Browse entries in the PDBbind-CN Database
HEADER HYDROLASE INHIBITOR/HYDROLASE 05-AUG-08 3E1Z TITLE CRYSTAL STRUCTURE OF THE PARASITE PROTESASE INHIBITOR TITLE 2 CHAGASIN IN COMPLEX WITH PAPAIN COMPND MOL_ID: 1; COMPND 2 MOLECULE: CHAGASIN; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: CYSTEINE PROTEASE INHIBITOR; COMPND 5 ENGINEERED: YES; COMPND 6 MOL_ID: 2; COMPND 7 MOLECULE: PAPAIN; COMPND 8 CHAIN: B; COMPND 9 SYNONYM: CYSTEINE PROTEASE, PAPAYA PROTEINASE I, PPI; COMPND 10 EC: 3.4.22.2 SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: TRYPANOSOMA CRUZI; SOURCE 3 ORGANISM_TAXID: 5693; SOURCE 4 GENE: CHA; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BL21; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_VECTOR: PGEX-6P-1; SOURCE 10 MOL_ID: 2; SOURCE 11 ORGANISM_SCIENTIFIC: CARICA PAPAYA; SOURCE 12 ORGANISM_COMMON: PAPAYA; SOURCE 13 ORGANISM_TAXID: 3649; SOURCE 14 STRAIN: PAPAYA KEYWDS CHAGASIN-PAPAIN COMPLEX, PAPAIN, CHAGAS DISEASE, CYSTEINE KEYWDS 2 PROTEINASES, PROTEIN INHIBITORS, CYTOPLASMIC VESICLE, KEYWDS 3 PROTEASE INHIBITOR, THIOL PROTEASE INHIBITOR, ALLERGEN, KEYWDS 4 HYDROLASE, PROTEASE, THIOL PROTEASE, ZYMOGEN, HYDROLASE KEYWDS 5 INHIBITOR/HYDROLASE COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR I.REDZYNIA,G.BUJACZ,A.BUJACZ,A.LJUNGGREN,M.ABRAHAMSON, AUTHOR 2 M.JASKOLSKI REVDAT 1 27-JAN-09 3E1Z 0 JRNL AUTH I.REDZYNIA,A.LJUNGGREN,A.BUJACZ,M.ABRAHAMSON, JRNL AUTH 2 M.JASKOLSKI,G.BUJACZ JRNL TITL CRYSTAL STRUCTURE OF THE PARASITE INHIBITOR JRNL TITL 2 CHAGASIN IN COMPLEX WITH PAPAIN ALLOWS JRNL TITL 3 IDENTIFICATION OF STRUCTURAL REQUIREMENTS FOR JRNL TITL 4 BROAD REACTIVITY AND SPECIFICITY DETERMINANTS FOR JRNL TITL 5 TARGET PROTEASES. JRNL REF FEBS J. V. 276 793 2009 JRNL REFN ISSN 1742-464X JRNL PMID 19143838 JRNL DOI 10.1111/J.1742-4658.2008.06824.X REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 1.86 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.4.0062 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) : 1.86 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 60.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : 98.3 REMARK 3 NUMBER OF REFLECTIONS : 31568 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.166 REMARK 3 R VALUE (WORKING SET) : 0.164 REMARK 3 FREE R VALUE : 0.208 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.100 REMARK 3 FREE R VALUE TEST SET COUNT : 1694 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) : 1.86 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.91 REMARK 3 REFLECTION IN BIN (WORKING SET) : 2026 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 86.96 REMARK 3 BIN R VALUE (WORKING SET) : 0.2720 REMARK 3 BIN FREE R VALUE SET COUNT : 115 REMARK 3 BIN FREE R VALUE : 0.3350 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2557 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 1 REMARK 3 SOLVENT ATOMS : 332 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 22.36 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 27.60 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.97000 REMARK 3 B22 (A**2) : -0.97000 REMARK 3 B33 (A**2) : 1.94000 REMARK 3 B12 (A**2) : 0.00000 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): 0.119 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.120 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.082 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 5.322 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.964 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.942 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2665 ; 0.017 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3623 ; 1.614 ; 1.940 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 336 ; 6.384 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 124 ;35.509 ;23.548 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 402 ;13.882 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 15 ;18.201 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 372 ; 0.115 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 2095 ; 0.009 ; 0.021 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): NULL ; NULL ; NULL 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): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): NULL ; NULL ; NULL 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): 1634 ; 0.974 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2601 ; 1.604 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 1031 ; 2.702 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 1014 ; 4.161 ; 4.500 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 : 2 REMARK 3 REMARK 3 TLS GROUP : 1 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 2 A 110 REMARK 3 ORIGIN FOR THE GROUP (A): 37.1740 4.7772 15.2074 REMARK 3 T TENSOR REMARK 3 T11: -0.0765 T22: 0.0212 REMARK 3 T33: -0.1700 T12: -0.0421 REMARK 3 T13: 0.0066 T23: -0.0578 REMARK 3 L TENSOR REMARK 3 L11: 2.0290 L22: 1.7238 REMARK 3 L33: 2.2948 L12: 0.7278 REMARK 3 L13: 1.3758 L23: 1.0111 REMARK 3 S TENSOR REMARK 3 S11: 0.0676 S12: -0.1126 S13: -0.0634 REMARK 3 S21: -0.1237 S22: -0.1217 S23: -0.0253 REMARK 3 S31: 0.0854 S32: -0.3076 S33: 0.0541 REMARK 3 REMARK 3 TLS GROUP : 2 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 1 B 212 REMARK 3 ORIGIN FOR THE GROUP (A): 54.7605 23.3570 32.2084 REMARK 3 T TENSOR REMARK 3 T11: -0.0410 T22: -0.0298 REMARK 3 T33: -0.0181 T12: -0.0097 REMARK 3 T13: 0.0016 T23: -0.0146 REMARK 3 L TENSOR REMARK 3 L11: 1.0809 L22: 0.6506 REMARK 3 L33: 0.6818 L12: -0.0583 REMARK 3 L13: -0.0387 L23: -0.0508 REMARK 3 S TENSOR REMARK 3 S11: 0.0237 S12: 0.0545 S13: 0.0201 REMARK 3 S21: -0.0558 S22: -0.0222 S23: 0.0067 REMARK 3 S31: 0.0112 S32: -0.0712 S33: -0.0016 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 : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE REMARK 3 RIDING POSITIONS REMARK 4 REMARK 4 3E1Z COMPLIES WITH FORMAT V. 3.20, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 07-AUG-08. REMARK 100 THE RCSB ID CODE IS RCSB048773. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 07-DEC-07 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : EMBL/DESY, HAMBURG REMARK 200 BEAMLINE : X13 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.8086 REMARK 200 MONOCHROMATOR : SI [111], HORIZONTALLY REMARK 200 FOCUSSING REMARK 200 OPTICS : MIRRORS REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MAR CCD 165 MM REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 33263 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.860 REMARK 200 RESOLUTION RANGE LOW (A) : 84.220 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -1.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 98.4 REMARK 200 DATA REDUNDANCY : 10.500 REMARK 200 R MERGE (I) : 0.09000 REMARK 200 R SYM (I) : NULL REMARK 200
