2234 C ALA I 45 34.475 30.218 11.507 1.00 19.03 C ATOM 2235 O ALA I 45 34.703 31.262 12.137 1.00 19.00 O ATOM 2236 CB ALA I 45 34.638 28.694 13.551 1.00 19.47 C ATOM 2237 N ALA I 46 34.753 30.087 10.203 1.00 19.12 N ATOM 2238 CA ALA I 46 35.389 31.197 9.447 1.00 18.26 C ATOM 2239 C ALA I 46 34.554 32.468 9.497 1.00 18.90 C ATOM 2240 O ALA I 46 33.315 32.416 9.397 1.00 17.88 O ATOM 2241 CB ALA I 46 35.630 30.804 7.996 1.00 18.25 C ATOM 2242 N GLN I 47 35.250 33.606 9.629 1.00 18.23 N ATOM 2243 CA GLN I 47 34.649 34.918 9.538 1.00 19.29 C ATOM 2244 C GLN I 47 34.924 35.399 8.148 1.00 18.45 C ATOM 2245 O GLN I 47 36.060 35.766 7.812 1.00 18.52 O ATOM 2246 CB GLN I 47 35.268 35.850 10.588 1.00 19.89 C ATOM 2247 CG GLN I 47 35.002 35.377 12.037 1.00 25.15 C ATOM 2248 CD GLN I 47 33.518 35.120 12.291 1.00 36.28 C ATOM 2249 OE1 GLN I 47 32.735 36.072 12.416 1.00 40.04 O ATOM 2250 NE2 GLN I 47 33.121 33.838 12.355 1.00 39.09 N ATOM 2251 N ILE I 48 33.911 35.282 7.288 1.00 17.91 N ATOM 2252 CA ILE I 48 34.135 35.596 5.886 1.00 17.13 C ATOM 2253 C ILE I 48 33.760 37.026 5.590 1.00 18.23 C ATOM 2254 O ILE I 48 32.670 37.470 5.962 1.00 19.53 O ATOM 2255 CB ILE I 48 33.326 34.627 4.967 1.00 17.43 C ATOM 2256 CG1 ILE I 48 33.883 33.211 5.146 1.00 18.00 C ATOM 2257 CG2 ILE I 48 33.383 35.108 3.512 1.00 16.99 C ATOM 2258 CD1 ILE I 48 33.064 32.112 4.442 1.00 19.56 C ATOM 2259 N ILE I 49 34.666 37.767 4.953 1.00 17.12 N ATOM 2260 CA ILE I 49 34.323 39.121 4.528 1.00 17.56 C ATOM 2261 C ILE I 49 34.544 39.282 3.047 1.00 15.71 C ATOM 2262 O ILE I 49 35.603 38.955 2.539 1.00 16.72 O ATOM 2263 CB ILE I 49 35.125 40.203 5.339 1.00 18.13 C ATOM 2264 CG1AILE I 49 34.813 41.622 4.860 0.50 20.40 C ATOM 2265 CG1BILE I 49 35.200 39.811 6.822 0.50 17.53 C ATOM 2266 CG2AILE I 49 36.588 39.957 5.244 0.50 16.68 C ATOM 2267 CG2BILE I 49 34.432 41.559 5.171 0.50 19.96 C ATOM 2268 CD1AILE I 49 34.611 42.573 6.018 0.50 23.91 C ATOM 2269 CD1BILE I 49 36.341 40.436 7.521 0.50 23.51 C ATOM 2270 N VAL I 50 33.546 39.798 2.360 1.00 15.66 N ATOM 2271 CA VAL I 50 33.617 39.989 0.934 1.00 16.98 C ATOM 2272 C VAL I 50 34.027 41.433 0.605 1.00 18.14 C ATOM 2273 O VAL I 50 33.418 42.389 1.102 1.00 19.10 O ATOM 2274 CB VAL I 50 32.257 39.642 0.276 1.00 17.06 C ATOM 2275 CG1 VAL I 50 32.293 39.895 -1.223 1.00 18.11 C ATOM 2276 CG2 VAL I 50 31.866 38.176 0.581 1.00 17.91 C ATOM 2277 N LEU I 51 35.071 41.564 -0.207 1.00 18.34 N ATOM 2278 CA LEU I 51 35.638 42.871 -0.532 1.00 17.91 C ATOM 2279 C LEU I 51 35.871 42.944 -2.040 1.00 17.59 C ATOM 2280 O LEU I 51 36.029 41.936 -2.719 1.00 16.41 O ATOM 2281 CB LEU I 51 36.986 43.046 0.206 1.00 17.71 C ATOM 2282 CG LEU I 51 36.976 42.916 1.733 1.00 18.48 C ATOM 2283 CD1 LEU I 51 38.414 42.856 2.337 1.00 19.29 C ATOM 2284 CD2 LEU I 51 36.108 44.083 2.366 1.00 21.14 C ATOM 2285 N PRO I 52 35.893 44.139 -2.607 1.00 18.56 N ATOM 2286 CA PRO I 52 36.162 44.254 -4.048 1.00 18.41 C ATOM 2287 C PRO I 52 37.628 43.964 -4.329 1.00 18.91 C ATOM 2288 O PRO I 52 38.463 44.448 -3.575 1.00 18.69 O ATOM 2289 CB PRO I 52 35.829 45.749 -4.358 1.00 19.53 C ATOM 2290 CG PRO I 52 35.156 46.269 -3.111 1.00 18.40 C ATOM 2291 CD PRO I 52 35.673 45.443 -1.932 1.00 19.36 C ATOM 2292 N VAL I 53 37.944 43.181 -5.363 1.00 18.95 N ATOM 2293 CA VAL I 53 39.329 42.954 -5.744 1.00 19.91 C ATOM 2294 C VAL I 53 39.922 44.331 -6.154 1.00 20.26 C ATOM 2295 O VAL I 53 39.184 45.202 -6.594 1.00 21.44 O ATOM 2296 CB VAL I 53 39.416 41.977 -6.930 1.00 21.02 C ATOM 2297 CG1 VAL I 53 38.865 42.615 -8.255 1.00 19.63 C ATOM 2298 CG2 VAL I 53 40.841 41.412 -7.119 1.00 19.31 C ATOM 2299 N GLY I 54 41.214 44.531 -5.956 1.00 21.43 N ATOM 2300 CA GLY I 54 41.798 45.825 -6.291 1.00 20.89 C ATOM 2301 C GLY I 54 41.606 46.890 -5.209 1.00 22.20 C ATOM 2302 O GLY I 54 41.798 48.091 -5.473 1.00 23.07 O ATOM 2303 N THR I 55 41.216 46.490 -4.003 1.00 20.30 N ATOM 2304 CA THR I 55 41.214 47.480 -2.908 1.00 19.37 C ATOM 2305 C THR I 55 42.459 47.250 -2.068 1.00 19.06 C ATOM 2306 O THR I 55 43.142 46.254 -2.188 1.00 17.53 O ATOM 2307 CB THR I 55 39.998 47.354 -2.002 1.00 19.53 C ATOM 2308 OG1 THR I 55 39.771 45.977 -1.646 1.00 20.01 O ATOM 2309 CG2 THR I 55 38.725 47.801 -2.751 1.00 18.65 C ATOM 2310 N ILE I 56 42.725 48.184 -1.175 1.00 17.13 N ATOM 2311 CA ILE I 56 43.871 48.037 -0.269 1.00 17.91 C ATOM 2312 C ILE I 56 43.253 47.681 1.090 1.00 16.35 C ATOM 2313 O ILE I 56 42.166 48.197 1.410 1.00 15.71 O ATOM 2314 CB ILE I 56 44.614 49.394 -0.255 1.00 18.86 C ATOM 2315 CG1 ILE I 56 45.590 49.426 -1.452 1.00 23.07 C ATOM 2316 CG2 ILE I 56 45.383 49.625 1.102 1.00 20.35 C ATOM 2317 CD1 ILE I 56 46.205 50.781 -1.735 1.00 29.59 C ATOM 2318 N VAL I 57 43.917 46.811 1.871 1.00 15.39 N ATOM 2319 CA VAL I 57 43.323 46.355 3.127 1.00 15.20 C ATOM 2320 C VAL I 57 44.342 46.355 4.267 1.00 14.65 C ATOM 2321 O VAL I 57 45.549 46.366 4.027 1.00 14.21 O ATOM 2322 CB VAL I 57 42.697 44.895 3.006 1.00 15.09 C ATOM 2323 CG1 VAL I 57 41.616 44.861 1.864 1.00 16.00 C ATOM 2324 CG2 VAL I 57 43.772 43.849 2.644 1.00 13.35 C ATOM 2325 N THR I 58 43.831 46.274 5.482 1.00 15.29 N ATOM 2326 CA THR I 58 44.681 46.186 6.678 1.00 14.17 C ATOM 2327 C THR I 58 45.527 44.947 6.656 1.00 15.66 C ATOM 2328 O THR I 58 45.106 43.878 6.125 1.00 14.80 O ATOM 2329 CB THR I 58 43.794 46.136 7.949 1.00 15.03 C ATOM 2330 OG1 THR I 58 42.870 45.023 7.862 1.00 16.46 O ATOM 2331 CG2 THR I 58 42.983 47.413 8.089 1.00 14.53 C ATOM 2332 N MET I 59 46.731 45.053 7.221 1.00 13.81 N ATOM 2333 CA MET I 59 47.664 43.933 7.210 1.00 14.90 C ATOM 2334 C MET I 59 47.871 43.297 8.604 1.00 13.80 C ATOM 2335 O MET I 59 48.986 42.914 8.980 1.00 13.45 O ATOM 2336 CB MET I 59 48.999 44.357 6.570 1.00 15.56 C ATOM 2337 CG MET I 59 48.814 44.630 5.095 1.00 17.33 C ATOM 2338 SD MET I 59 48.635 43.020 4.239 1.00 26.10 S ATOM 2339 CE MET I 59 47.264 43.367 3.416 1.00 23.15 C ATOM 2340 N GLU I 60 46.786 43.166 9.365 1.00 14.02 N ATOM 2341 CA GLU I 60 46.834 42.321 10.564 1.00 15.34 C ATOM 2342 C GLU I 60 46.461 40.883 10.171 1.00 15.37 C ATOM 2343 O GLU I 60 45.819 40.672 9.134 1.00 15.77 O ATOM 2344 CB GLU I 60 45.944 42.887 11.696 1.00 15.31 C ATOM 2345 CG GLU I 60 44.453 42.448 11.699 1.00 15.17 C ATOM 2346 CD GLU I 60 43.569 43.027 10.593 1.00 15.31 C ATOM 2347 OE1 GLU I 60 44.036 43.321 9.466 1.00 15.97 O ATOM 2348 OE2 GLU I 60 42.333 43.137 10.841 1.00 18.46 O ATOM 2349 N ALA I 61 46.906 39.926 10.970 1.00 15.04 N ATOM 2350 CA ALA I 61 46.737 38.501 10.678 1.00 16.46 C ATOM 2351 C ALA I 61 45.671 37.998 11.600 1.00 17.16 C ATOM 2352 O ALA I 61 45.801 38.088 12.836 1.00 17.42 O ATOM 2353 CB ALA I 61 48.055 37.756 10.903 1.00 18.37 C ATOM 2354 N ARG I 62 44.599 37.472 11.006 1.00 16.05 N ATOM 2355 CA ARG I 62 43.469 36.950 11.780 1.00 18.29 C ATOM 2356 C ARG I 62 43.263 35.503 11.322 1.00 