FOR THE DATA SET : 22.1000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.86 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.93 REMARK 200 COMPLETENESS FOR SHELL (%) : 88.8 REMARK 200 DATA REDUNDANCY IN SHELL : 6.80 REMARK 200 R MERGE FOR SHELL (I) : 0.55700 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200
FOR SHELL : 2.100 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: MOLREP REMARK 200 STARTING MODEL: PDB ENTRY 2NQD REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 55.41 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.76 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 2.0M AMMONIUM FORMATE, PH 7.5, REMARK 280 VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 291K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: I 4 2 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z REMARK 290 3555 -Y,X,Z REMARK 290 4555 Y,-X,Z REMARK 290 5555 -X,Y,-Z REMARK 290 6555 X,-Y,-Z REMARK 290 7555 Y,X,-Z REMARK 290 8555 -Y,-X,-Z REMARK 290 9555 X+1/2,Y+1/2,Z+1/2 REMARK 290 10555 -X+1/2,-Y+1/2,Z+1/2 REMARK 290 11555 -Y+1/2,X+1/2,Z+1/2 REMARK 290 12555 Y+1/2,-X+1/2,Z+1/2 REMARK 290 13555 -X+1/2,Y+1/2,-Z+1/2 REMARK 290 14555 X+1/2,-Y+1/2,-Z+1/2 REMARK 290 15555 Y+1/2,X+1/2,-Z+1/2 REMARK 290 16555 -Y+1/2,-X+1/2,-Z+1/2 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 7 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 7 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 9 1.000000 0.000000 0.000000 49.56500 REMARK 290 SMTRY2 9 0.000000 1.000000 0.000000 49.56500 REMARK 290 SMTRY3 9 0.000000 0.000000 1.000000 79.74500 REMARK 290 SMTRY1 10 -1.000000 0.000000 0.000000 49.56500 REMARK 290 SMTRY2 10 0.000000 -1.000000 0.000000 49.56500 REMARK 290 SMTRY3 10 0.000000 0.000000 1.000000 79.74500 REMARK 290 SMTRY1 11 0.000000 -1.000000 0.000000 49.56500 REMARK 290 SMTRY2 11 1.000000 0.000000 0.000000 49.56500 REMARK 290 SMTRY3 11 0.000000 0.000000 1.000000 79.74500 REMARK 290 SMTRY1 12 0.000000 1.000000 0.000000 49.56500 REMARK 290 SMTRY2 12 -1.000000 0.000000 0.000000 49.56500 REMARK 290 SMTRY3 12 0.000000 0.000000 1.000000 79.74500 REMARK 290 SMTRY1 13 -1.000000 0.000000 0.000000 49.56500 REMARK 290 SMTRY2 13 0.000000 1.000000 0.000000 49.56500 REMARK 290 SMTRY3 13 0.000000 0.000000 -1.000000 79.74500 REMARK 290 SMTRY1 14 1.000000 0.000000 0.000000 49.56500 REMARK 290 SMTRY2 14 0.000000 -1.000000 0.000000 49.56500 REMARK 290 SMTRY3 14 0.000000 0.000000 -1.000000 79.74500 REMARK 290 SMTRY1 15 0.000000 1.000000 0.000000 49.56500 REMARK 290 SMTRY2 15 1.000000 0.000000 0.000000 49.56500 REMARK 290 SMTRY3 15 0.000000 0.000000 -1.000000 79.74500 REMARK 290 SMTRY1 16 0.000000 -1.000000 0.000000 49.56500 REMARK 290 SMTRY2 16 -1.000000 0.000000 0.000000 49.56500 REMARK 290 SMTRY3 16 0.000000 0.000000 -1.000000 79.74500 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: 1710 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 13940 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -12.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B 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 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 1 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 SG CYS B 25 CH3 ACY B 213 1.78 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 ARG B 93 -169.34 -127.80 REMARK 500 ASP B 158 6.11 -153.48 REMARK 500 CYS B 200 26.91 48.42 REMARK 500 REMARK 500 REMARK: NULL 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 ZN A 111 ZN REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLU A 23 OE2 REMARK 620 2 HIS A 72 ND1 91.8 REMARK 620 3 HIS A 74 NE2 117.3 114.2 REMARK 620 4 FMT A 113 O2 102.8 93.6 128.9 REMARK 620 N 1 2 3 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ZN A 111 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FMT A 112 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FMT A 113 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FMT A 114 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ACY B 213 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FMT B 214 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FMT B 215 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FMT B 216 REMARK 800 SITE_IDENTIFIER: AC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FMT B 217 REMARK 800 SITE_IDENTIFIER: BC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FMT B 218 REMARK 800 SITE_IDENTIFIER: BC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FMT B 219 REMARK 800 SITE_IDENTIFIER: BC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FMT B 220 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1KHQ RELATED DB: PDB REMARK 900 ORTHOROMBIC STRUCTURE OF PAPAIN REMARK 900 RELATED ID: 2NQD RELATED DB: PDB REMARK 900 CHAGASIN-CATHEPSIN L COMPLEX STRUCTURE REMARK 900 RELATED ID: 3CBJ RELATED DB: PDB REMARK 900 MONOCLINIC FORM OF CHAGASIN-CATHEPSIN B COMPLEX STRUCTURE REMARK 900 RELATED ID: 3CBK RELATED DB: PDB REMARK 900 TETRAGONAL FORM OF CHAGASIN-CATHEPSIN B COMPLEX STRUCTURE REMARK 900 RELATED ID: 2OUL RELATED DB: PDB REMARK 900 CHAGASIN-FALCIPAIN COMPLEX STRUCTURE REMARK 900 RELATED ID: 1ME3 RELATED DB: PDB REMARK 900 CRYSTAL STRUCTURE OF CRUZIPAIN DBREF 3E1Z A 1 110 UNP Q966X9 CHAG_TRYCR 1 110 DBREF 3E1Z B 1 212 UNP P00784 PAPA1_CARPA 134 345 SEQRES 1 A 110 MET SER HIS LYS VAL THR LYS ALA HIS ASN GLY ALA THR SEQRES 2 A 110 LEU THR VAL ALA VAL GLY GLU LEU VAL GLU ILE GLN LEU SEQRES 3 A 110 PRO SER ASN PRO THR THR GLY PHE ALA TRP TYR PHE GLU SEQRES 4 A 110 GLY GLY THR LYS GLU SER PRO ASN GLU SER MET PHE THR SEQRES 5 A 110 VAL GLU ASN LYS TYR PHE PRO PRO ASP SER LYS LEU LEU SEQRES 6 A 110 GLY ALA GLY GLY THR GLU HIS PHE HIS VAL THR VAL LYS SEQRES 7 A 110 ALA ALA GLY THR HIS ALA VAL ASN LEU THR TYR MET ARG SEQRES 8 A 110 PRO TRP THR GLY PRO SER HIS ASP SER GLU ARG PHE THR SEQRES 9 A 110 VAL TYR LEU LYS ALA ASN SEQRES 1 B 212 ILE PRO GLU TYR VAL ASP TRP ARG GLN LYS GLY ALA VAL SEQRES 2 B 212 THR PRO VAL LYS ASN GLN GLY SER CYS GLY SER CYS TRP SEQRES 3 B 212 ALA PHE SER ALA VAL VAL THR ILE GLU GLY ILE ILE LYS SEQRES 4 B 212 ILE ARG THR GLY ASN LEU ASN GLU TYR SER GLU GLN GLU SEQRES 5 B 212 LEU LEU ASP CYS ASP ARG ARG SER TYR GLY CYS ASN GLY SEQRES 6 B 212 GLY TYR PRO TRP SER ALA LEU GLN LEU VAL ALA GLN TYR SEQRES 