19.78 C ATOM 2357 O ARG I 62 42.836 35.263 10.172 1.00 19.09 O ATOM 2358 CB ARG I 62 42.235 37.771 11.506 1.00 19.07 C ATOM 2359 CG AARG I 62 42.275 39.118 12.185 0.50 20.36 C ATOM 2360 CG BARG I 62 42.160 39.086 12.349 0.50 19.48 C ATOM 2361 CD AARG I 62 41.750 39.058 13.580 0.50 21.47 C ATOM 2362 CD BARG I 62 40.886 39.905 12.091 0.50 19.60 C ATOM 2363 NE AARG I 62 40.461 38.365 13.678 0.50 26.93 N ATOM 2364 NE BARG I 62 40.857 41.242 12.697 0.50 23.06 N ATOM 2365 CZ AARG I 62 39.295 38.904 13.371 0.50 26.82 C ATOM 2366 CZ BARG I 62 40.311 41.527 13.874 0.50 23.56 C ATOM 2367 NH1AARG I 62 39.219 40.139 12.892 0.50 28.80 N ATOM 2368 NH1BARG I 62 39.761 40.556 14.600 0.50 23.76 N ATOM 2369 NH2AARG I 62 38.193 38.199 13.544 0.50 28.04 N ATOM 2370 NH2BARG I 62 40.326 42.782 14.341 0.50 23.84 N ATOM 2371 N ILE I 63 43.556 34.545 12.186 1.00 19.79 N ATOM 2372 CA ILE I 63 43.474 33.168 11.703 1.00 22.06 C ATOM 2373 C ILE I 63 42.028 32.678 11.574 1.00 20.68 C ATOM 2374 O ILE I 63 41.805 31.617 11.016 1.00 22.66 O ATOM 2375 CB ILE I 63 44.297 32.189 12.554 1.00 23.85 C ATOM 2376 CG1 ILE I 63 43.866 32.272 14.000 1.00 25.83 C ATOM 2377 CG2 ILE I 63 45.833 32.377 12.255 1.00 26.77 C ATOM 2378 CD1 ILE I 63 44.511 31.168 14.861 1.00 33.49 C ATOM 2379 N ASP I 64 41.079 33.443 12.066 1.00 21.04 N ATOM 2380 CA ASP I 64 39.680 33.068 11.945 1.00 22.28 C ATOM 2381 C ASP I 64 39.083 33.638 10.650 1.00 20.61 C ATOM 2382 O ASP I 64 37.937 33.332 10.324 1.00 21.61 O ATOM 2383 CB ASP I 64 38.883 33.637 13.107 1.00 23.22 C ATOM 2384 CG AASP I 64 39.074 35.129 13.251 0.67 26.33 C ATOM 2385 CG BASP I 64 39.185 32.977 14.410 0.33 23.30 C ATOM 2386 OD1AASP I 64 40.240 35.579 13.412 0.67 28.26 O ATOM 2387 OD1BASP I 64 39.110 31.734 14.490 0.33 25.77 O ATOM 2388 OD2AASP I 64 38.124 35.917 13.167 0.67 31.20 O ATOM 2389 OD2BASP I 64 39.477 33.637 15.425 0.33 25.68 O ATOM 2390 N ARG I 65 39.825 34.507 9.944 1.00 18.34 N ATOM 2391 CA ARG I 65 39.203 35.310 8.870 1.00 17.26 C ATOM 2392 C ARG I 65 39.530 34.730 7.505 1.00 16.38 C ATOM 2393 O ARG I 65 40.643 34.300 7.264 1.00 16.26 O ATOM 2394 CB ARG I 65 39.715 36.767 8.899 1.00 16.50 C ATOM 2395 CG ARG I 65 39.115 37.675 7.785 1.00 14.86 C ATOM 2396 CD ARG I 65 39.530 39.143 8.016 1.00 15.35 C ATOM 2397 NE ARG I 65 41.002 39.260 8.043 1.00 12.44 N ATOM 2398 CZ ARG I 65 41.635 40.344 8.512 1.00 15.48 C ATOM 2399 NH1 ARG I 65 40.922 41.384 8.924 1.00 16.70 N ATOM 2400 NH2 ARG I 65 42.961 40.394 8.508 1.00 16.04 N ATOM 2401 N VAL I 66 38.552 34.752 6.592 1.00 16.60 N ATOM 2402 CA VAL I 66 38.885 34.560 5.187 1.00 16.24 C ATOM 2403 C VAL I 66 38.286 35.695 4.375 1.00 16.18 C ATOM 2404 O VAL I 66 37.071 35.853 4.316 1.00 15.91 O ATOM 2405 CB VAL I 66 38.346 33.199 4.632 1.00 16.99 C ATOM 2406 CG1 VAL I 66 38.737 33.059 3.182 1.00 16.22 C ATOM 2407 CG2 VAL I 66 38.871 32.004 5.458 1.00 15.70 C ATOM 2408 N ARG I 67 39.133 36.543 3.801 1.00 14.83 N ATOM 2409 CA ARG I 67 38.599 37.567 2.909 1.00 14.14 C ATOM 2410 C ARG I 67 38.358 36.948 1.528 1.00 14.13 C ATOM 2411 O ARG I 67 39.171 36.159 1.017 1.00 15.58 O ATOM 2412 CB ARG I 67 39.615 38.673 2.760 1.00 15.76 C ATOM 2413 CG ARG I 67 39.817 39.485 4.042 1.00 16.61 C ATOM 2414 CD ARG I 67 40.965 40.479 3.837 1.00 21.13 C ATOM 2415 NE ARG I 67 40.966 41.529 4.836 1.00 22.84 N ATOM 2416 CZ ARG I 67 42.096 42.081 5.326 1.00 23.15 C ATOM 2417 NH1 ARG I 67 43.299 41.640 4.960 1.00 26.23 N ATOM 2418 NH2 ARG I 67 41.999 43.052 6.188 1.00 23.76 N ATOM 2419 N LEU I 68 37.243 37.338 0.916 1.00 13.83 N ATOM 2420 CA LEU I 68 36.923 36.915 -0.458 1.00 13.95 C ATOM 2421 C LEU I 68 36.938 38.150 -1.337 1.00 14.84 C ATOM 2422 O LEU I 68 36.087 39.029 -1.165 1.00 16.14 O ATOM 2423 CB LEU I 68 35.503 36.265 -0.513 1.00 13.84 C ATOM 2424 CG LEU I 68 35.435 34.960 0.257 1.00 14.74 C ATOM 2425 CD1 LEU I 68 34.043 34.391 0.064 1.00 16.27 C ATOM 2426 CD2 LEU I 68 36.504 33.998 -0.298 1.00 15.84 C ATOM 2427 N PHE I 69 37.895 38.209 -2.256 1.00 14.18 N ATOM 2428 CA PHE I 69 38.001 39.354 -3.156 1.00 15.49 C ATOM 2429 C PHE I 69 37.276 39.019 -4.446 1.00 15.03 C ATOM 2430 O PHE I 69 37.654 38.055 -5.139 1.00 16.68 O ATOM 2431 CB PHE I 69 39.465 39.676 -3.436 1.00 15.38 C ATOM 2432 CG PHE I 69 40.168 40.282 -2.249 1.00 14.47 C ATOM 2433 CD1 PHE I 69 40.007 41.634 -1.967 1.00 16.76 C ATOM 2434 CD2 PHE I 69 40.934 39.488 -1.377 1.00 15.41 C ATOM 2435 CE1 PHE I 69 40.653 42.239 -0.849 1.00 16.27 C ATOM 2436 CE2 PHE I 69 41.586 40.101 -0.227 1.00 14.87 C ATOM 2437 CZ PHE I 69 41.404 41.439 0.028 1.00 15.32 C ATOM 2438 N VAL I 70 36.275 39.845 -4.754 1.00 15.34 N ATOM 2439 CA VAL I 70 35.403 39.582 -5.896 1.00 17.02 C ATOM 2440 C VAL I 70 35.539 40.619 -6.986 1.00 18.00 C ATOM 2441 O VAL I 70 35.828 41.786 -6.713 1.00 18.55 O ATOM 2442 CB VAL I 70 33.915 39.477 -5.516 1.00 16.99 C ATOM 2443 CG1 VAL I 70 33.686 38.222 -4.586 1.00 16.82 C ATOM 2444 CG2 VAL I 70 33.431 40.719 -4.815 1.00 16.95 C ATOM 2445 N ASP I 71 35.344 40.176 -8.216 1.00 18.10 N ATOM 2446 CA ASP I 71 35.281 41.117 -9.321 1.00 19.58 C ATOM 2447 C ASP I 71 33.887 41.769 -9.384 1.00 20.09 C ATOM 2448 O ASP I 71 33.043 41.559 -8.476 1.00 19.69 O ATOM 2449 CB ASP I 71 35.773 40.427 -10.599 1.00 19.06 C ATOM 2450 CG ASP I 71 34.805 39.346 -11.105 1.00 21.67 C ATOM 2451 OD1 ASP I 71 33.625 39.304 -10.665 1.00 19.17 O ATOM 2452 OD2 ASP I 71 35.167 38.487 -11.911 1.00 25.26 O ATOM 2453 N ARG I 72 33.641 42.616 -10.400 1.00 21.43 N ATOM 2454 CA ARG I 72 32.392 43.383 -10.441 1.00 23.22 C ATOM 2455 C ARG I 72 31.162 42.471 -10.714 1.00 22.54 C ATOM 2456 O ARG I 72 30.027 42.935 -10.597 1.00 23.09 O ATOM 2457 CB ARG I 72 32.462 44.514 -11.494 1.00 24.85 C ATOM 2458 CG ARG I 72 32.338 43.993 -12.917 1.00 31.82 C ATOM 2459 CD ARG I 72 32.967 44.830 -14.067 1.00 42.24 C ATOM 2460 NE ARG I 72 33.260 43.943 -15.209 1.00 48.38 N ATOM 2461 CZ ARG I 72 32.348 43.459 -16.077 1.00 50.55 C ATOM 2462 NH1 ARG I 72 31.054 43.797 -15.980 1.00 50.64 N ATOM 2463 NH2 ARG I 72 32.740 42.645 -17.061 1.00 49.87 N ATOM 2464 N LEU I 73 31.414 41.211 -11.081 1.00 20.94 N ATOM 2465 CA LEU I 73 30.336 40.227 -11.365 1.00 20.87 C ATOM 2466 C LEU I 73 30.062 39.323 -10.159 1.00 19.66 C ATOM 2467 O LEU I 73 29.222 38.428 -10.249 1.00 18.95 O ATOM 2468 CB LEU I 73 30.711 39.350 -12.567 1.00 20.47 C ATOM 2469 CG LEU I 73 31.036 40.036 -13.921 1.00 23.54 C ATOM 2470 CD1 LEU I 73 31.415 39.034 -14.994 1.00 22.02 C ATOM 2471 CD2 LEU I 73 29.862 40.898 -14.367 1.00 25.11 C ATOM 2472 N ASP I 74 30.764 39.573 -9.043 1.00 18.66 N ATOM 2473 CA ASP I 74 30.678 38.767 -7.813 1.00 17.95 C ATOM 2474 C ASP I 74 31.267 37.361 -7.949 1.00 16.12 C ATOM 2475 O ASP I 74 30.761 36.420 -7.289 1.00 14.61 O ATOM 2476 CB ASP I 74 29.231 38.669 -7.271 1.00 16.98 C ATOM 2477 CG ASP I 74 29.043 39.401 -5.970 1.00 22.04 C ATOM 2478 OD1 ASP I 74 29.984 40.105 -5.495 1.00 23.59 O ATOM 2479 OD2 ASP I 74 27.959 39.377 -5.345 1.00 20.00 O ATOM 2480 N ASN I 75 32.267 37.200 -8.819 1.00 15.70 N ATOM 2481 CA ASN I 75 33.035 35.968 -8.896 1.00 15.52 C ATOM 2482 C ASN I 75 34.381 36.185 -8.183 1.00 15.41 C ATOM 2483 O ASN I 75 34.878 37.320 -8.118 1.00 16.01 O ATOM 2484 CB ASN I 75 33.268 35.594 -10.341 1.00 14.97 C ATOM 2485 CG ASN I 75 31.962 35.271 -11.069 1.00 15.67 C ATOM 2486 OD1 ASN I 75 31.038 34.703 -10.469 1.00 14.73 O ATOM 2487 ND2 ASN I 75 31.860 35.694 -12.341 1.00 15.66 N ATOM 2488 N ILE I 76 34.933 35.115 -7.628 1.00 14.71 N ATOM 2489 CA ILE I 76 36.189 35.240 -6.882 1.00 14.94 C ATOM 2490 C ILE I 76 37.323 35.573 -7.850 1.00 15.13 C ATOM 2491 O ILE I 76 37.510 34.892 -8.873 1.00 16.44 O ATOM 2492 CB ILE I 76 36.494 33.875 -6.171 1.00 14.51 C ATOM 2493 CG1 ILE I 76 35.377 33.533 -5.144 1.00 12.49 C ATOM 2494 CG2 ILE I 76 37.890 33.894 -5.500 1.00 13.22 C ATOM 2495 CD1 ILE I 76 35.143 34.615 -4.085 1.00 15.54 C ATOM 2496 N ALA I 77 38.111 36.590 -7.510 1.00 14.86 N ATOM 2497 CA ALA I 77 39.136 37.108 -8.417 1.00 16.63 C ATOM 2498 C ALA I 77 40.564 36.913 -7.909 1.00 19.17 C ATOM 2499 O ALA I 77 41.507 37.303 -8.605 1.00 21.94 O ATOM 2500 CB ALA I 77 38.921 38.595 -8.641 1.00 16.68 C ATOM 2501 N GLN I 78 40.716 36.364 -6.710 1.00 18.31 N ATOM 2502 CA GLN I 78 42.036 36.173 -6.077 1.00 19.34 C ATOM 2503 C GLN I 78 41.890 34.919 -5.186 1.00 18.40 C ATOM 2504 O GLN I 78 40.791 34.673 -4.647 1.00 17.36 O ATOM 2505 CB GLN I 78 42.292 37.427 -5.236 1.00 20.94 C ATOM 2506 CG GLN I 78 43.575 37.512 -4.434 1.00 26.96 C ATOM 2507 CD GLN I 78 43.713 38.906 -3.796 1.00 31.92 C ATOM 2508 OE1 GLN I 78 43.534 39.920 -4.493 1.00 31.17 O ATOM 2509 NE2 GLN I 78 43.997 38.958 -2.486 1.00 27.68 N ATOM 2510 N VAL I 79 42.976 34.170 -5.009 1.00 17.69 N ATOM 2511 CA VAL I 79 42.930 32.919 -4.232 1.00 16.97 C ATOM 2512 C VAL I 79 42.526 33.232 -2.791 1.00 16.23 C ATOM 2513 O VAL I 79 43.233 34.015 -2.102 1.00 16.58 O ATOM 2514 CB VAL I 79 44.307 32.226 -4.202 1.00 17.49 C ATOM 2515 CG1 VAL I 79 44.248 30.986 -3.336 1.00 17.36 C ATOM 2516 CG2 VAL I 79 44.750 31.825 -5.638 1.00 17.67 C ATOM 2517 N PRO I 80 41.397 32.699 -2.312 1.00 14.72 N ATOM 2518 CA PRO I 80 41.046 32.891 -0.893 1.00 14.69 C ATOM 2519 C PRO I 80 42.062 32.206 0.002 1.00 15.26 C ATOM 2520 O PRO I 80 42.499 31.081 -0.263 1.00 15.73 O ATOM 2521 CB PRO I 80 39.676 32.190 -0.757 1.00 14.71 C ATOM 2522 CG PRO I 80 39.113 32.251 -2.200 1.00 14.43 C ATOM 2523 CD PRO I 80 40.329 31.983 -3.058 1.00 14.33 C ATOM 2524 N ARG I 81 42.420 32.897 1.076 1.00 15.17 N ATOM 2525 CA ARG I 81 43.346 32.334 2.056 1.00 15.84 C ATOM 2526 C ARG I 81 42.935 32.794 3.421 1.00 16.49 C ATOM 2527 O ARG I 81 42.391 33.892 3.594 1.00 16.04 O ATOM 2528 CB ARG I 81 44.785 32.828 1.783 1.00 18.62 C ATOM 2529 CG ARG I 81 45.354 32.403 0.431 1.00 24.87 C ATOM 2530 CD ARG I 81 46.582 33.257 -0.011 1.00 35.76 C ATOM 2531 NE ARG I 81 47.791 32.857 0.709 1.00 42.39 N ATOM 2532 CZ ARG I 81 48.224 33.431 1.845 1.00 46.84 C ATOM 2533 NH1 ARG I 81 47.549 34.455 2.394 1.00 47.31 N ATOM 2534 NH2 ARG I 81 49.330 32.978 2.431 1.00 45.47 N ATOM 2535 N VAL I 82 43.210 31.971 4.424 1.00 15.67 N ATOM 2536 CA VAL I 82 43.031 32.411 5.810 1.00 16.71 C ATOM 2537 C VAL I 82 44.019 33.558 6.144 1.00 16.78 C ATOM 2538 O VAL I 82 45.195 33.515 5.724 1.00 16.51 O ATOM 2539 CB VAL I 82 43.315 31.195 6.743 1.00 17.09 C ATOM 2540 CG1 VAL I 82 43.330 31.588 8.196 1.00 18.79 C ATOM 2541 CG2 VAL I 82 42.260 30.085 6.509 1.00 17.04 C ATOM 2542 N GLY I 83 43.564 34.535 6.911 1.00 16.63 N ATOM 2543 CA GLY I 83 44.443 35.605 7.360 1.00 16.28 C ATOM 2544 C GLY I 83 43.696 36.920 7.502 1.00 16.87 C ATOM 2545 O GLY I 83 44.189 37.822 8.209 1.00 15.70 O ATOM 2546 OXT GLY I 83 42.545 37.130 7.004 1.00 15.23 O TER 2547 GLY I 83 HETATM 2548 CA CA E 510 50.602 54.901 28.724 1.00 18.07 CA HETATM 2549 NA NA E 511 60.073 49.230 -0.513 1.00 18.15 NA HETATM 2550 C1 CIT E 512 74.110 68.305 9.157 1.00 21.73 C HETATM 2551 O1 CIT E 512 75.204 67.733 9.003 1.00 19.80 O HETATM 2552 O2 CIT E 512 73.518 68.808 8.153 1.00 22.47 O HETATM 2553 C2 CIT E 512 73.476 68.372 10.536 1.00 19.33 C HETATM 2554 C3 CIT E 512 74.148 67.589 11.696 1.00 23.91 C HETATM 2555 O7 CIT E 512 75.617 67.791 12.094 1.00 17.05 O HETATM 2556 C4 CIT E 512 72.989 67.416 12.740 1.00 20.03 C HETATM 2557 C5 CIT E 512 73.031 66.143 13.578 1.00 24.33 C HETATM 2558 O3 CIT E 512 74.100 65.511 13.657 1.00 23.71 O HETATM 2559 O4 CIT E 512 72.012 65.725 14.202 1.00 18.66 O HETATM 2560 C6 CIT E 512 74.453 66.312 11.165 1.00 25.78 C HETATM 2561 O5 CIT E 512 75.731 65.990 11.213 1.00 17.87 O HETATM 2562 O6 CIT E 512 73.419 65.759 10.711 1.00 20.20 O HETATM 2563 C1 CIT E 513 73.986 60.257 9.560 0.50 32.54 C HETATM 2564 O1 CIT E 513 74.890 59.489 10.055 0.50 29.76 O HETATM 2565 O2 CIT E 513 72.763 59.997 9.741 0.50 28.58 O HETATM 2566 C2 CIT E 513 74.355 61.504 8.761 0.50 31.10 C HETATM 2567 C3 CIT E 513 75.399 62.338 9.526 0.50 30.03 C HETATM 2568 O7 CIT E 513 75.622 61.685 10.824 0.50 30.37 O HETATM 2569 C4 CIT E 513 76.684 62.555 8.695 0.50 29.03 C HETATM 2570 C5 CIT E 513 77.651 63.519 9.366 0.50 28.48 C HETATM 2571 O3 CIT E 513 77.893 63.468 10.592 0.50 26.76 O HETATM 2572 O4 CIT E 513 78.238 64.390 8.693 0.50 28.76 O HETATM 2573 C6 CIT E 513 74.931 63.715 9.906 0.50 29.13 C HETATM 2574 O5 CIT E 513 74.651 63.891 11.128 0.50 25.37 O HETATM 2575 O6 CIT E 513 74.901 64.685 9.075 0.50 28.34 O HETATM 2576 OH3 1PE E 514 57.197 65.810 26.622 1.00 55.55 O HETATM 2577 C13 1PE E 514 59.110 65.872 28.070 1.00 50.22 C HETATM 2578 C23 1PE E 514 58.622 65.845 26.624 1.00 52.51 C HETATM 2579 OH4 1PE E 514 59.239 64.537 28.584 1.00 45.65 O HETATM 2580 C14 1PE E 514 61.319 63.464 29.069 1.00 32.33 C HETATM 2581 C24 1PE E 514 60.262 64.432 29.599 1.00 37.99 C HETATM 2582 OH5 1PE E 514 60.717 62.156 28.855 1.00 26.82 O HETATM 2583 C15 1PE E 514 61.091 59.826 28.536 1.00 23.64 C HETATM 2584 C25 1PE E 514 61.740 61.203 28.496 1.00 23.11 C HETATM 2585 OH6 1PE E 514 60.821 59.528 29.912 1.00 25.13 O HETATM 2586 C26 1PE E 514 60.860 58.117 30.056 1.00 24.64 C HETATM 2587 OH2 1PE E 515 61.737 69.100 4.115 1.00 49.39 O HETATM 2588 C12 1PE E 515 62.105 68.694 5.439 1.00 47.58 C HETATM 2589 C22 1PE E 515 60.914 68.093 6.199 1.00 43.20 C HETATM 2590 OH3 1PE E 515 60.012 67.453 5.291 1.00 39.30 O HETATM 2591 C13 1PE E 515 57.788 66.672 4.905 1.00 38.69 C HETATM 2592 C23 1PE E 515 58.800 67.117 5.938 1.00 38.58 C HETATM 2593 OH4 1PE E 515 57.069 67.792 4.422 1.00 38.26 O HETATM 2594 C14 1PE E 515 55.860 68.701 2.591 1.00 42.26 C HETATM 2595 C24 1PE E 515 56.214 67.435 3.344 1.00 40.43 C HETATM 2596 OH5 1PE E 515 57.011 69.220 1.929 1.00 44.26 O HETATM 2597 C15 1PE E 515 57.681 70.427 -0.046 1.00 51.41 C