7 B 212 GLY ILE HIS TYR ARG ASN THR TYR PRO TYR GLU GLY VAL SEQRES 8 B 212 GLN ARG TYR CYS ARG SER ARG GLU LYS GLY PRO TYR ALA SEQRES 9 B 212 ALA LYS THR ASP GLY VAL ARG GLN VAL GLN PRO TYR ASN SEQRES 10 B 212 GLU GLY ALA LEU LEU TYR SER ILE ALA ASN GLN PRO VAL SEQRES 11 B 212 SER VAL VAL LEU GLU ALA ALA GLY LYS ASP PHE GLN LEU SEQRES 12 B 212 TYR ARG GLY GLY ILE PHE VAL GLY PRO CYS GLY ASN LYS SEQRES 13 B 212 VAL ASP HIS ALA VAL ALA ALA VAL GLY TYR GLY PRO ASN SEQRES 14 B 212 TYR ILE LEU ILE LYS ASN SER TRP GLY THR GLY TRP GLY SEQRES 15 B 212 GLU ASN GLY TYR ILE ARG ILE LYS ARG GLY THR GLY ASN SEQRES 16 B 212 SER TYR GLY VAL CYS GLY LEU TYR THR SER SER PHE TYR SEQRES 17 B 212 PRO VAL LYS ASN HET ZN A 111 1 HET FMT A 112 3 HET FMT A 113 3 HET FMT A 114 3 HET ACY B 213 4 HET FMT B 214 3 HET FMT B 215 3 HET FMT B 216 3 HET FMT B 217 3 HET FMT B 218 3 HET FMT B 219 3 HET FMT B 220 3 HETNAM ZN ZINC ION HETNAM FMT FORMIC ACID HETNAM ACY ACETIC ACID FORMUL 3 ZN ZN 2+ FORMUL 4 FMT 10(C H2 O2) FORMUL 7 ACY C2 H4 O2 FORMUL 15 HOH *298(H2 O) HELIX 1 1 THR A 6 ASN A 10 5 5 HELIX 2 2 ASN A 29 GLY A 33 5 5 HELIX 3 3 ARG B 8 GLY B 11 5 4 HELIX 4 4 SER B 24 GLY B 43 1 20 HELIX 5 5 SER B 49 ASP B 57 1 9 HELIX 6 6 TYR B 61 GLY B 65 5 5 HELIX 7 7 TYR B 67 GLY B 79 1 13 HELIX 8 8 ARG B 96 LYS B 100 5 5 HELIX 9 9 ASN B 117 GLN B 128 1 12 HELIX 10 10 GLY B 138 LEU B 143 1 6 HELIX 11 11 GLY B 198 LEU B 202 5 5 SHEET 1 A 4 THR A 13 VAL A 16 0 SHEET 2 A 4 GLU A 101 ALA A 109 1 O TYR A 106 N LEU A 14 SHEET 3 A 4 GLY A 81 MET A 90 -1 N GLY A 81 O ALA A 109 SHEET 4 A 4 ALA A 35 TYR A 37 -1 N ALA A 35 O MET A 90 SHEET 1 B 3 LEU A 21 SER A 28 0 SHEET 2 B 3 GLY A 69 VAL A 77 -1 O VAL A 75 N VAL A 22 SHEET 3 B 3 PHE A 51 PHE A 58 -1 N LYS A 56 O HIS A 72 SHEET 1 C 3 VAL B 5 ASP B 6 0 SHEET 2 C 3 HIS B 159 GLY B 167 -1 O TYR B 166 N VAL B 5 SHEET 3 C 3 VAL B 130 LEU B 134 -1 N VAL B 132 O VAL B 161 SHEET 1 D 5 VAL B 5 ASP B 6 0 SHEET 2 D 5 HIS B 159 GLY B 167 -1 O TYR B 166 N VAL B 5 SHEET 3 D 5 TYR B 170 LYS B 174 -1 O LYS B 174 N ALA B 162 SHEET 4 D 5 TYR B 186 LYS B 190 -1 O ILE B 187 N ILE B 173 SHEET 5 D 5 ILE B 148 PHE B 149 1 N PHE B 149 O ARG B 188 SHEET 1 E 2 GLY B 109 GLN B 112 0 SHEET 2 E 2 PHE B 207 VAL B 210 -1 O TYR B 208 N ARG B 111 SSBOND 1 CYS B 22 CYS B 63 1555 1555 2.04 SSBOND 2 CYS B 56 CYS B 95 1555 1555 2.09 SSBOND 3 CYS B 153 CYS B 200 1555 1555 2.03 LINK OE2 GLU A 23 ZN ZN A 111 1555 1555 2.00 LINK ND1 HIS A 72 ZN ZN A 111 1555 1555 2.14 LINK NE2 HIS A 74 ZN ZN A 111 1555 1555 1.91 LINK ZN ZN A 111 O2 FMT A 113 1555 1555 2.07 CISPEP 1 GLY B 151 PRO B 152 0 6.43 SITE 1 AC1 4 GLU A 23 HIS A 72 HIS A 74 FMT A 113 SITE 1 AC2 1 GLY B 101 SITE 1 AC3 7 GLU A 23 PHE A 58 HIS A 72 HIS A 74 SITE 2 AC3 7 ZN A 111 HOH A 141 TYR B 61 SITE 1 AC4 6 PHE A 34 SER A 97 HIS A 98 ASP A 99 SITE 2 AC4 6 HOH A 148 ASN B 18 SITE 1 AC5 10 ASN A 29 THR A 31 THR A 32 GLY A 66 SITE 2 AC5 10 GLN B 19 GLY B 23 SER B 24 CYS B 25 SITE 3 AC5 10 ASP B 158 HIS B 159 SITE 1 AC6 5 SER B 124 ASN B 127 GLN B 128 TYR B 208 SITE 2 AC6 5 HOH B 380 SITE 1 AC7 3 TYR B 78 HIS B 81 HOH B 382 SITE 1 AC8 2 ARG B 98 HOH B 382 SITE 1 AC9 1 HOH B 400 SITE 1 BC1 3 GLU A 20 GLN B 92 HOH B 390 SITE 1 BC2 1 LYS B 190 SITE 1 BC3 5 GLN B 9 ILE B 40 HOH B 298 HOH B 400 SITE 2 BC3 5 HOH B 441 CRYST1 99.130 99.130 159.490 90.00 90.00 90.00 I 4 2 2 16 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 0.010088 0.000000 0.000000 0.00000 SCALE2 0.000000 0.010088 0.000000 0.00000 SCALE3 0.000000 0.000000 0.006270 0.00000 ATOM 1 N SER A 2 44.725 -9.851 13.680 1.00 61.65 N ATOM 2 CA SER A 2 43.446 -10.618 13.869 1.00 61.31 C ATOM 3 C SER A 2 42.435 -10.285 12.770 1.00 60.85 C ATOM 4 O SER A 2 42.818 -10.129 11.604 1.00 61.52 O ATOM 5 CB SER A 2 42.863 -10.418 15.285 1.00 61.42 C ATOM 6 OG SER A 2 43.322 -9.225 15.906 1.00 61.53 O ATOM 7 N HIS A 3 41.152 -10.213 13.117 1.00 59.83 N ATOM 8 CA HIS A 3 40.183 -9.543 12.250 1.00 58.57 C ATOM 9 C HIS A 3 39.996 -8.090 12.724 1.00 56.56 C ATOM 10 O HIS A 3 38.992 -7.432 12.400 1.00 56.75 O ATOM 11 CB HIS A 3 38.847 -10.306 12.154 1.00 59.46 C ATOM 12 CG HIS A 3 37.915 -9.764 11.103 1.00 62.33 C ATOM 13 ND1 HIS A 3 38.360 -9.050 10.006 1.00 64.81 N ATOM 14 CD2 HIS A 3 36.567 -9.838 10.978 1.00 64.43 C ATOM 15 CE1 HIS A 3 37.326 -8.702 9.258 1.00 65.73 C ATOM 16 NE2 HIS A 3 36.227 -9.169 9.824 1.00 65.83 N ATOM 17 N LYS A 4 40.972 -7.597 13.495 1.00 53.64 N ATOM 18 CA LYS A 4 40.998 -6.200 13.865 1.00 50.73 C ATOM 19 C LYS A 4 41.239 -5.362 12.607 1.00 48.35 C ATOM 20 O LYS A 4 42.084 -5.684 11.769 1.00 48.75 O ATOM 21 CB LYS A 4 42.046 -5.911 14.944 1.00 50.99 C ATOM 22 CG LYS A 4 43.480 -6.153 14.534 1.00 51.65 C ATOM 23 CD LYS A 4 44.456 -5.527 15.520 1.00 53.59 C ATOM 24 CE LYS A 4 44.771 -6.449 16.682 1.00 53.47 C ATOM 25 NZ LYS A 4 45.399 -5.717 17.825 1.00 54.43 N ATOM 26 N VAL A 5 40.450 -4.307 12.479 1.00 45.07 N ATOM 27 CA VAL A 5 40.586 -3.306 11.444 1.00 41.84 C ATOM 28 C VAL A 5 41.498 -2.185 11.963 1.00 40.66 C ATOM 29 O VAL A 5 41.198 -1.578 12.987 1.00 39.95 O ATOM 30 CB VAL A 5 39.229 -2.693 11.169 1.00 41.11 C ATOM 31 CG1 VAL A 5 39.281 -1.807 9.938 1.00 39.28 C ATOM 32 CG2 VAL A 5 38.190 -3.809 11.034 1.00 43.07 C ATOM 33 N THR A 6 42.598 -1.916 11.259 1.00 38.72 N ATOM 34 CA THR A 6 43.531 -0.874 11.670 1.00 37.95 C ATOM 35 C THR A 6 43.669 0.184 10.585 1.00 38.31 C ATOM 36 O THR A 6 42.968 0.141 9.581 1.00 37.48 O ATOM 37 CB THR A 6 44.916 -1.458 11.947 1.00 37.60 C ATOM 38 OG1 THR A 6 45.472 -1.964 10.720 1.00 37.98 O ATOM 39 CG2 THR A 6 44.804 -2.575 12.982 1.00 37.89 C ATOM 40 N LYS A 7 44.616 1.105 10.766 1.00 38.36 N ATOM 41 CA LYS A 7 44.864 2.131 9.765 1.00 39.16 C ATOM 42 C LYS A 7 45.177 1.579 8.391 1.00 39.09 C ATOM 43 O LYS A 7 44.761 2.158 7.423 1.00 39.98 O ATOM 44 CB LYS A 7 45.944 3.095 10.209 1.00 39.58 C ATOM 45 CG LYS A 7 45.400 4.437 10.642 1.00 41.79 C ATOM 46 CD LYS A 7 46.585 5.340 10.925 1.00 46.84 C ATOM 47 CE LYS A 7 46.209 6.810 10.936 1.00 50.22 C ATOM 48 NZ LYS A 7 47.425 7.592 11.340 1.00 53.73 N ATOM 49 N ALA A 8 45.856 0.438 8.323 1.00 38.77 N ATOM 50 CA ALA A 8 46.143 -0.245 7.064 1.00 39.03 C ATOM 51 C ALA A 8 44.900 -0.627 6.224 1.00 38.26 C ATOM 52 O ALA A 8 45.003 -0.929 5.026 1.00 38.57 O ATOM 53 CB ALA A 8 47.006 -1.480 7.342 1.00 39.10 C ATOM 54 N HIS A 9 43.733 -0.658 6.855 1.00 36.93 N ATOM 55 CA HIS A 9 42.499 -0.957 6.164 1.00 36.27 C ATOM 56 C HIS A 9 41.703 0.300 5.785 1.00 35.45 C ATOM 57 O HIS A 9 40.544 0.197 5.393 1.00 35.21 O ATOM 58 CB HIS