HETATM 2598 C25 1PE E 515 56.646 70.295 1.059 1.00 48.17 C HETATM 2599 OH6 1PE E 515 58.969 70.417 0.573 1.00 54.89 O HETATM 2600 C16 1PE E 515 61.329 70.601 0.398 1.00 57.60 C HETATM 2601 C26 1PE E 515 60.046 70.257 -0.354 1.00 55.56 C HETATM 2602 OH7 1PE E 515 61.559 69.637 1.435 1.00 57.33 O HETATM 2603 C12 1PE E 517 37.297 65.767 19.184 1.00 50.13 C HETATM 2604 C22 1PE E 517 38.240 65.226 18.103 1.00 50.96 C HETATM 2605 OH3 1PE E 517 39.630 65.399 18.446 1.00 51.29 O HETATM 2606 C13 1PE E 517 41.795 66.259 17.593 1.00 49.30 C HETATM 2607 C23 1PE E 517 40.473 65.558 17.304 1.00 49.00 C HETATM 2608 OH4 1PE E 517 41.759 67.644 17.278 1.00 53.80 O HETATM 2609 C14 1PE E 517 41.477 68.969 15.183 1.00 59.58 C HETATM 2610 C24 1PE E 517 42.318 67.971 16.001 1.00 56.80 C HETATM 2611 OH5 1PE E 517 41.396 68.545 13.808 1.00 60.85 O HETATM 2612 C15 1PE E 517 39.348 68.286 12.497 1.00 63.63 C HETATM 2613 C25 1PE E 517 40.420 69.244 13.024 1.00 62.46 C HETATM 2614 OH6 1PE E 517 39.728 67.696 11.246 1.00 64.25 O HETATM 2615 C26 1PE E 517 38.630 67.058 10.574 1.00 64.47 C HETATM 2616 C14 1PE I 516 49.372 34.645 14.135 1.00 59.92 C HETATM 2617 OH5 1PE I 516 48.114 34.444 13.474 1.00 58.77 O HETATM 2618 C15 1PE I 516 46.144 35.165 14.778 1.00 58.56 C HETATM 2619 C25 1PE I 516 47.152 35.499 13.674 1.00 57.82 C HETATM 2620 OH6 1PE I 516 44.797 35.558 14.489 1.00 57.37 O HETATM 2621 C16 1PE I 516 42.431 35.258 15.218 1.00 57.55 C HETATM 2622 C26 1PE I 516 43.914 35.296 15.593 1.00 58.02 C HETATM 2623 O HOH E 518 53.094 42.993 23.347 1.00 11.42 O HETATM 2624 O HOH E 519 50.269 47.847 16.089 1.00 10.80 O HETATM 2625 O HOH E 520 52.599 48.393 20.938 1.00 10.46 O HETATM 2626 O HOH E 521 55.033 44.270 21.824 1.00 12.71 O HETATM 2627 O HOH E 522 49.767 63.812 19.359 1.00 17.05 O HETATM 2628 O HOH E 523 61.435 64.159 22.237 1.00 13.64 O HETATM 2629 O HOH E 524 48.678 52.636 9.028 1.00 12.08 O HETATM 2630 O HOH E 525 66.871 46.074 18.469 1.00 14.44 O HETATM 2631 O HOH E 526 68.014 49.987 13.081 1.00 12.01 O HETATM 2632 O HOH E 527 60.921 63.273 7.556 1.00 16.07 O HETATM 2633 O HOH E 528 52.553 50.697 22.446 1.00 11.78 O HETATM 2634 O HOH E 529 49.499 59.811 21.485 1.00 13.58 O HETATM 2635 O HOH E 530 53.479 61.018 26.185 1.00 13.14 O HETATM 2636 O HOH E 531 66.721 50.005 25.332 1.00 17.85 O HETATM 2637 O HOH E 532 58.970 45.447 27.818 1.00 16.17 O HETATM 2638 O HOH E 533 71.656 46.398 15.895 1.00 14.01 O HETATM 2639 O HOH E 534 55.014 46.868 20.990 1.00 10.43 O HETATM 2640 O HOH E 535 51.593 61.694 21.635 1.00 14.75 O HETATM 2641 O HOH E 536 68.853 44.104 18.501 1.00 16.62 O HETATM 2642 O HOH E 537 61.068 53.811 28.322 1.00 16.06 O HETATM 2643 O HOH E 538 54.692 66.436 19.454 1.00 17.49 O HETATM 2644 O HOH E 539 43.009 53.024 30.035 1.00 15.08 O HETATM 2645 O HOH E 540 44.033 56.255 10.784 1.00 12.49 O HETATM 2646 O HOH E 541 56.421 46.969 31.514 1.00 17.10 O HETATM 2647 O HOH E 542 71.135 51.924 3.734 1.00 15.73 O HETATM 2648 O HOH E 543 60.487 55.917 2.868 1.00 16.12 O HETATM 2649 O HOH E 544 67.850 63.913 1.142 1.00 15.42 O HETATM 2650 O HOH E 545 69.888 67.406 14.141 1.00 20.54 O HETATM 2651 O HOH E 546 52.333 47.523 1.833 1.00 15.22 O HETATM 2652 O HOH E 547 54.259 42.659 25.875 1.00 19.40 O HETATM 2653 O HOH E 548 62.376 57.531 4.244 1.00 16.57 O HETATM 2654 O HOH E 549 61.495 48.164 1.117 1.00 17.87 O HETATM 2655 O HOH E 550 43.057 51.121 31.879 1.00 19.05 O HETATM 2656 O HOH E 551 64.843 60.313 0.491 1.00 21.68 O HETATM 2657 O HOH E 552 62.905 56.430 0.464 1.00 21.52 O HETATM 2658 O HOH E 553 71.292 56.618 20.442 1.00 18.31 O HETATM 2659 O HOH E 554 36.754 44.124 27.019 1.00 17.66 O HETATM 2660 O HOH E 555 74.771 55.629 8.022 1.00 20.96 O HETATM 2661 O HOH E 556 40.456 43.972 24.399 1.00 17.83 O HETATM 2662 O HOH E 557 70.834 42.097 4.741 1.00 21.96 O HETATM 2663 O HOH E 558 36.875 52.832 10.605 1.00 22.15 O HETATM 2664 O HOH E 559 66.290 54.376 32.539 1.00 19.25 O HETATM 2665 O HOH E 560 56.248 61.330 26.193 1.00 24.17 O HETATM 2666 O HOH E 561 70.398 57.296 28.732 1.00 16.95 O HETATM 2667 O HOH E 562 75.372 52.519 15.462 1.00 21.40 O HETATM 2668 O HOH E 563 68.899 39.793 8.205 1.00 20.92 O HETATM 2669 O HOH E 564 51.692 44.776 1.466 1.00 27.58 O HETATM 2670 O HOH E 565 49.542 67.140 -1.574 1.00 22.06 O HETATM 2671 O HOH E 566 68.463 56.146 2.420 1.00 19.74 O HETATM 2672 O HOH E 567 72.023 54.000 2.447 1.00 22.47 O HETATM 2673 O HOH E 568 63.318 65.178 5.185 1.00 15.40 O HETATM 2674 O HOH E 569 70.588 63.146 3.472 1.00 24.08 O HETATM 2675 O HOH E 570 59.416 53.919 -5.616 1.00 17.43 O HETATM 2676 O HOH E 571 55.518 61.518 -7.922 1.00 26.42 O HETATM 2677 O HOH E 572 73.558 39.763 13.548 1.00 27.77 O HETATM 2678 O HOH E 573 72.518 49.193 20.573 1.00 23.14 O HETATM 2679 O HOH E 574 38.460 55.156 23.890 1.00 20.77 O HETATM 2680 O HOH E 575 36.434 55.021 17.678 1.00 19.44 O HETATM 2681 O HOH E 576 64.124 58.227 1.996 1.00 19.65 O HETATM 2682 O HOH E 577 72.255 65.062 4.282 1.00 22.30 O HETATM 2683 O HOH E 578 68.113 53.485 1.751 1.00 22.19 O HETATM 2684 O HOH E 579 37.560 57.371 27.018 1.00 23.68 O HETATM 2685 O HOH E 580 53.183 47.569 34.766 1.00 27.10 O HETATM 2686 O HOH E 581 63.922 62.242 -1.122 1.00 24.95 O HETATM 2687 O HOH E 582 60.895 59.716 -4.464 1.00 22.73 O HETATM 2688 O HOH E 583 48.256 58.600 33.896 1.00 28.09 O HETATM 2689 O HOH E 584 67.860 41.525 19.198 1.00 25.24 O HETATM 2690 O HOH E 585 59.375 37.882 6.253 1.00 18.02 O HETATM 2691 O HOH E 586 46.801 53.186 36.618 1.00 30.34 O HETATM 2692 O HOH E 587 47.013 37.377 4.695 1.00 36.23 O HETATM 2693 O HOH E 588 50.748 61.871 -6.403 1.00 26.22 O HETATM 2694 O HOH E 589 61.123 63.780 25.415 1.00 21.88 O HETATM 2695 O HOH E 590 65.597 41.839 1.253 1.00 26.11 O HETATM 2696 O HOH E 591 74.182 42.333 12.472 1.00 24.27 O HETATM 2697 O HOH E 592 58.606 33.144 -1.488 1.00 22.19 O HETATM 2698 O HOH E 593 45.952 50.768 32.604 1.00 22.81 O HETATM 2699 O HOH E 594 55.334 44.095 29.116 1.00 29.94 O HETATM 2700 O HOH E 595 70.171 55.449 26.708 1.00 32.17 O HETATM 2701 O HOH E 596 66.348 43.460 21.502 1.00 28.20 O HETATM 2702 O HOH E 597 61.585 42.809 24.822 1.00 27.14 O HETATM 2703 O HOH E 598 71.985 65.972 8.207 1.00 34.90 O HETATM 2704 O HOH E 599 47.956 60.772 29.928 1.00 28.75 O HETATM 2705 O HOH E 600 56.264 37.151 20.337 1.00 23.33 O HETATM 2706 O HOH E 601 69.452 49.294 24.919 1.00 24.67 O HETATM 2707 O HOH E 602 66.371 56.997 1.188 1.00 28.39 O HETATM 2708 O HOH E 603 51.718 45.366 27.614 1.00 29.87 O HETATM 2709 O HOH E 604 57.310 68.715 9.018 1.00 27.00 O HETATM 2710 O HOH E 605 63.764 56.699 31.150 1.00 24.07 O HETATM 2711 O HOH E 606 40.415 48.418 29.198 1.00 21.65 O HETATM 2712 O HOH E 607 64.201 48.186 0.726 1.00 25.29 O HETATM 2713 O HOH E 608 47.537 54.795 -12.034 1.00 24.81 O HETATM 2714 O HOH E 609 67.244 50.909 27.831 1.00 30.91 O HETATM 2715 O HOH E 610 65.179 47.748 25.590 1.00 25.36 O HETATM 2716 O HOH E 611 40.488 54.171 -6.736 1.00 27.66 O HETATM 2717 O HOH E 612 56.385 57.584 -9.722 1.00 29.44 O HETATM 2718 O HOH E 613 62.947 66.111 21.381 1.00 25.10 O HETATM 2719 O HOH E 614 44.462 68.382 11.285 1.00 30.21 O HETATM 2720 O HOH E 615 45.331 53.926 -8.547 1.00 24.91 O HETATM 2721 O HOH E 616 48.611 37.137 19.970 1.00 48.13 O HETATM 2722 O HOH E 617 49.197 60.144 -7.698 1.00 24.13 O HETATM 2723 O HOH E 618 51.545 64.181 23.282 1.00 30.98 O HETATM 2724 O HOH E 619 44.852 45.293 -4.597 1.00 35.33 O HETATM 2725 O HOH E 620 36.165 52.596 29.667 1.00 35.71 O HETATM 2726 O HOH E 621 72.006 60.528 4.029 1.00 40.83 O HETATM 2727 O HOH E 622 43.084 62.724 21.415 1.00 26.36 O HETATM 2728 O HOH E 623 66.507 49.871 1.087 1.00 34.03 O HETATM 2729 O HOH E 624 71.720 55.085 24.741 1.00 33.71 O HETATM 2730 O HOH E 625 64.473 63.999 0.774 1.00 26.53 O HETATM 2731 O HOH E 626 33.346 49.427 5.418 1.00 24.14 O HETATM 2732 O HOH E 627 38.747 60.152 -0.958 1.00 25.55 O HETATM 2733 O HOH E 628 57.824 55.612 31.336 1.00 20.62 O HETATM 2734 O HOH E 629 54.121 56.404 -11.157 1.00 23.93 O HETATM 2735 O HOH E 630 74.179 54.627 3.947 1.00 18.29 O HETATM 2736 O HOH E 631 65.140 45.807 0.433 1.00 34.00 O HETATM 2737 O HOH E 632 78.313 68.483 12.360 1.00 32.20 O HETATM 2738 O HOH E 633 35.244 55.114 21.658 1.00 30.25 O HETATM 2739 O HOH E 634 40.769 50.744 -5.651 1.00 26.23 O HETATM 2740 O HOH E 635 33.186 47.375 30.700 1.00 32.84 O HETATM 2741 O HOH E 636 58.864 45.836 30.737 1.00 27.01 O HETATM 2742 O HOH E 637 38.421 44.588 22.910 1.00 26.90 O HETATM 2743 O HOH E 638 38.060 65.093 7.060 1.00 26.35 O HETATM 2744 O HOH E 639 73.967 51.266 20.170 1.00 34.48 O HETATM 2745 O HOH E 640 75.886 51.345 17.771 1.00 36.60 O HETATM 2746 O HOH E 641 50.094 34.116 4.814 1.00 32.02 O HETATM 2747 O HOH E 642 35.222 61.660 4.113 1.00 31.59 O HETATM 2748 O HOH E 643 43.877 64.947 -0.243 1.00 31.60 O HETATM 2749 O HOH E 644 67.992 52.903 28.999 1.00 26.75 O HETATM 2750 O HOH E 645 32.573 51.952 5.510 1.00 27.20 O HETATM 2751 O HOH E 646 49.600 66.470 20.096 1.00 28.91 O HETATM 2752 O HOH E 647 39.016 43.227 6.242 1.00 33.55 O HETATM 2753 O HOH E 648 45.090 61.276 28.185 1.00 30.15 O HETATM 2754 O HOH E 649 36.119 57.746 18.782 1.00 28.37 O HETATM 2755 O HOH E 650 37.527 47.866 21.039 1.00 33.14 O HETATM 2756 O HOH E 651 61.068 48.056 -2.332 1.00 21.67 O HETATM 2757 O HOH E 652 44.940 69.871 3.622 1.00 27.35 O HETATM 2758 O HOH E 653 33.570 58.255 10.401 1.00 37.12 O HETATM 2759 O HOH E 654 52.759 50.147 -9.825 1.00 26.26 O HETATM 2760 O HOH E 655 67.441 32.680 7.052 1.00 41.57 O HETATM 2761 O HOH E 656 69.714 69.106 7.105 1.00 40.01 O HETATM 2762 O HOH E 657 35.559 64.754 6.865 1.00 36.28 O HETATM 2763 O HOH E 658 35.632 50.527 3.125 1.00 26.03 O HETATM 2764 O HOH E 659 76.620 59.197 18.399 1.00 37.58 O HETATM 2765 O HOH E 660 61.795 67.269 16.704 1.00 39.94 O HETATM 2766 O HOH E 661 35.312 46.031 30.763 1.00 44.86 O HETATM 2767 O HOH E 662 50.219 42.540 1.103 1.00 30.40 O HETATM 2768 O HOH E 663 61.815 48.444 28.708 1.00 25.02 O HETATM 2769 O HOH E 664 46.219 37.920 19.162 1.00 32.93 O HETATM 2770 O HOH E 665 49.496 41.573 -1.257 1.00 34.25 O HETATM 2771 O HOH E 666 32.939 54.943 1.808 1.00 24.72 O HETATM 2772 O HOH E 667 56.125 60.212 -10.228 1.00 29.95 O HETATM 2773 O HOH E 668 36.198 62.427 23.732 1.00 34.24 O HETATM 2774 O HOH E 669 31.124 48.004 6.912 1.00 44.50 O HETATM 2775 O HOH E 670 49.009 40.062 2.632 1.00 32.28 O HETATM 2776 O HOH E 671 52.404 39.471 24.222 1.00 36.10 O HETATM 2777 O HOH E 672 55.022 54.184 -12.531 1.00 30.63 O HETATM 2778 O HOH E 673 67.255 43.927 2.482 1.00 39.54 O HETATM 2779 O HOH E 674 70.168 43.125 2.436 1.00 35.83 O HETATM 2780 O HOH E 675 39.161 43.859 18.519 1.00 33.60 O HETATM 2781 O HOH E 676 62.534 67.497 -0.184 1.00 39.08 O HETATM 2782 O HOH E 677 61.314 65.644 9.205 1.00 27.60 O HETATM 2783 O HOH E 678 51.143 69.267 -1.494 1.00 31.75 O HETATM 2784 O HOH E 679 61.882 40.619 23.408 1.00 31.44 O HETATM 2785 O HOH E 680 58.149 40.600 -8.249 1.00 36.87 O HETATM 2786 O HOH E 681 51.905 62.436 27.885 1.00 37.53 O HETATM 2787 O HOH E 682 56.463 28.571 -0.301 1.00 38.04 O HETATM 2788 O HOH E 683 59.983 58.593 -8.893 1.00 33.98 O HETATM 2789 O HOH E 684 63.531 65.738 7.884 1.00 31.19 O HETATM 2790 O HOH E 685 54.341 60.920 -12.102 1.00 34.01 O HETATM 2791 O HOH E 686 50.906 68.266 18.613 1.00 38.21 O HETATM 2792 O HOH E 687 61.024 47.318 31.012 1.00 30.49 O HETATM 2793 O HOH E 688 57.625 68.436 12.743 1.00 33.08 O HETATM 2794 O HOH E 689 51.593 31.990 5.461 1.00 34.43 O HETATM 2795 O HOH E 690 60.701 40.836 -6.906 1.00 37.21 O HETATM 2796 O HOH E 691 49.671 39.545 25.256 1.00 40.54 O HETATM 2797 O HOH E 692 59.957 42.771 27.458 1.00 42.18 O HETATM 2798 O HOH E 693 33.776 52.402 3.007 1.00 27.50 O HETATM 2799 O HOH E 694 63.986 43.548 25.121 1.00 38.40 O HETATM 2800 O HOH E 695 51.638 40.320 -2.176 1.00 30.22 O HETATM 2801 O HOH E 696 33.968 47.416 0.896 1.00 33.26 O HETATM 2802 O HOH E 697 54.775 40.081 26.286 1.00 38.84 O HETATM 2803 O HOH E 698 71.232 37.518 3.197 1.00 34.13 O HETATM 2804 O HOH E 699 36.912 50.224 28.868 1.00 27.34 O HETATM 2805 O HOH E 700 56.754 30.568 6.397 1.00 33.01 O HETATM 2806 O HOH E 701 51.525 66.503 22.246 1.00 42.13 O HETATM 2807 O HOH E 702 56.021 33.171 17.885 1.00 37.50 O HETATM 2808 O HOH E 703 35.204 63.276 17.186 1.00 41.11 O HETATM 2809 O HOH E 704 70.399 53.234 27.718 1.00 38.89 O HETATM 2810 O HOH E 705 46.432 60.600 -8.076 1.00 34.98 O HETATM 2811 O HOH E 706 62.173 66.919 11.790 1.00 31.70 O HETATM 2812 O HOH E 707 47.329 39.943 -0.901 1.00 43.20 O HETATM 2813 O HOH E 708 50.348 70.068 10.246 1.00 40.50 O HETATM 2814 O HOH E 709 52.952 58.303 -12.771 1.00 36.86 O HETATM 2815 O HOH E 710 49.668 60.490 -10.452 1.00 28.68 O HETATM 2816 O HOH E 711 55.491 34.303 20.265 1.00 48.51 O HETATM 2817 O HOH E 712 57.623 38.307 25.497 1.00 38.71 O HETATM 2818 O HOH E 713 47.572 69.760 9.952 1.00 41.80 O HETATM 2819 O HOH E 714 58.905 47.373 -6.896 1.00 34.42 O HETATM 2820 O HOH E 715 50.263 58.427 -12.069 1.00 30.30 O HETATM 2821 O HOH E 716 63.296 65.730 26.858 1.00 40.40 O HETATM 2822 O HOH E 717 48.707 51.978 -13.255 1.00 34.83 O HETATM 2823 O HOH E 718 72.685 42.500 18.937 1.00 34.39 O HETATM 2824 O HOH E 719 63.406 31.767 9.606 1.00 36.68 O HETATM 2825 O HOH E 720 53.955 51.807 -11.726 1.00 34.22 O HETATM 2826 O HOH E 721 61.134 67.828 14.134 1.00 39.49 O HETATM 2827 O HOH E 722 35.271 50.415 16.983 1.00 43.13 O HETATM 2828 O HOH E 723 51.942 33.222 -0.724 1.00 50.79 O HETATM 2829 O HOH E 724 66.512 34.405 13.716 1.00 37.54 O HETATM 2830 O HOH E 725 34.133 57.282 24.442 1.00 40.52 O HETATM 2831 O HOH E 726 48.409 70.150 13.959 1.00 37.21 O HETATM 