A 9 41.642 -1.880 7.020 1.00 37.15 C ATOM 59 CG HIS A 9 42.389 -3.056 7.557 1.00 41.24 C ATOM 60 ND1 HIS A 9 42.612 -4.197 6.816 1.00 44.25 N ATOM 61 CD2 HIS A 9 42.992 -3.257 8.756 1.00 43.13 C ATOM 62 CE1 HIS A 9 43.319 -5.052 7.540 1.00 47.03 C ATOM 63 NE2 HIS A 9 43.560 -4.505 8.722 1.00 45.59 N ATOM 64 N ASN A 10 42.301 1.487 5.919 1.00 34.12 N ATOM 65 CA ASN A 10 41.588 2.730 5.592 1.00 32.94 C ATOM 66 C ASN A 10 40.947 2.628 4.215 1.00 31.63 C ATOM 67 O ASN A 10 41.609 2.241 3.263 1.00 30.75 O ATOM 68 CB ASN A 10 42.521 3.937 5.635 1.00 31.95 C ATOM 69 CG ASN A 10 41.784 5.216 5.943 1.00 36.36 C ATOM 70 OD1 ASN A 10 40.592 5.337 5.664 1.00 34.52 O ATOM 71 ND2 ASN A 10 42.486 6.180 6.556 1.00 36.74 N ATOM 72 N GLY A 11 39.658 2.921 4.113 1.00 30.75 N ATOM 73 CA GLY A 11 38.963 2.846 2.804 1.00 30.90 C ATOM 74 C GLY A 11 38.420 1.471 2.444 1.00 31.35 C ATOM 75 O GLY A 11 37.684 1.340 1.459 1.00 30.89 O ATOM 76 N ALA A 12 38.736 0.449 3.244 1.00 31.58 N ATOM 77 CA ALA A 12 38.335 -0.933 2.916 1.00 32.20 C ATOM 78 C ALA A 12 36.849 -1.177 3.180 1.00 32.64 C ATOM 79 O ALA A 12 36.222 -0.437 3.948 1.00 30.18 O ATOM 80 CB ALA A 12 39.182 -1.950 3.701 1.00 32.46 C ATOM 81 N THR A 13 36.295 -2.175 2.484 1.00 33.30 N ATOM 82 CA THR A 13 34.957 -2.667 2.762 1.00 33.89 C ATOM 83 C THR A 13 35.051 -4.037 3.438 1.00 33.97 C ATOM 84 O THR A 13 35.730 -4.951 2.953 1.00 32.07 O ATOM 85 CB THR A 13 34.089 -2.679 1.503 1.00 34.66 C ATOM 86 OG1 THR A 13 33.892 -1.324 1.093 1.00 37.45 O ATOM 87 CG2 THR A 13 32.735 -3.315 1.739 1.00 33.06 C ATOM 88 N LEU A 14 34.384 -4.153 4.578 1.00 33.47 N ATOM 89 CA LEU A 14 34.335 -5.417 5.320 1.00 34.99 C ATOM 90 C LEU A 14 32.936 -5.988 5.229 1.00 34.79 C ATOM 91 O LEU A 14 31.960 -5.271 5.445 1.00 35.37 O ATOM 92 CB LEU A 14 34.694 -5.176 6.795 1.00 35.68 C ATOM 93 CG LEU A 14 36.141 -4.938 7.260 1.00 39.09 C ATOM 94 CD1 LEU A 14 37.144 -4.492 6.176 1.00 41.40 C ATOM 95 CD2 LEU A 14 36.152 -3.968 8.439 1.00 40.18 C ATOM 96 N THR A 15 32.829 -7.273 4.899 1.00 35.02 N ATOM 97 CA THR A 15 31.519 -7.933 4.847 1.00 35.09 C ATOM 98 C THR A 15 31.269 -8.534 6.228 1.00 34.60 C ATOM 99 O THR A 15 32.094 -9.303 6.728 1.00 33.30 O ATOM 100 CB THR A 15 31.468 -8.983 3.721 1.00 35.73 C ATOM 101 OG1 THR A 15 31.965 -8.383 2.520 1.00 37.59 O ATOM 102 CG2 THR A 15 30.037 -9.467 3.437 1.00 35.70 C ATOM 103 N VAL A 16 30.138 -8.161 6.827 1.00 33.90 N ATOM 104 CA VAL A 16 29.848 -8.441 8.234 1.00 34.84 C ATOM 105 C VAL A 16 28.423 -8.943 8.403 1.00 35.47 C ATOM 106 O VAL A 16 27.553 -8.701 7.551 1.00 35.03 O ATOM 107 CB VAL A 16 30.009 -7.169 9.108 1.00 34.56 C ATOM 108 CG1 VAL A 16 31.428 -6.669 9.051 1.00 34.15 C ATOM 109 CG2 VAL A 16 29.039 -6.057 8.647 1.00 33.20 C ATOM 110 N ALA A 17 28.192 -9.652 9.499 1.00 36.13 N ATOM 111 CA ALA A 17 26.837 -10.075 9.839 1.00 37.26 C ATOM 112 C ALA A 17 26.180 -8.971 10.657 1.00 37.47 C ATOM 113 O ALA A 17 26.859 -8.278 11.433 1.00 37.93 O ATOM 114 CB ALA A 17 26.851 -11.397 10.618 1.00 36.77 C ATOM 115 N VAL A 18 24.865 -8.794 10.469 1.00 38.32 N ATOM 116 CA VAL A 18 24.081 -7.983 11.395 1.00 37.89 C ATOM 117 C VAL A 18 24.331 -8.592 12.767 1.00 38.37 C ATOM 118 O VAL A 18 24.191 -9.812 12.932 1.00 38.62 O ATOM 119 CB VAL A 18 22.560 -8.026 11.070 1.00 37.92 C ATOM 120 CG1 VAL A 18 21.740 -7.516 12.279 1.00 37.41 C ATOM 121 CG2 VAL A 18 22.254 -7.191 9.837 1.00 35.04 C ATOM 122 N GLY A 19 24.739 -7.757 13.726 1.00 38.07 N ATOM 123 CA GLY A 19 24.916 -8.199 15.096 1.00 38.39 C ATOM 124 C GLY A 19 26.347 -8.549 15.460 1.00 38.41 C ATOM 125 O GLY A 19 26.661 -8.724 16.649 1.00 39.05 O ATOM 126 N GLU A 20 27.215 -8.640 14.456 1.00 38.29 N ATOM 127 CA GLU A 20 28.638 -8.952 14.655 1.00 38.58 C ATOM 128 C GLU A 20 29.410 -7.737 15.165 1.00 37.93 C ATOM 129 O GLU A 20 29.290 -6.662 14.600 1.00 37.38 O ATOM 130 CB GLU A 20 29.237 -9.451 13.330 1.00 38.79 C ATOM 131 CG GLU A 20 30.772 -9.305 13.210 1.00 40.08 C ATOM 132 CD GLU A 20 31.316 -9.777 11.865 1.00 42.14 C ATOM 133 OE1 GLU A 20 30.522 -10.114 10.958 1.00 42.02 O ATOM 134 OE2 GLU A 20 32.549 -9.803 11.703 1.00 43.77 O ATOM 135 N LEU A 21 30.184 -7.900 16.241 1.00 37.72 N ATOM 136 CA LEU A 21 31.058 -6.836 16.721 1.00 37.63 C ATOM 137 C LEU A 21 32.334 -6.714 15.840 1.00 38.01 C ATOM 138 O LEU A 21 33.118 -7.674 15.690 1.00 38.74 O ATOM 139 CB LEU A 21 31.390 -7.006 18.231 1.00 38.08 C ATOM 140 CG LEU A 21 32.148 -5.874 18.956 1.00 39.01 C ATOM 141 CD1 LEU A 21 32.034 -5.939 20.484 1.00 38.62 C ATOM 142 CD2 LEU A 21 33.641 -5.814 18.548 1.00 41.24 C ATOM 143 N VAL A 22 32.502 -5.543 15.221 1.00 36.47 N ATOM 144 CA VAL A 22 33.668 -5.238 14.386 1.00 34.30 C ATOM 145 C VAL A 22 34.697 -4.478 15.261 1.00 33.51 C ATOM 146 O VAL A 22 34.354 -3.545 16.002 1.00 33.09 O ATOM 147 CB VAL A 22 33.251 -4.438 13.135 1.00 34.26 C ATOM 148 CG1 VAL A 22 34.460 -4.049 12.269 1.00 33.34 C ATOM 149 CG2 VAL A 22 32.237 -5.231 12.337 1.00 31.91 C ATOM 150 N GLU A 23 35.951 -4.905 15.193 1.00 31.89 N ATOM 151 CA GLU A 23 36.984 -4.387 16.091 1.00 32.29 C ATOM 152 C GLU A 23 37.811 -3.373 15.307 1.00 32.42 C ATOM 153 O GLU A 23 38.427 -3.751 14.289 1.00 33.05 O ATOM 154 CB GLU A 23 37.854 -5.561 16.549 1.00 30.73 C ATOM 155 CG GLU A 23 39.098 -5.167 17.267 1.00 35.10 C ATOM 156 CD GLU A 23 38.844 -4.938 18.746 1.00 33.48 C ATOM 157 OE1 GLU A 23 37.866 -5.529 19.278 1.00 32.69 O ATOM 158 OE2 GLU A 23 39.620 -4.184 19.376 1.00 36.81 O ATOM 159 N ILE A 24 37.764 -2.091 15.687 1.00 30.59 N ATOM 160 CA ILE A 24 38.554 -1.080 14.984 1.00 30.95 C ATOM 161 C ILE A 24 39.558 -0.569 15.988 1.00 31.34 C ATOM 162 O ILE A 24 39.189 -0.339 17.145 1.00 29.01 O ATOM 163 CB ILE A 24 37.709 0.121 14.427 1.00 32.17 C ATOM 164 CG1 ILE A 24 36.577 -0.342 13.505 1.00 31.32 C ATOM 165 CG2 ILE A 24 38.565 1.058 13.577 1.00 31.06 C ATOM 166 CD1 ILE A 24 35.546 0.788 13.191 1.00 32.59 C ATOM 167 N GLN A 25 40.827 -0.481 15.594 1.00 31.01 N ATOM 168 CA GLN A 25 41.857 -0.025 16.529 1.00 30.89 C ATOM 169 C GLN A 25 42.708 0.976 15.783 1.00 30.42 C ATOM 170 O GLN A 25 43.205 0.655 14.680 1.00 30.98 O ATOM 171 CB GLN A 25 42.708 -1.196 16.991 1.00 31.23 C ATOM 172 CG GLN A 25 41.935 -2.262 17.797 1.00 34.17 C ATOM 173 CD GLN A 25 42.871 -3.283 18.405 1.00 35.44 C ATOM 174 OE1 GLN A 25 44.078 -3.070 18.443 1.00 38.97 O ATOM 175 NE2 GLN A 25 42.324 -4.405 18.868 1.00 40.15 N ATOM 176 N LEU A 26 42.841 2.185 16.338 1.00 29.18 N ATOM 177 CA LEU A 26 43.576 3.267 15.663 1.00 29.86 C ATOM 178 C LEU A 26 44.486 3.946 16.673 1.00 29.19 C ATOM 179 O LEU A 26 44.106 4.108 17.814 1.00 28.99 O ATOM 180 CB LEU A 26 42.609 4.300 15.072 1.00 29.66 C ATOM 181 CG LEU A 26 41.557 3.856 14.035 1.00 30.77 C ATOM 182 CD1 LEU A 26 40.434 4.908 13.847 1.00 30.92 C ATOM 183 CD2 LEU A 26 42.202 3.466 12.694 1.00 27.99 C ATOM 184 N PRO A 27 45.702 4.325 16.243 1.00 29.43 N ATOM 185 CA PRO A 27 46.613 5.010 17.136 1.00 28.76 C ATOM 186 C PRO A 27 45.953 6.335 17.515 1.00 29.09 C ATOM 187 O PRO A 27 45.323 6.993 16.657 1.00 26.55 O ATOM 188 CB PRO A 27 47.858 5.272 16.294 1.00 28.73 C ATOM 189 CG PRO A 27 47.625 4.631 14.968 1.00 30.10 C ATOM 190 CD PRO A 27 46.153 4.327 14.845 1.00 27.91 C ATOM 191 N SER A 28 46.081 6.671 18.784 1.00 27.84 N ATOM 192 CA SER A 28 45.475 7.871 19.388 1.00 30.30 C ATOM 193 C SER A 28 46.294 8.402 20.567 1.00 29.88 C ATOM 194 O SER A 28 46.800 7.644 21.422 1.00 31.12 O ATOM 195 CB SER A 28 44.037 7.609 19.854 1.00 29.63 C ATOM 196 OG SER A 28 43.378 8.820 20.202 1.00 29.22 O ATOM 197 N ASN A 29 46.425 9.726 20.609 1.00 29.29 N ATOM 198 CA ASN A 29 47.189 10.413 21.667 1.00 28.01 C ATOM 199 C ASN A 29 46.312 11.543 22.208 1.00 28.44 C ATOM 200 O ASN A 29 46.517 12.725 21.856 1.00 28.64 O ATOM 201 CB ASN A 29 48.501 10.979 21.106 1.00 26.29 C ATOM 202 CG ASN A 29 49.503 11.258 22.185 1.00 29.31 C ATOM 203 OD1 ASN A 29 49.169 11.201 23.387 1.00 25.65 O ATOM 204 ND2 ASN A 29 50.732 11.559 21.787 1.00 25.33 N ATOM 205 N PRO A 30 45.322 11.181 23.055 1.00 28.41 N ATOM 206 CA PRO A 30 44.318 12.114 23.523 1.00 27.98 C ATOM 207 C PRO A 30 44.863 13.213 24.438 1.00 27.63 C ATOM 208 O PRO A 30 44.206 14.229 24.590 1.00 28.73 O ATOM 209 CB PRO A 30 43.295 11.218 24.257 1.00 27.24 C ATOM 210 CG PRO A 30 44.016 9.943 24.549 1.00 28.66 C ATOM 211 CD PRO A 30 44.990 9.791 23.420 1.00 28.46 C ATOM 212 N THR A 31 46.057 13.058 25.005 1.00 26.65 N ATOM 213 CA THR A 31 46.608 14.165 25.809 1.00 26.42 C ATOM 214 C THR A 31 47.277 15.248 24.935 1.00 25.66 C ATOM 215 O THR A 31 47.852 16.215 25.435 1.00 25.39 O ATOM 216 CB THR A 31 47.502 13.663 27.010 1.00 27.09 C ATOM 217 OG1 THR A 31 48.541 12.838 26.502 1.00 28.46 O ATOM 218 CG2 THR A 31 46.675 12.811 27.948 1.00 30.32 C ATOM 219 N THR A 32 47.176 15.099 23.614 1.00 25.55 N ATOM 220 CA THR A 32 47.424 16.192 22.678 1.00 26.29 C ATOM 221 C THR A 32 46.123 17.003 22.470 1.00 26.56 C ATOM 222 O THR A 32 46.132 18.037 21.818 1.00 26.70 O ATOM 223 CB THR A 32 47.838 15.686 21.260 1.00 26.03 C ATOM 224 OG1 THR A 32 46.772 14.906 20.683 1.00 26.11 O ATOM 225 CG2 THR A 32 49.101 14.838 21.290 1.00 25.06 C ATOM 226 N GLY A 33 45.014 16.496 22.983 1.00 26.72 N ATOM 227 CA GLY A 33 43.695 17.060 22.713 1.00 28.70 C ATOM 228 C GLY A 33 43.031 16.525 21.457 1.00 29.76 C ATOM 229 O GLY A 33 41.838 16.753 21.249 1.00 31.75 O ATOM 230 N PHE A 34 43.790 15.832 20.615 1.00 29.82 N ATOM 231 CA PHE A 34 43.220 15.163 19.423 1.00 30.00 C ATOM 232 C PHE A 34 42.715 13.772 19.842 1.00 30.22 C ATOM 233 O PHE A 34 43.397 13.064 20.620 1.00 31.85 O ATOM 234 CB PHE A 34 44.295 15.006 18.333 1.00 28.79 C ATOM 235 CG PHE A 34 44.681 16.294 17.653 1.00 30.04 C ATOM 236 CD1 PHE A 34 44.208 16.580 16.384 1.00 31.40 C ATOM 237 CD2 PHE A 34 45.537 17.221 18.274 1.00 29.83 C ATOM 238 CE1 PHE A 34 44.562 17.755 15.735 1.00 30.24 C ATOM 239 CE2 PHE A 34 45.892 18.415 17.636 1.00 28.26 C ATOM 240 CZ PHE A 34 45.395 18.683 16.368 1.00 30.83 C ATOM 241 N ALA A 35 41.555 13.374 19.325 1.00 30.75 N ATOM 242 CA ALA A 35 41.145 11.968 19.340 1.00 30.33 C ATOM 243 C ALA A 35 40.196 11.691 18.194 1.00 30.48 C ATOM 244 O ALA A 35 39.919 12.565 17.370 1.00 31.04 O ATOM 245 CB ALA A 35 40.492 11.584 20.680 1.00 29.31 C ATOM 246 N TRP A 36 39.712 10.454 18.109 1.00 29.71 N ATOM 247 CA TRP A 36 38.967 10.060 16.905 1.00 29.80 C ATOM 248 C TRP A 36 37.492 10.281 17.169 1.00 30.22 C ATOM 249 O TRP A 36 36.985 9.826 18.188 1.00 30.38 O ATOM 250 CB TRP A 36 39.211 8.590 16.588 1.00 28.84 C ATOM 251 CG TRP A 36 40.556 8.347 16.125 1.00 28.36 C ATOM 252 CD1 TRP A 36 41.597 7.933 16.879 1.00 28.75 C ATOM 253 CD2 TRP A 36 41.043 8.486 14.790 1.00 27.61 C ATOM 254 NE1 TRP A 36 42.716 7.810 16.135 1.00 27.84 N ATOM 255 CE2 TRP A 36 42.407 8.110 14.821 1.00 28.77 C ATOM 256 CE3 TRP A 36 40.456 8.867 13.552 1.00 30.88 C ATOM 257 CZ2 TRP A 36 43.219 8.147 13.694 1.00 30.34 C ATOM 258 CZ3 TRP A 36 41.272 8.874 12.403 1.00 28.92 C ATOM 259 CH2 TRP A 36 42.653 8.534 12.492 1.00 27.21 C ATOM 260 N TYR A 37 36.820 11.007 16.260 1.00 31.06 N ATOM 261 CA TYR A 37 35.395 11.294 16.430 1.00 32.66 C ATOM 262 C TYR A 37 34.627 11.185 15.146 1.00 33.39 C ATOM 263 O TYR A 37 35.193 11.418 14.036 1.00 32.83 O ATOM 264 CB TYR A 37 35.188 12.727 16.935 1.00 32.59 C ATOM 265 CG TYR A 37 35.837 13.010 18.243 1.00 32.24 C ATOM 266 CD1 TYR A 37 35.151 12.758 19.446 1.00 31.93 C ATOM 267 CD2 TYR A 37 37.126 13.536 18.298 1.00 32.46 C ATOM 268 CE1 TYR A 37 35.739 12.996 20.651 1.00 34.66 C ATOM 269 CE2 TYR A 37 37.731 13.783 19.532 1.00 31.82 C ATOM 270 CZ TYR A 37 37.005 13.511 20.692 1.00 34.32 C ATOM 271 OH TYR A 37 37.557 13.745 21.900 1.00 36.93 O ATOM 272 N PHE A 38 33.332 10.874 15.288 1.00 34.56 N ATOM 273 CA PHE A 38 32.374 11.076 14.177 1.00 37.12 C ATOM 274 C PHE A 38 32.154 12.572 13.996 1.00 38.66 C ATOM 275 O PHE A 38 32.530 13.379 14.863 1.00 37.79 O ATOM 276 CB PHE A 38 31.053 10.355 14.448 1.00 36.77 C ATOM 277 CG PHE A 38 31.200 8.849 14.515 1.00 34.94 C ATOM 278 CD1 PHE A 38 31.362 8.206 15.750 1.00 31.54 C ATOM 279 CD2 PHE A 38 31.211 8.090 13.348 1.00 34.47 C ATOM 280 CE1 PHE A 38 31.520 6.815 15.813 1.00 30.36 C ATOM 281 CE2 PHE A 38 31.351 6.700 13.379 1.00 33.96 C ATOM 282 CZ PHE A 38 31.505 6.045 14.591 1.00 31.60 C ATOM 283 N GLU A 39 31.553 12.936 12.869 1.00 41.13 N ATOM 284 CA GLU A 39 31.302 14.343 12.560 1.00 43.71 C ATOM 285 C GLU A 39 30.579 14.997 13.726 1.00 43.31 C ATOM 286 O GLU A 39 29.645 14.426 14.265 1.00 44.59 O ATOM 287 CB GLU A 39 30.438 14.449 11.306 1.00 44.19 C ATOM 288 CG GLU A 39 30.267 15.871 10.787 1.00 48.77 C ATOM 289 CD GLU A 39 28.985 16.051 9.999 1.00 53.56 C ATOM 290 OE1 GLU A 39 28.798 15.346 8.976 1.00 54.25 O ATOM 291 OE2 GLU A 39 28.164 16.910 10.409 1.00 56.69 O ATOM 292 N GLY A 40 31.008 16.179 14.133 1.00 43.29 N ATOM 293 CA GLY A 40 30.316 16.863 15.227 1.00 42.96 C ATOM 294 C GLY A 40 31.065 16.728 16.542 1.00 42.52 C ATOM 295 O GLY A 40 30.865 17.498 17.493 1.00 43.47 O ATOM 296 N GLY A 41 31.947 15.743 16.596 1.00 41.55 N ATOM 297 CA GLY A 41 32.874 15.650 17.701 1.00 40.04 C ATOM 298 C GLY A 41 32.362 