2832 O HOH E 727 64.330 47.788 28.092 1.00 35.34 O HETATM 2833 O HOH E 728 45.026 62.462 25.799 1.00 40.14 O HETATM 2834 O HOH E 729 35.935 48.993 -0.155 1.00 40.66 O HETATM 2835 O HOH E 730 54.269 68.902 15.835 1.00 41.53 O HETATM 2836 O HOH E 731 55.177 40.784 -4.599 1.00 34.06 O HETATM 2837 O HOH E 732 47.713 48.965 36.573 1.00 37.51 O HETATM 2838 O HOH E 733 55.033 32.119 13.147 1.00 34.50 O HETATM 2839 O HOH E 734 54.000 42.789 -8.942 1.00 42.99 O HETATM 2840 O HOH E 735 71.106 39.473 5.986 1.00 40.37 O HETATM 2841 O HOH E 736 67.317 40.386 -0.489 1.00 40.52 O HETATM 2842 O HOH E 737 45.950 59.192 32.685 1.00 48.51 O HETATM 2843 O HOH E 738 59.873 31.530 17.814 1.00 32.64 O HETATM 2844 O HOH E 739 58.590 49.546 -8.465 1.00 37.67 O HETATM 2845 O HOH E 740 73.732 63.965 6.486 0.50 25.04 O HETATM 2846 O HOH E 741 52.510 34.746 20.968 1.00 39.02 O HETATM 2847 O HOH E 742 63.989 66.564 24.134 1.00 41.45 O HETATM 2848 O HOH E 743 60.910 31.436 8.478 1.00 31.95 O HETATM 2849 O HOH E 744 61.388 53.870 -7.928 1.00 36.98 O HETATM 2850 O HOH E 745 64.534 67.008 3.454 1.00 38.61 O HETATM 2851 O HOH E 746 71.758 40.447 0.962 1.00 44.42 O HETATM 2852 O HOH E 747 66.209 68.865 4.741 1.00 39.64 O HETATM 2853 O HOH E 748 71.363 44.441 19.927 1.00 38.89 O HETATM 2854 O HOH E 749 63.870 67.743 18.939 1.00 47.05 O HETATM 2855 O HOH E 750 47.343 68.146 20.210 1.00 48.57 O HETATM 2856 O HOH E 751 45.513 69.668 13.836 1.00 36.08 O HETATM 2857 O HOH E 752 75.993 38.467 17.459 1.00 36.69 O HETATM 2858 O HOH E 753 52.413 63.108 -8.342 1.00 35.83 O HETATM 2859 O HOH E 754 47.451 64.112 26.444 1.00 38.80 O HETATM 2860 O HOH E 755 41.657 68.263 8.172 1.00 45.13 O HETATM 2861 O HOH E 756 58.267 70.399 7.147 1.00 35.17 O HETATM 2862 O HOH E 757 51.318 69.202 -4.629 1.00 45.94 O HETATM 2863 O HOH E 758 72.926 37.527 9.124 1.00 49.35 O HETATM 2864 O HOH E 759 44.724 70.895 7.532 1.00 36.12 O HETATM 2865 O HOH E 760 72.450 50.718 26.763 1.00 42.03 O HETATM 2866 O HOH E 761 52.245 31.662 1.846 1.00 42.19 O HETATM 2867 O HOH E 762 63.058 45.336 31.190 1.00 38.48 O HETATM 2868 O HOH E 763 60.479 30.312 0.162 1.00 36.33 O HETATM 2869 O HOH E 764 34.619 52.912 17.791 1.00 40.31 O HETATM 2870 O HOH E 765 63.522 47.762 -3.072 1.00 38.74 O HETATM 2871 O HOH E 766 46.419 69.592 17.952 1.00 36.04 O HETATM 2872 O HOH E 767 55.599 68.563 -2.689 1.00 37.50 O HETATM 2873 O HOH E 768 45.421 67.386 0.379 1.00 38.82 O HETATM 2874 O HOH E 769 30.104 59.691 8.306 1.00 39.36 O HETATM 2875 O HOH E 770 52.995 47.430 37.533 1.00 42.36 O HETATM 2876 O HOH E 771 51.962 62.236 -10.903 1.00 42.97 O HETATM 2877 O HOH E 772 46.747 68.242 -1.620 1.00 43.20 O HETATM 2878 O HOH E 773 44.026 58.838 -7.652 1.00 38.02 O HETATM 2879 O HOH E 774 54.516 45.188 32.732 1.00 42.23 O HETATM 2880 O HOH E 775 48.197 57.180 -13.325 1.00 33.01 O HETATM 2881 O HOH E 776 64.074 56.396 -2.071 1.00 45.29 O HETATM 2882 O HOH E 777 50.220 72.698 1.777 1.00 36.97 O HETATM 2883 O HOH E 778 43.144 60.222 -5.767 1.00 34.09 O HETATM 2884 O HOH E 779 49.999 34.956 17.997 1.00 48.07 O HETATM 2885 O HOH E 780 57.675 33.066 14.385 1.00 40.67 O HETATM 2886 O HOH E 781 73.317 46.171 20.859 1.00 51.50 O HETATM 2887 O HOH E 782 68.519 37.231 17.545 1.00 40.82 O HETATM 2888 O HOH E 783 46.956 62.795 -6.480 1.00 38.11 O HETATM 2889 O HOH E 784 52.327 41.444 -4.550 1.00 44.35 O HETATM 2890 O HOH E 785 36.398 55.500 25.380 1.00 38.39 O HETATM 2891 O HOH E 786 64.981 32.404 -2.631 1.00 47.13 O HETATM 2892 O HOH E 787 78.958 45.562 16.581 1.00 48.61 O HETATM 2893 O HOH E 788 51.090 31.594 8.464 1.00 33.23 O HETATM 2894 O HOH E 789 53.162 43.712 27.711 1.00 46.67 O HETATM 2895 O HOH E 790 59.328 68.922 3.072 1.00 23.57 O HETATM 2896 O HOH E 791 42.677 60.710 24.022 0.50 10.85 O HETATM 2897 O HOH E 792 31.975 54.525 -0.660 1.00 34.03 O HETATM 2898 O HOH E 793 35.764 48.556 -6.544 1.00 46.17 O HETATM 2899 O HOH E 794 43.663 56.169 -8.124 1.00 43.48 O HETATM 2900 O HOH E 795 58.824 43.268 31.878 1.00 42.11 O HETATM 2901 O HOH E 796 63.542 54.511 29.386 1.00 15.18 O HETATM 2902 O HOH E 797 77.016 42.879 18.456 1.00 35.58 O HETATM 2903 O HOH E 798 56.452 46.444 -9.174 1.00 45.41 O HETATM 2904 O HOH E 799 74.417 57.855 6.675 1.00 36.80 O HETATM 2905 O HOH E 800 59.542 37.929 -7.449 1.00 55.54 O HETATM 2906 O HOH E 801 60.500 44.747 -7.152 1.00 38.35 O HETATM 2907 O HOH E 802 58.625 29.502 -7.027 1.00 51.72 O HETATM 2908 O HOH E 803 32.709 44.121 3.486 1.00 46.90 O HETATM 2909 O HOH E 804 78.136 57.778 17.222 1.00 30.59 O HETATM 2910 O HOH E 805 67.210 45.483 25.232 1.00 42.99 O HETATM 2911 O HOH E 806 66.935 32.230 -0.351 1.00 47.67 O HETATM 2912 O HOH E 807 56.522 67.033 23.738 1.00 48.31 O HETATM 2913 O HOH E 808 65.937 32.954 16.308 1.00 44.68 O HETATM 2914 O HOH E 809 53.990 54.120 -15.428 1.00 44.29 O HETATM 2915 O HOH E 810 43.358 63.205 23.876 1.00 42.60 O HETATM 2916 O HOH E 811 73.958 40.060 16.236 1.00 28.87 O HETATM 2917 O HOH E 812 35.134 56.668 -3.993 1.00 36.00 O HETATM 2918 O HOH E 813 38.159 62.823 0.045 1.00 50.28 O HETATM 2919 O HOH E 814 49.105 48.632 31.874 1.00 19.71 O HETATM 2920 O HOH E 815 33.257 46.495 28.237 1.00 45.92 O HETATM 2921 O HOH E 816 65.454 52.863 30.378 1.00 41.39 O HETATM 2922 O HOH E 817 31.606 62.421 1.858 1.00 45.19 O HETATM 2923 O HOH E 818 36.867 60.226 -2.910 1.00 44.24 O HETATM 2924 O HOH E 819 60.807 51.068 -9.417 1.00 38.01 O HETATM 2925 O HOH E 820 49.494 70.193 17.162 1.00 43.69 O HETATM 2926 O HOH E 821 43.220 69.912 9.553 1.00 39.28 O HETATM 2927 O HOH E 822 55.766 70.165 14.952 1.00 42.58 O HETATM 2928 O HOH E 823 44.631 67.133 20.463 1.00 45.98 O HETATM 2929 O HOH E 824 74.037 61.085 21.820 1.00 41.51 O HETATM 2930 O HOH E 825 57.689 61.652 28.388 1.00 22.61 O HETATM 2931 O HOH E 826 66.487 54.066 -0.382 1.00 32.17 O HETATM 2932 O HOH E 827 45.309 54.783 -11.230 1.00 46.21 O HETATM 2933 O HOH E 828 66.140 49.164 29.487 1.00 49.92 O HETATM 2934 O HOH E 829 38.738 67.992 16.082 1.00 46.95 O HETATM 2935 O HOH E 830 64.623 50.370 30.420 0.50 23.90 O HETATM 2936 O HOH E 831 53.538 71.620 2.079 1.00 53.74 O HETATM 2937 O HOH E 832 50.526 64.482 25.671 1.00 33.58 O HETATM 2938 O HOH E 833 41.455 61.035 25.267 0.50 16.96 O HETATM 2939 O HOH E 834 58.889 70.717 4.509 1.00 39.23 O HETATM 2940 O HOH E 835 64.095 54.993 -4.204 1.00 48.84 O HETATM 2941 O HOH E 836 65.544 53.633 -2.490 1.00 45.94 O HETATM 2942 O HOH E 837 49.726 71.794 -0.928 1.00 44.23 O HETATM 2943 O HOH E 838 61.766 37.706 -6.260 1.00 49.43 O HETATM 2944 O HOH E 839 30.595 52.380 9.314 1.00 46.42 O HETATM 2945 O HOH E 840 39.415 61.507 -5.274 1.00 41.94 O HETATM 2946 O HOH E 841 60.198 31.546 11.193 1.00 37.05 O HETATM 2947 O HOH E 842 36.393 48.488 17.934 1.00 42.67 O HETATM 2948 O HOH E 843 68.747 36.378 -0.702 1.00 44.91 O HETATM 2949 O HOH E 844 38.379 