14.683 18.734 1.00 39.64 C ATOM 299 O GLY A 41 32.554 14.892 19.915 1.00 38.53 O ATOM 300 N THR A 42 31.698 13.621 18.283 1.00 38.59 N ATOM 301 CA THR A 42 31.175 12.630 19.205 1.00 38.15 C ATOM 302 C THR A 42 31.703 11.241 18.888 1.00 37.77 C ATOM 303 O THR A 42 32.065 10.972 17.748 1.00 34.96 O ATOM 304 CB THR A 42 29.637 12.628 19.179 1.00 39.33 C ATOM 305 OG1 THR A 42 29.144 11.687 20.137 1.00 40.51 O ATOM 306 CG2 THR A 42 29.133 12.257 17.789 1.00 39.35 C ATOM 307 N LYS A 43 31.718 10.370 19.895 1.00 38.06 N ATOM 308 CA LYS A 43 32.062 8.955 19.729 1.00 39.98 C ATOM 309 C LYS A 43 30.832 8.111 19.346 1.00 41.78 C ATOM 310 O LYS A 43 30.937 6.898 19.142 1.00 42.02 O ATOM 311 CB LYS A 43 32.693 8.405 21.016 1.00 40.27 C ATOM 312 CG LYS A 43 33.888 9.225 21.563 1.00 40.00 C ATOM 313 CD LYS A 43 35.157 8.984 20.784 1.00 39.53 C ATOM 314 CE LYS A 43 36.344 9.322 21.652 1.00 40.66 C ATOM 315 NZ LYS A 43 37.567 9.572 20.889 1.00 45.25 N ATOM 316 N GLU A 44 29.669 8.759 19.237 1.00 43.31 N ATOM 317 CA GLU A 44 28.408 8.048 19.017 1.00 44.10 C ATOM 318 C GLU A 44 28.096 7.896 17.552 1.00 43.76 C ATOM 319 O GLU A 44 28.338 8.809 16.768 1.00 41.77 O ATOM 320 CB GLU A 44 27.235 8.751 19.732 1.00 45.11 C ATOM 321 CG GLU A 44 27.276 8.714 21.275 1.00 49.58 C ATOM 322 CD GLU A 44 27.599 7.329 21.864 1.00 55.33 C ATOM 323 OE1 GLU A 44 27.312 6.279 21.226 1.00 56.67 O ATOM 324 OE2 GLU A 44 28.150 7.295 22.987 1.00 57.93 O ATOM 325 N SER A 45 27.574 6.720 17.203 1.00 43.64 N ATOM 326 CA SER A 45 27.053 6.445 15.888 1.00 44.68 C ATOM 327 C SER A 45 26.211 7.611 15.383 1.00 45.06 C ATOM 328 O SER A 45 25.343 8.096 16.099 1.00 45.28 O ATOM 329 CB SER A 45 26.201 5.181 15.931 1.00 44.03 C ATOM 330 OG SER A 45 25.662 4.922 14.654 1.00 45.70 O ATOM 331 N PRO A 46 26.450 8.048 14.137 1.00 45.64 N ATOM 332 CA PRO A 46 25.593 9.055 13.514 1.00 45.96 C ATOM 333 C PRO A 46 24.181 8.533 13.206 1.00 46.08 C ATOM 334 O PRO A 46 23.250 9.333 13.113 1.00 46.62 O ATOM 335 CB PRO A 46 26.328 9.388 12.214 1.00 46.17 C ATOM 336 CG PRO A 46 27.722 8.747 12.355 1.00 45.87 C ATOM 337 CD PRO A 46 27.471 7.556 13.190 1.00 46.11 C ATOM 338 N AASN A 47 24.029 7.213 13.099 0.50 45.71 N ATOM 339 N BASN A 47 24.033 7.221 13.014 0.50 46.02 N ATOM 340 CA AASN A 47 22.713 6.594 12.927 0.50 45.36 C ATOM 341 CA BASN A 47 22.702 6.600 12.905 0.50 45.94 C ATOM 342 C AASN A 47 22.599 5.249 13.644 0.50 45.59 C ATOM 343 C BASN A 47 22.574 5.246 13.626 0.50 45.90 C ATOM 344 O AASN A 47 22.978 4.186 13.084 0.50 45.53 O ATOM 345 O BASN A 47 22.919 4.180 13.056 0.50 45.76 O ATOM 346 CB AASN A 47 22.400 6.413 11.446 0.50 44.77 C ATOM 347 CB BASN A 47 22.209 6.500 11.445 0.50 45.71 C ATOM 348 CG AASN A 47 20.923 6.197 11.184 0.50 43.54 C ATOM 349 CG BASN A 47 23.342 6.551 10.412 0.50 45.93 C ATOM 350 OD1AASN A 47 20.199 5.644 12.011 0.50 40.40 O ATOM 351 OD1BASN A 47 23.761 7.628 9.984 0.50 45.57 O ATOM 352 ND2AASN A 47 20.471 6.629 10.019 0.50 43.29 N ATOM 353 ND2BASN A 47 23.799 5.385 9.972 0.50 45.19 N ATOM 354 N GLU A 48 22.063 5.306 14.871 1.00 45.70 N ATOM 355 CA GLU A 48 21.903 4.111 15.746 1.00 46.19 C ATOM 356 C GLU A 48 21.103 2.962 15.115 1.00 45.31 C ATOM 357 O GLU A 48 21.172 1.822 15.591 1.00 44.93 O ATOM 358 CB GLU A 48 21.233 4.480 17.090 1.00 46.22 C ATOM 359 CG GLU A 48 22.003 5.413 18.011 1.00 50.10 C ATOM 360 CD GLU A 48 23.282 4.800 18.630 1.00 54.61 C ATOM 361 OE1 GLU A 48 23.408 3.547 18.676 1.00 55.79 O ATOM 362 OE2 GLU A 48 24.162 5.590 19.076 1.00 54.23 O ATOM 363 N SER A 49 20.353 3.281 14.052 1.00 44.97 N ATOM 364 CA SER A 49 19.557 2.323 13.294 1.00 44.26 C ATOM 365 C SER A 49 20.407 1.446 12.405 1.00 43.50 C ATOM 366 O SER A 49 19.988 0.350 12.022 1.00 42.99 O ATOM 367 CB SER A 49 18.569 3.057 12.386 1.00 44.50 C ATOM 368 OG SER A 49 17.509 3.614 13.135 1.00 46.92 O ATOM 369 N MET A 50 21.575 1.949 12.035 1.00 41.81 N ATOM 370 CA MET A 50 22.426 1.249 11.099 1.00 40.96 C ATOM 371 C MET A 50 23.546 0.505 11.817 1.00 39.88 C ATOM 372 O MET A 50 23.829 -0.665 11.503 1.00 39.40 O ATOM 373 CB MET A 50 22.967 2.231 10.062 1.00 41.34 C ATOM 374 CG MET A 50 21.864 3.025 9.353 1.00 43.61 C ATOM 375 SD MET A 50 20.961 2.032 8.122 1.00 49.10 S ATOM 376 CE MET A 50 19.444 1.632 8.984 1.00 48.77 C ATOM 377 N PHE A 51 24.143 1.173 12.810 1.00 37.92 N ATOM 378 CA PHE A 51 25.186 0.567 13.625 1.00 36.68 C ATOM 379 C PHE A 51 25.327 1.284 14.950 1.00 36.24 C ATOM 380 O PHE A 51 25.098 2.496 15.050 1.00 35.14 O ATOM 381 CB PHE A 51 26.548 0.511 12.887 1.00 36.34 C ATOM 382 CG PHE A 51 27.112 1.865 12.504 1.00 36.10 C ATOM 383 CD1 PHE A 51 27.929 2.580 13.388 1.00 39.82 C ATOM 384 CD2 PHE A 51 26.846 2.409 11.240 1.00 41.16 C ATOM 385 CE1 PHE A 51 28.445 3.826 13.036 1.00 38.08 C ATOM 386 CE2 PHE A 51 27.369 3.653 10.874 1.00 40.19 C ATOM 387 CZ PHE A 51 28.172 4.354 11.761 1.00 39.77 C ATOM 388 N THR A 52 25.821 0.525 15.887 1.00 35.84 N ATOM 389 CA THR A 52 26.027 0.907 17.256 1.00 35.82 C ATOM 390 C THR A 52 27.527 0.920 17.517 1.00 34.75 C ATOM 391 O THR A 52 28.219 0.123 16.927 1.00 34.13 O ATOM 392 CB THR A 52 25.326 -0.170 18.074 1.00 36.19 C ATOM 393 OG1 THR A 52 23.990 0.244 18.284 1.00 38.76 O ATOM 394 CG2 THR A 52 25.978 -0.475 19.301 1.00 36.57 C ATOM 395 N VAL A 53 28.006 1.814 18.390 1.00 33.52 N ATOM 396 CA VAL A 53 29.438 1.912 18.591 1.00 33.10 C ATOM 397 C VAL A 53 29.750 2.004 20.075 1.00 33.34 C ATOM 398 O VAL A 53 29.194 2.879 20.742 1.00 34.63 O ATOM 399 CB VAL A 53 30.020 3.173 17.944 1.00 32.51 C ATOM 400 CG1 VAL A 53 31.543 3.274 18.259 1.00 33.03 C ATOM 401 CG2 VAL A 53 29.771 3.182 16.402 1.00 30.49 C ATOM 402 N GLU A 54 30.655 1.148 20.571 1.00 33.77 N ATOM 403 CA GLU A 54 31.306 1.375 21.879 1.00 34.29 C ATOM 404 C GLU A 54 32.751 1.787 21.695 1.00 34.61 C ATOM 405 O GLU A 54 33.447 1.228 20.884 1.00 34.87 O ATOM 406 CB GLU A 54 31.320 0.120 22.759 1.00 35.34 C ATOM 407 CG GLU A 54 29.993 -0.616 22.841 1.00 37.67 C ATOM 408 CD GLU A 54 29.859 -1.482 24.105 1.00 42.69 C ATOM 409 OE1 GLU A 54 30.879 -1.843 24.755 1.00 42.60 O ATOM 410 OE2 GLU A 54 28.697 -1.797 24.456 1.00 46.00 O ATOM 411 N ASN A 55 33.230 2.696 22.514 1.00 34.91 N ATOM 412 CA ASN A 55 34.604 3.157 22.342 1.00 36.37 C ATOM 413 C ASN A 55 35.435 2.953 23.628 1.00 34.96 C ATOM 414 O ASN A 55 34.940 3.123 24.761 1.00 35.08 O ATOM 415 CB ASN A 55 34.573 4.576 21.748 1.00 36.00 C ATOM 416 CG ASN A 55 35.798 5.389 22.068 1.00 41.06 C ATOM 417 OD1 ASN A 55 35.837 6.060 23.109 1.00 46.44 O ATOM 418 ND2 ASN A 55 36.805 5.363 21.177 1.00 41.79 N ATOM 419 N LYS A 56 36.686 2.525 23.477 1.00 34.18 N ATOM 420 CA LYS A 56 37.549 2.386 24.664 1.00 34.51 C ATOM 421 C LYS A 56 38.968 2.816 24.290 1.00 34.45 C ATOM 422 O LYS A 56 39.450 2.449 23.223 1.00 35.31 O ATOM 423 CB LYS A 56 37.519 0.944 25.189 1.00 34.64 C ATOM 424 CG LYS A 56 38.294 0.766 26.505 1.00 38.63 C ATOM 425 CD LYS A 56 38.363 -0.676 27.007 1.00 41.08 C ATOM 426 CE LYS A 56 37.083 -1.133 27.697 1.00 44.59 C ATOM 427 NZ LYS A 56 37.487 -2.027 28.837 1.00 43.49 N ATOM 428 N TYR A 57 39.597 3.615 25.140 1.00 33.47 N ATOM 429 CA TYR A 57 40.972 4.040 24.931 1.00 32.09 C ATOM 430 C TYR A 57 41.923 3.230 25.797 1.00 31.85 C ATOM 431 O TYR A 57 41.718 3.105 27.007 1.00 32.02 O ATOM 432 CB TYR A 57 41.144 5.550 25.198 1.00 32.29 C ATOM 433 CG TYR A 57 42.593 5.998 25.119 1.00 30.67 C ATOM 434 CD1 TYR A 57 43.284 5.880 23.961 1.00 27.79 C ATOM 435 CD2 TYR A 57 43.283 6.459 26.249 1.00 28.73 C ATOM 436 CE1 TYR A 57 44.610 6.271 23.862 1.00 27.80 C ATOM 437 CE2 TYR A 57 44.626 6.841 26.177 1.00 25.62 C ATOM 438 CZ TYR A 57 45.291 6.728 24.953 1.00 29.44 C ATOM 439 OH TYR A 57 46.605 7.084 24.790 1.00 32.34 O ATOM 440 N PHE A 58 42.953 2.665 25.171 1.00 31.29 N ATOM 441 CA PHE A 58 44.005 1.925 25.878 1.00 32.29 C ATOM 442 C PHE A 58 45.273 2.752 25.816 1.00 32.86 C ATOM 443 O PHE A 58 45.833 2.934 24.743 1.00 32.87 O ATOM 444 CB PHE A 58 44.282 0.547 25.263 1.00 32.37 C ATOM 445 CG PHE A 58 43.147 -0.462 25.426 1.00 35.07 C ATOM 446 CD1 PHE A 58 41.954 -0.319 24.724 1.00 35.63 C ATOM 447 CD2 PHE A 58 43.315 -1.596 26.197 1.00 38.42 C ATOM 448 CE1 PHE A 58 40.916 -1.262 24.840 1.00 36.91 C ATOM 449 CE2 PHE A 58 42.265 -2.567 26.324 1.00 40.70 C ATOM 450 CZ PHE A 58 41.068 -2.385 25.629 1.00 38.30 C ATOM 451 N PRO A 59 45.718 3.270 26.981 1.00 32.81 N ATOM 452 CA PRO A 59 47.000 3.940 27.136 1.00 32.21 C ATOM 453 C PRO A 59 48.120 2.904 26.986 1.00 31.76 C ATOM 454 O PRO A 59 47.881 1.714 27.233 1.00 31.19 O ATOM 455 CB PRO A 59 46.946 4.438 28.580 1.00 32.65 C ATOM 456 CG PRO A 59 45.484 4.289 29.007 1.00 32.73 C ATOM 457 CD PRO A 59 44.984 3.161 28.254 1.00 32.71 C ATOM 458 N PRO A 60 49.328 3.339 26.557 1.00 31.84 N ATOM 459 CA PRO A 60 50.480 2.455 26.686 1.00 32.17 C ATOM 460 C PRO A 60 50.722 2.228 28.168 1.00 32.46 C ATOM 461 O PRO A 60 50.373 3.093 28.975 1.00 31.05 O ATOM 462 CB PRO A 60 51.629 3.296 26.090 1.00 32.78 C ATOM 463 CG PRO A 60 51.245 4.702 26.342 1.00 31.26 C ATOM 464 CD PRO A 60 49.723 4.706 26.160 1.00 31.38 C ATOM 465 N ASP A 61 51.282 1.075 28.540 1.00 32.75 N ATOM 466 CA ASP A 61 51.711 0.880 29.902 1.00 32.98 C ATOM 467 C ASP A 61 53.135 1.458 29.965 1.00 32.77 C ATOM 468 O ASP A 61 54.129 0.721 29.956 1.00 32.95 O ATOM 469 CB ASP A 61 51.646 -0.589 30.312 1.00 33.93 C ATOM 470 CG ASP A 61 51.793 -0.775 31.793 1.00 36.77 C ATOM 471 OD1 ASP A 61 51.661 -1.914 32.278 1.00 42.52 O ATOM 472 OD2 ASP A 61 52.050 0.220 32.511 1.00 41.67 O ATOM 473 N SER A 62 53.199 2.789 29.988 1.00 31.25 N ATOM 474 CA SER A 62 54.439 3.565 29.971 1.00 30.74 C ATOM 475 C SER A 62 54.231 4.826 30.822 1.00 30.58 C ATOM 476 O SER A 62 53.130 5.343 30.888 1.00 29.35 O ATOM 477 CB SER A 62 54.781 3.995 28.538 1.00 30.30 C ATOM 478 OG SER A 62 55.894 4.887 28.552 1.00 29.82 O ATOM 479 N LYS A 63 55.292 5.280 31.491 1.00 30.08 N ATOM 480 CA LYS A 63 55.270 6.527 32.251 1.00 29.83 C ATOM 481 C LYS A 63 55.666 7.766 31.430 1.00 29.45 C ATOM 482 O LYS A 63 55.626 8.882 31.952 1.00 29.18 O ATOM 483 CB LYS A 63 56.142 6.405 33.506 1.00 30.90 C ATOM 484 CG LYS A 63 55.517 5.500 34.560 1.00 31.28 C ATOM 485 CD LYS A 63 56.272 5.626 35.910 1.00 37.62 C ATOM 486 CE LYS A 63 55.300 5.660 37.084 1.00 40.59 C ATOM 487 NZ LYS A 63 53.994 4.989 36.739 1.00 42.42 N ATOM 488 N LEU A 64 56.024 7.571 30.152 1.00 27.36 N ATOM 489 CA LEU A 64 56.363 8.681 29.265 1.00 26.78 C ATOM 490 C LEU A 64 55.177 9.567 29.059 1.00 26.85 C ATOM 491 O LEU A 64 54.122 9.067 28.630 1.00 27.07 O ATOM 492 CB LEU A 64 56.782 8.181 27.900 1.00 25.75 C ATOM 493 CG LEU A 64 58.216 7.740 27.761 1.00 25.74 C ATOM 494 CD1 LEU A 64 58.382 7.132 26.347 1.00 25.20 C ATOM 495 CD2 LEU A 64 59.169 8.921 27.992 1.00 25.99 C ATOM 496 N LEU A 65 55.320 10.864 29.357 1.00 26.26 N ATOM 497 CA LEU A 65 54.215 11.808 29.091 1.00 27.06 C ATOM 498 C LEU A 65 54.202 12.155 27.619 1.00 26.92 C ATOM 499 O LEU A 65 55.183 12.724 27.111 1.00 25.94 O ATOM 500 CB LEU A 65 54.304 13.077 29.940 1.00 26.71 C ATOM 501 CG LEU A 65 54.138 13.130 31.469 1.00 29.67 C ATOM 502 CD1 LEU A 65 52.994 12.190 31.834 1.00 29.53 C ATOM 503 CD2 LEU A 65 55.359 12.781 32.234 1.00 30.51 C ATOM 504 N GLY A 66 53.095 11.818 26.946 1.00 26.49 N ATOM 505 CA GLY A 66 52.915 12.056 25.501 1.00 27.02 C ATOM 506 C GLY A 66 53.101 10.822 24.642 1.00 28.17 C ATOM 507 O GLY A 66 53.035 10.922 23.443 1.00 28.92 O ATOM 508 N ALA A 67 53.377 9.674 25.259 1.00 29.41 N ATOM 509 CA ALA A 67 53.387 8.385 24.567 1.00 29.38 C ATOM 510 C ALA A 67 51.948 8.045 24.109 1.00 29.57 C ATOM 511 O ALA A 67 51.036 7.975 24.911 1.00 30.59 O ATOM 512 CB ALA A 67 53.953 7.302 25.484 1.00 28.71 C ATOM 513 N GLY A 68 51.731 7.867 22.811 1.00 28.98 N ATOM 514 CA GLY A 68 50.369 7.541 22.361 1.00 27.86 C ATOM 515 C GLY A 68 49.929 6.118 22.645 1.00 28.28 C ATOM 516 O GLY A 68 50.755 5.190 22.771 1.00 27.52 O ATOM 517 N GLY A 69 48.614 5.940 22.699 1.00 28.54 N ATOM 518 CA GLY A 69 48.011 4.634 22.847 1.00 29.93 C ATOM 519 C GLY A 69 47.143 4.287 21.659 1.00 31.28 C ATOM 520 O GLY A 69 47.409 4.696 20.516 1.00 30.27 O ATOM 521 N THR A 70 46.094 3.512 21.934 1.00 31.67 N ATOM 522 CA THR A 70 45.230 2.989 20.901 1.00 30.96 C ATOM 523 C THR A 70 43.773 3.139 21.320 1.00 30.57 C ATOM 524 O THR A 70 43.408 2.717 22.429 1.00 30.34 O ATOM 525 CB THR A 70 45.517 1.496 20.716 1.00 31.95 C ATOM 526 OG1 THR A 70 46.913 1.328 20.448 1.00 32.99 O ATOM 527 CG2 THR A 70 44.753 0.943 19.543 1.00 30.73 C ATOM 528 N GLU A 71 42.969 3.755 20.457 1.00 30.09 N ATOM 529 CA GLU A 71 41.520 3.806 20.630 1.00 29.74 C ATOM 530 C GLU A 71 40.915 2.604 19.947 1.00 29.31 C ATOM 531 O GLU A 71 41.260 2.292 18.775 1.00 28.24 O ATOM 532 CB GLU A 71 40.897 5.062 20.041 1.00 30.16 C ATOM 533 CG GLU A 71 41.100 6.319 20.863 1.00 37.88 C ATOM 534 CD GLU A 71 40.174 7.464 20.420 1.00 41.74 C ATOM 535 OE1 GLU A 71 40.730 8.467 19.944 1.00 40.37 O ATOM 536 OE2 GLU A 71 38.914 7.345 20.558 1.00 44.36 O ATOM 537 N HIS A 72 40.038 1.922 20.669 1.00 29.88 N ATOM 538 CA HIS A 72 39.225 0.862 20.077 1.00 30.89 C ATOM 539 C HIS A 72 37.844 1.410 19.790 