55.088 -6.397 1.00 46.48 O HETATM 2950 O HOH E 845 54.613 33.629 14.845 1.00 46.49 O HETATM 2951 O HOH E 846 34.077 51.047 26.803 1.00 46.59 O HETATM 2952 O HOH E 847 46.886 44.874 28.174 1.00 50.60 O HETATM 2953 O HOH E 848 49.099 45.267 28.169 1.00 40.44 O HETATM 2954 O HOH E 849 35.003 53.660 26.512 1.00 55.47 O HETATM 2955 O HOH E 850 53.773 36.018 -5.218 1.00 47.74 O HETATM 2956 O HOH E 851 65.531 71.647 12.300 1.00 52.30 O HETATM 2957 O HOH E 852 58.870 34.235 20.602 1.00 43.07 O HETATM 2958 O HOH E 853 64.016 71.877 14.392 1.00 36.80 O HETATM 2959 O HOH E 854 47.587 46.970 28.950 1.00 45.04 O HETATM 2960 O HOH E 855 62.108 67.302 28.397 1.00 53.16 O HETATM 2961 O HOH E 856 58.294 55.297 -11.699 1.00 37.98 O HETATM 2962 O HOH E 857 48.999 42.235 29.224 1.00 41.71 O HETATM 2963 O HOH E 858 46.911 62.840 28.881 1.00 36.43 O HETATM 2964 O HOH E 859 61.417 46.942 -6.598 1.00 48.00 O HETATM 2965 O HOH E 860 58.302 28.731 4.413 1.00 54.48 O HETATM 2966 O HOH E 861 36.927 60.724 19.150 1.00 48.13 O HETATM 2967 O HOH E 862 48.034 70.326 21.666 1.00 51.79 O HETATM 2968 O HOH E 863 55.362 30.951 -6.514 1.00 42.04 O HETATM 2969 O HOH E 864 80.686 52.995 13.201 1.00 48.01 O HETATM 2970 O HOH E 865 55.019 68.327 21.372 1.00 47.12 O HETATM 2971 O HOH E 866 56.335 37.025 23.539 1.00 58.31 O HETATM 2972 O HOH E 867 34.817 46.892 23.999 1.00 48.40 O HETATM 2973 O HOH E 868 35.032 50.250 -2.154 1.00 41.65 O HETATM 2974 O HOH E 869 68.399 47.282 -0.052 1.00 45.29 O HETATM 2975 O HOH E 870 71.874 35.317 12.718 1.00 52.91 O HETATM 2976 O HOH E 871 68.631 49.878 -0.213 1.00 46.20 O HETATM 2977 O HOH E 872 57.978 65.363 -6.608 1.00 50.93 O HETATM 2978 O HOH E 873 33.595 49.117 28.615 1.00 49.61 O HETATM 2979 O HOH E 874 38.044 59.028 -4.791 1.00 50.16 O HETATM 2980 O HOH E 875 41.460 68.686 5.436 1.00 50.60 O HETATM 2981 O HOH E 876 61.141 68.145 24.305 1.00 46.88 O HETATM 2982 O HOH E 877 69.793 39.786 19.254 1.00 44.05 O HETATM 2983 O HOH E 878 32.721 56.031 -3.167 1.00 44.87 O HETATM 2984 O HOH E 879 56.826 41.843 28.538 1.00 48.39 O HETATM 2985 O HOH E 880 55.041 66.405 -7.864 1.00 47.46 O HETATM 2986 O HOH E 881 29.884 52.274 4.754 1.00 41.49 O HETATM 2987 O HOH E 882 78.748 49.013 19.346 1.00 55.82 O HETATM 2988 O HOH E 883 44.228 64.946 -3.172 1.00 40.43 O HETATM 2989 O HOH E 884 70.634 43.150 22.707 1.00 44.12 O HETATM 2990 O HOH E 885 46.640 39.913 4.063 1.00 32.37 O HETATM 2991 O HOH E 886 75.925 59.660 6.472 1.00 47.84 O HETATM 2992 O HOH E 887 74.768 62.863 14.072 0.50 19.98 O HETATM 2993 O HOH E 888 76.908 62.236 19.359 0.50 23.01 O HETATM 2994 O HOH E 889 45.428 38.147 16.215 1.00 43.63 O HETATM 2995 O HOH E 890 37.760 48.394 29.960 1.00 41.88 O HETATM 2996 O HOH E 891 46.853 60.849 -10.863 1.00 39.64 O HETATM 2997 O HOH E 892 46.081 58.659 -12.832 1.00 40.93 O HETATM 2998 O HOH E 893 51.453 45.486 -9.909 1.00 40.36 O HETATM 2999 O HOH E 894 67.182 43.199 -1.638 1.00 43.17 O HETATM 3000 O HOH E 895 52.411 32.961 12.759 1.00 60.28 O HETATM 3001 O HOH E 896 45.870 47.642 -8.802 1.00 53.69 O HETATM 3002 O HOH E 897 38.918 65.092 3.796 1.00 42.70 O HETATM 3003 O HOH E 898 32.059 63.703 10.688 1.00 49.97 O HETATM 3004 O HOH E 899 57.762 58.191 -13.383 1.00 48.94 O HETATM 3005 O HOH E 900 54.400 30.972 4.825 1.00 44.08 O HETATM 3006 O HOH E 901 70.067 46.767 24.962 1.00 45.12 O HETATM 3007 O HOH E 902 50.961 65.621 -7.764 1.00 43.87 O HETATM 3008 O HOH E 903 51.695 52.375 -15.756 1.00 46.41 O HETATM 3009 O HOH E 904 64.818 28.905 1.041 1.00 46.50 O HETATM 3010 O HOH E 905 46.228 49.092 -11.056 1.00 53.87 O HETATM 3011 O HOH E 906 61.841 35.484 23.885 1.00 50.33 O HETATM 3012 O HOH E 907 71.711 38.846 17.578 1.00 45.88 O HETATM 3013 O HOH E 908 32.045 56.841 10.966 1.00 45.40 O HETATM 3014 O HOH E 909 30.867 62.109 13.851 1.00 44.34 O HETATM 3015 O HOH E 910 78.143 51.387 19.649 1.00 49.20 O HETATM 3016 O HOH E 911 51.671 44.000 32.041 1.00 51.94 O HETATM 3017 O HOH E 912 70.096 64.388 6.895 0.50 21.99 O HETATM 3018 O HOH E 913 75.093 62.749 10.884 0.50 21.72 O HETATM 3019 O HOH I 517 30.033 28.931 -8.499 1.00 15.39 O HETATM 3020 O HOH I 518 27.563 22.797 3.310 1.00 13.22 O HETATM 3021 O HOH I 519 28.730 25.335 3.891 1.00 14.64 O HETATM 3022 O HOH I 520 26.855 30.528 0.047 1.00 16.21 O HETATM 3023 O HOH I 521 41.945 36.365 4.445 1.00 15.79 O HETATM 3024 O HOH I 522 39.766 36.058 -2.501 1.00 18.00 O HETATM 3025 O HOH I 523 41.790 35.799 1.008 1.00 18.54 O HETATM 3026 O HOH I 524 31.354 30.903 10.547 1.00 20.04 O HETATM 3027 O HOH I 525 30.969 25.542 -9.978 1.00 20.75 O HETATM 3028 O HOH I 526 46.929 38.229 7.212 1.00 20.52 O HETATM 3029 O HOH I 527 42.346 36.458 -1.613 1.00 30.67 O HETATM 3030 O HOH I 528 40.400 44.729 9.259 1.00 19.88 O HETATM 3031 O HOH I 529 40.076 33.493 16.717 0.67 34.69 O HETATM 3032 O HOH I 530 34.214 36.822 -13.547 1.00 19.83 O HETATM 3033 O HOH I 531 46.818 31.438 5.427 1.00 43.78 O HETATM 3034 O HOH I 532 45.326 35.312 -6.281 1.00 28.73 O HETATM 3035 O HOH I 533 27.435 30.021 2.822 1.00 27.49 O HETATM 3036 O HOH I 534 31.051 40.523 3.644 1.00 27.58 O HETATM 3037 O HOH I 535 43.344 41.418 14.962 1.00 25.96 O HETATM 3038 O HOH I 536 26.584 28.098 6.528 1.00 23.06 O HETATM 3039 O HOH I 537 25.675 20.735 -0.343 1.00 26.14 O HETATM 3040 O HOH I 538 43.461 37.646 2.626 1.00 31.53 O HETATM 3041 O HOH I 539 31.350 34.047 8.013 1.00 29.92 O HETATM 3042 O HOH I 540 38.066 42.286 8.946 1.00 34.55 O HETATM 3043 O HOH I 541 24.962 23.329 -3.475 1.00 35.82 O HETATM 3044 O HOH I 542 44.144 43.732 -1.131 1.00 36.42 O HETATM 3045 O HOH I 543 23.806 25.012 -1.254 1.00 34.27 O HETATM 3046 O HOH I 544 44.839 41.155 -0.485 1.00 28.97 O HETATM 3047 O HOH I 545 30.764 42.558 -6.913 1.00 30.10 O HETATM 3048 O HOH I 546 25.023 36.370 -2.428 1.00 31.25 O HETATM 3049 O HOH I 547 34.626 44.235 -7.291 1.00 24.23 O HETATM 3050 O HOH I 548 38.002 35.382 -11.576 1.00 37.08 O HETATM 3051 O HOH I 549 27.543 32.297 4.441 1.00 30.59 O HETATM 3052 O HOH I 550 34.620 21.712 1.166 1.00 38.57 O HETATM 3053 O HOH I 551 29.256 27.156 10.176 1.00 26.36 O HETATM 3054 O HOH I 552 37.997 29.195 12.056 1.00 37.96 O HETATM 3055 O HOH I 553 29.917 41.943 -3.412 1.00 29.93 O HETATM 3056 O HOH I 554 37.716 38.026 -12.263 1.00 35.73 O HETATM 3057 O HOH I 555 25.624 32.943 0.018 1.00 40.32 O HETATM 3058 O HOH I 556 29.525 33.761 5.306 1.00 36.65 O HETATM 3059 O HOH I 557 38.800 20.963 7.253 1.00 31.73 O HETATM 3060 O HOH I 558 38.335 24.789 11.311 1.00 29.98 O HETATM 3061 O HOH I 559 23.838 31.227 -1.555 1.00 34.32 O HETATM 3062 O HOH I 560 40.820 44.877 12.942 1.00 40.09 O HETATM 3063 O HOH I 561 43.683 29.347 -8.691 1.00 31.07 O HETATM 3064 O HOH I 562 35.860 43.632 -11.739 1.00 36.71 O HETATM 3065 O HOH I 563 28.205 42.261 -8.469 1.00 37.84 O HETATM 3066 O HOH I 564 28.744 31.526 9.314 1.00 37.09 O HETATM 3067 O HOH I 565 42.734 42.569 -4.175 1.00 32.56 O HETATM 3068 O HOH I 566 44.503 40.165 2.294 1.00 30.17 O HETATM 3069 O HOH I 567 32.161 43.800 -3.166 1.00 43.86 O HETATM 3070 O HOH I 568 34.842 32.755 -13.881 1.00 38.07 O HETATM 3071 O HOH I 569 45.753 41.174 6.402 1.00 22.79 O HETATM 3072 O HOH I 570 28.352 19.961 -0.332 1.00 31.91 O HETATM 3073 O HOH I 571 45.854 35.273 -2.136 1.00 45.74 O HETATM 3074 O HOH I 572 27.131 24.125 -4.296 1.00 28.08 O HETATM 3075 O HOH I 573 37.895 22.169 -0.176 1.00 33.05 O HETATM 3076 O HOH I 574 36.726 45.824 -7.780 1.00 35.27 O HETATM 3077 O HOH I 575 32.307 44.239 -0.589 1.00 38.88 O HETATM 3078 O HOH I 576 30.824 22.920 -4.391 1.00 45.61 O HETATM 3079 O HOH I 577 31.659 20.716 -1.534 1.00 37.11 O HETATM 3080 O HOH I 578 29.205 22.603 -2.747 1.00 37.87 O HETATM 3081 O HOH I 579 39.971 25.524 13.269 1.00 52.66 O HETATM 3082 O HOH I 580 27.338 39.404 -2.777 1.00 39.75 O HETATM 3083 O HOH I 581 26.490 35.459 -0.446 1.00 44.15 O HETATM 3084 O HOH I 582 37.495 23.021 -2.510 1.00 39.83 O HETATM 3085 O HOH I 583 39.930 24.795 8.711 1.00 43.21 O HETATM 3086 O HOH I 584 44.924 24.241 -0.588 1.00 39.99 O HETATM 3087 O HOH I 585 39.277 40.696 -11.632 1.00 39.18 O HETATM 3088 O HOH I 586 27.942 43.556 -12.403 1.00 33.67 O HETATM 3089 O HOH I 587 39.143 41.284 17.155 1.00 36.02 O HETATM 3090 O HOH I 588 40.380 28.353 -9.977 1.00 39.64 O HETATM 3091 O HOH I 589 38.638 48.305 -6.796 1.00 50.68 O HETATM 3092 O HOH I 590 43.644 51.203 -9.084 1.00 49.18 O HETATM 3093 O HOH I 591 44.117 40.453 -6.863 1.00 33.71 O HETATM 3094 O HOH I 592 29.874 36.278 4.830 1.00 48.81 O HETATM 3095 O HOH I 593 41.647 40.061 16.671 1.00 34.48 O HETATM 3096 O HOH I 594 30.689 32.153 12.766 1.00 43.70 O HETATM 3097 O HOH I 595 45.700 39.956 14.928 1.00 22.54 O HETATM 3098 O HOH I 596 36.690 28.428 -11.848 1.00 41.21 O HETATM 3099 O HOH I 597 42.742 37.686 16.564 1.00 37.09 O HETATM 3100 O HOH I 598 43.309 23.015 -3.114 1.00 46.39 O HETATM 3101 O HOH I 599 36.515 26.549 11.773 1.00 22.44 O HETATM 3102 O HOH I 600 45.809 24.787 2.486 1.00 31.18 O HETATM 3103 O HOH I 601 47.979 35.405 7.869 1.00 38.64 O HETATM 3104 O HOH I 602 30.012 45.019 -14.520 1.00 54.12 O HETATM 3105 O HOH I 603 47.999 29.873 3.806 1.00 56.18 O HETATM 3106 O HOH I 604 43.700 48.772 -7.941 1.00 40.87 O HETATM 3107 O HOH I 605 41.386 42.519 13.042 0.50 18.17 O HETATM 3108 O HOH I 606 47.194 28.503 -3.223 1.00 43.17 O HETATM 3109 O HOH I 607 42.096 27.570 9.340 1.00 40.14 O HETATM 3110 O HOH I 608 36.681 39.379 10.629 1.00 50.81 O HETATM 3111 O HOH I 609 47.919 25.014 5.602 1.00 52.62 O HETATM 3112 O HOH I 610 32.451 44.871 -5.530 1.00 41.04 O HETATM 3113 O HOH I 611 28.586 38.986 1.776 1.00 41.13 O HETATM 3114 O HOH I 612 44.896 28.734 10.182 1.00 48.42 O HETATM 3115 O HOH I 613 35.555 22.878 -4.145 1.00 46.24 O HETATM 3116 O HOH I 614 30.728 40.004 6.502 1.00 48.49 O HETATM 3117 O HOH I 615 37.053 45.525 -10.166 1.00 47.37 O HETATM 3118 O HOH I 616 47.792 31.702 -2.347 1.00 50.29 O HETATM 3119 O HOH I 617 46.961 38.112 -5.722 1.00 47.12 O HETATM 3120 O HOH I 618 25.612 34.104 3.015 1.00 50.19 O HETATM 3121 O HOH I 619 41.108 51.735 -8.474 1.00 42.84 O HETATM 3122 O HOH I 620 26.637 31.080 7.001 1.00 44.70 O HETATM 3123 O HOH I 621 48.323 33.915 10.137 1.00 54.97 O CONECT 13 2548 CONECT 298 2548 CONECT 531 2548 CONECT 550 2548 CONECT 561 2548 CONECT 573 2548 CONECT 1176 2549 CONECT 1189 2549 CONECT 1214 2549 CONECT 2548 13 298 531 550 CONECT 2548 561 573 CONECT 2549 1176 1189 1214 2654 CONECT 2549 2756 CONECT 2550 2551 2552 2553 CONECT 2551 2550 CONECT 2552 2550 CONECT 2553 2550 2554 CONECT 2554 2553 2555 2556 2560 CONECT 2555 2554 CONECT 2556 2554 2557 CONECT 2557 2556 2558 2559 CONECT 2558 2557 CONECT 2559 2557 CONECT 2560 2554 2561 2562 CONECT 2561 2560 CONECT 2562 2560 CONECT 2563 2564 2565 2566 CONECT 2564 2563 CONECT 2565 2563 CONECT 2566 2563 2567 CONECT 2567 2566 2568 2569 2573 CONECT 2568 2567 CONECT 2569 2567 2570 CONECT 2570 2569 2571 2572 CONECT 2571 2570 CONECT 2572 2570 CONECT 2573 2567 2574 2575 CONECT 2574 2573 CONECT 2575 2573 CONECT 2576 2578 CONECT 2577 2578 2579 CONECT 2578 2576 2577 CONECT 2579 2577 2581 CONECT 2580 2581 2582 CONECT 2581 2579 2580 CONECT 2582 2580 2584 CONECT 2583 2584 2585 CONECT 2584 2582 2583 CONECT 2585 2583 2586 CONECT 2586 2585 CONECT 2587 2588 CONECT 2588 2587 2589 CONECT 2589 2588 2590 CONECT 2590 2589 2592 CONECT 2591 2592 2593 CONECT 2592 2590 2591 CONECT 2593 2591 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 CONECT 2603 2604 CONECT 2604 2603 2605 CONECT 2605 2604 2607 CONECT 2606 2607 2608 CONECT 2607 2605 2606 CONECT 2608 2606 2610 CONECT 2609 2610 2611 CONECT 2610 2608 2609 CONECT 2611 2609 2613 CONECT 2612 2613 2614 CONECT 2613 2611 2612 CONECT 2614 2612 2615 CONECT 2615 2614 CONECT 2616 2617 CONECT 2617 2616 2619 CONECT 2618 2619 2620 CONECT 2619 2617 2618 CONECT 2620 2618 2622 CONECT 2621 2622 CONECT 2622 2620 2621 CONECT 2654 2549 CONECT 2756 2549 MASTER 411 0 8 11 15 0 18 6 3072 2 88 27 END
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Related entries of code: 1to1
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1lw6
RCSB PDB
PDBbind
64aa, >1LW6_2|Chain... at 95%
1tm1
RCSB PDB
PDBbind
64aa, >1TM1_2|Chain... at 93%
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RCSB PDB
PDBbind
64aa, >1TM3_2|Chain... at 92%
1tm4
RCSB PDB
PDBbind
64aa, >1TM4_2|Chain... at 92%
1tm5
RCSB PDB
PDBbind
64aa, >1TM5_2|Chain... at 92%
1tm7
RCSB PDB
PDBbind
64aa, >1TM7_2|Chain... at 92%
1y1k
RCSB PDB
PDBbind
64aa, >1Y1K_2|Chain... at 92%
1y33
RCSB PDB
PDBbind
64aa, >1Y33_2|Chain... at 92%
1y34
RCSB PDB
PDBbind
64aa, >1Y34_2|Chain... at 92%
1y3b
RCSB PDB
PDBbind
64aa, >1Y3B_2|Chain... at 92%
1y3c
RCSB PDB
PDBbind
64aa, >1Y3C_2|Chain... at 92%
1y3d
RCSB PDB
PDBbind
64aa, >1Y3D_2|Chain... at 92%
1y48
RCSB PDB
PDBbind
64aa, >1Y48_2|Chain... at 92%
1y4a
RCSB PDB
PDBbind
64aa, >1Y4A_2|Chain... at 90%
1y4d
RCSB PDB
PDBbind
64aa, >1Y4D_2|Chain... at 90%
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RCSB PDB
PDBbind
83aa, >2SNI_2|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1tm1
RCSB PDB
PDBbind
64-mer
1tm3
RCSB PDB
PDBbind
64-mer
1tm4
RCSB PDB
PDBbind
64-mer
1tm5
RCSB PDB
PDBbind
64-mer
1tm7
RCSB PDB
PDBbind
64-mer
1y1k
RCSB PDB
PDBbind
64-mer
1y33
RCSB PDB
PDBbind
64-mer
1y34
RCSB PDB
PDBbind
64-mer
1y3b
RCSB PDB
PDBbind
64-mer
1y3c
RCSB PDB
PDBbind
64-mer
1y3d
RCSB PDB
PDBbind
64-mer
1y48
RCSB PDB
PDBbind
64-mer
Entry Information
PDB ID
1to1
Complex Type
Protein-Protein
PDBbind Subset
general set
Protein Name
subtilisin bpn
Ligand Name
64-mer
EC.Number
E.C.3.4.21.62
Resolution
1.68(Å)
Affinity (Kd/Ki/IC50)
Ki=0.46nM
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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