1.00 30.84 C ATOM 540 O HIS A 72 37.296 2.164 20.594 1.00 30.46 O ATOM 541 CB HIS A 72 39.110 -0.328 21.031 1.00 29.83 C ATOM 542 CG HIS A 72 40.417 -0.973 21.334 1.00 30.86 C ATOM 543 ND1 HIS A 72 40.553 -2.328 21.509 1.00 30.58 N ATOM 544 CD2 HIS A 72 41.659 -0.448 21.480 1.00 31.51 C ATOM 545 CE1 HIS A 72 41.815 -2.618 21.756 1.00 33.14 C ATOM 546 NE2 HIS A 72 42.507 -1.490 21.756 1.00 34.86 N ATOM 547 N PHE A 73 37.278 1.031 18.660 1.00 30.72 N ATOM 548 CA PHE A 73 35.846 1.237 18.448 1.00 31.03 C ATOM 549 C PHE A 73 35.281 -0.133 18.202 1.00 31.05 C ATOM 550 O PHE A 73 35.737 -0.831 17.313 1.00 30.81 O ATOM 551 CB PHE A 73 35.554 2.121 17.241 1.00 29.23 C ATOM 552 CG PHE A 73 35.957 3.570 17.416 1.00 31.03 C ATOM 553 CD1 PHE A 73 34.988 4.532 17.705 1.00 30.16 C ATOM 554 CD2 PHE A 73 37.279 3.985 17.217 1.00 30.14 C ATOM 555 CE1 PHE A 73 35.333 5.885 17.869 1.00 34.53 C ATOM 556 CE2 PHE A 73 37.635 5.355 17.368 1.00 32.84 C ATOM 557 CZ PHE A 73 36.647 6.303 17.708 1.00 31.34 C ATOM 558 N HIS A 74 34.353 -0.551 19.058 1.00 30.79 N ATOM 559 CA HIS A 74 33.742 -1.830 18.910 1.00 31.30 C ATOM 560 C HIS A 74 32.374 -1.538 18.299 1.00 32.31 C ATOM 561 O HIS A 74 31.494 -0.961 18.956 1.00 31.60 O ATOM 562 CB HIS A 74 33.716 -2.569 20.253 1.00 31.59 C ATOM 563 CG HIS A 74 35.081 -2.735 20.873 1.00 30.70 C ATOM 564 ND1 HIS A 74 35.276 -2.711 22.231 1.00 28.19 N ATOM 565 CD2 HIS A 74 36.305 -2.945 20.326 1.00 29.31 C ATOM 566 CE1 HIS A 74 36.565 -2.859 22.502 1.00 29.11 C ATOM 567 NE2 HIS A 74 37.217 -2.990 21.361 1.00 26.70 N ATOM 568 N VAL A 75 32.244 -1.881 17.017 1.00 32.50 N ATOM 569 CA VAL A 75 31.094 -1.446 16.189 1.00 33.56 C ATOM 570 C VAL A 75 30.143 -2.602 15.874 1.00 34.25 C ATOM 571 O VAL A 75 30.561 -3.614 15.323 1.00 35.54 O ATOM 572 CB VAL A 75 31.560 -0.781 14.866 1.00 33.73 C ATOM 573 CG1 VAL A 75 30.364 -0.440 13.962 1.00 31.88 C ATOM 574 CG2 VAL A 75 32.407 0.475 15.162 1.00 32.90 C ATOM 575 N THR A 76 28.869 -2.447 16.205 1.00 34.78 N ATOM 576 CA THR A 76 27.871 -3.470 15.817 1.00 35.64 C ATOM 577 C THR A 76 26.891 -2.995 14.742 1.00 36.28 C ATOM 578 O THR A 76 26.189 -1.984 14.921 1.00 35.75 O ATOM 579 CB THR A 76 27.093 -3.986 17.012 1.00 35.35 C ATOM 580 OG1 THR A 76 27.992 -4.249 18.090 1.00 33.86 O ATOM 581 CG2 THR A 76 26.410 -5.282 16.657 1.00 35.67 C ATOM 582 N VAL A 77 26.858 -3.731 13.629 1.00 37.39 N ATOM 583 CA VAL A 77 25.901 -3.461 12.552 1.00 38.22 C ATOM 584 C VAL A 77 24.481 -3.920 12.958 1.00 39.30 C ATOM 585 O VAL A 77 24.300 -5.018 13.517 1.00 38.64 O ATOM 586 CB VAL A 77 26.371 -4.039 11.208 1.00 38.56 C ATOM 587 CG1 VAL A 77 25.247 -4.036 10.194 1.00 37.11 C ATOM 588 CG2 VAL A 77 27.552 -3.210 10.704 1.00 37.73 C ATOM 589 N LYS A 78 23.503 -3.048 12.690 1.00 40.19 N ATOM 590 CA LYS A 78 22.112 -3.243 13.112 1.00 41.23 C ATOM 591 C LYS A 78 21.216 -3.612 11.937 1.00 41.72 C ATOM 592 O LYS A 78 20.146 -4.211 12.128 1.00 41.95 O ATOM 593 CB LYS A 78 21.571 -1.966 13.769 1.00 41.21 C ATOM 594 CG LYS A 78 22.325 -1.534 15.006 1.00 43.28 C ATOM 595 CD LYS A 78 21.907 -2.340 16.227 1.00 46.53 C ATOM 596 CE LYS A 78 22.571 -3.721 16.277 1.00 48.33 C ATOM 597 NZ LYS A 78 22.253 -4.433 17.571 1.00 49.57 N ATOM 598 N ALA A 79 21.650 -3.235 10.734 1.00 41.62 N ATOM 599 CA ALA A 79 20.824 -3.346 9.533 1.00 41.82 C ATOM 600 C ALA A 79 21.628 -3.809 8.319 1.00 41.62 C ATOM 601 O ALA A 79 22.822 -3.508 8.207 1.00 42.00 O ATOM 602 CB ALA A 79 20.166 -2.002 9.233 1.00 41.87 C ATOM 603 N ALA A 80 20.973 -4.534 7.416 1.00 40.71 N ATOM 604 CA ALA A 80 21.553 -4.868 6.109 1.00 40.13 C ATOM 605 C ALA A 80 21.852 -3.585 5.340 1.00 39.79 C ATOM 606 O ALA A 80 21.208 -2.557 5.561 1.00 40.59 O ATOM 607 CB ALA A 80 20.606 -5.773 5.307 1.00 40.07 C ATOM 608 N GLY A 81 22.840 -3.638 4.450 1.00 38.70 N ATOM 609 CA GLY A 81 23.326 -2.446 3.775 1.00 37.34 C ATOM 610 C GLY A 81 24.825 -2.255 3.916 1.00 36.40 C ATOM 611 O GLY A 81 25.518 -3.017 4.608 1.00 36.78 O ATOM 612 N THR A 82 25.330 -1.238 3.233 1.00 35.89 N ATOM 613 CA THR A 82 26.713 -0.829 3.372 1.00 35.49 C ATOM 614 C THR A 82 26.700 0.454 4.183 1.00 35.90 C ATOM 615 O THR A 82 26.013 1.419 3.834 1.00 36.74 O ATOM 616 CB THR A 82 27.361 -0.554 2.013 1.00 36.29 C ATOM 617 OG1 THR A 82 27.248 -1.729 1.188 1.00 35.10 O ATOM 618 CG2 THR A 82 28.810 -0.170 2.191 1.00 35.34 C ATOM 619 N HIS A 83 27.476 0.459 5.248 1.00 35.22 N ATOM 620 CA HIS A 83 27.443 1.546 6.233 1.00 34.91 C ATOM 621 C HIS A 83 28.841 2.073 6.406 1.00 33.38 C ATOM 622 O HIS A 83 29.747 1.327 6.735 1.00 33.76 O ATOM 623 CB HIS A 83 26.918 1.045 7.572 1.00 36.45 C ATOM 624 CG HIS A 83 25.639 0.287 7.467 1.00 38.33 C ATOM 625 ND1 HIS A 83 24.468 0.870 7.032 1.00 40.42 N ATOM 626 CD2 HIS A 83 25.349 -1.010 7.725 1.00 40.14 C ATOM 627 CE1 HIS A 83 23.507 -0.036 7.036 1.00 43.56 C ATOM 628 NE2 HIS A 83 24.016 -1.183 7.454 1.00 43.55 N ATOM 629 N ALA A 84 29.015 3.359 6.154 1.00 32.41 N ATOM 630 CA ALA A 84 30.323 3.986 6.242 1.00 32.16 C ATOM 631 C ALA A 84 30.570 4.475 7.656 1.00 31.86 C ATOM 632 O ALA A 84 29.749 5.206 8.230 1.00 32.64 O ATOM 633 CB ALA A 84 30.404 5.148 5.254 1.00 30.88 C ATOM 634 N VAL A 85 31.673 4.026 8.242 1.00 30.95 N ATOM 635 CA VAL A 85 32.109 4.465 9.558 1.00 31.03 C ATOM 636 C VAL A 85 33.194 5.497 9.312 1.00 31.39 C ATOM 637 O VAL A 85 34.299 5.125 8.935 1.00 32.43 O ATOM 638 CB VAL A 85 32.737 3.281 10.327 1.00 30.79 C ATOM 639 CG1 VAL A 85 33.324 3.732 11.730 1.00 30.53 C ATOM 640 CG2 VAL A 85 31.720 2.132 10.455 1.00 31.72 C ATOM 641 N ASN A 86 32.876 6.784 9.479 1.00 32.42 N ATOM 642 CA ASN A 86 33.747 7.875 9.023 1.00 31.55 C ATOM 643 C ASN A 86 34.259 8.600 10.272 1.00 31.38 C ATOM 644 O ASN A 86 33.479 9.229 11.017 1.00 31.12 O ATOM 645 CB ASN A 86 32.992 8.865 8.125 1.00 31.14 C ATOM 646 CG ASN A 86 32.467 8.243 6.834 1.00 32.94 C ATOM 647 OD1 ASN A 86 33.189 7.559 6.133 1.00 28.17 O ATOM 648 ND2 ASN A 86 31.214 8.525 6.506 1.00 31.40 N ATOM 649 N LEU A 87 35.563 8.482 10.535 1.00 30.69 N ATOM 650 CA LEU A 87 36.181 9.113 11.707 1.00 30.83 C ATOM 651 C LEU A 87 37.206 10.128 11.277 1.00 30.51 C ATOM 652 O LEU A 87 37.811 10.033 10.176 1.00 29.96 O ATOM 653 CB LEU A 87 36.818 8.072 12.651 1.00 31.39 C ATOM 654 CG LEU A 87 35.839 6.994 13.129 1.00 31.59 C ATOM 655 CD1 LEU A 87 36.520 5.699 13.569 1.00 32.10 C ATOM 656 CD2 LEU A 87 34.884 7.542 14.214 1.00 31.83 C ATOM 657 N THR A 88 37.344 11.137 12.119 1.00 29.50 N ATOM 658 CA THR A 88 38.354 12.172 11.997 1.00 29.77 C ATOM 659 C THR A 88 39.117 12.326 13.331 1.00 30.23 C ATOM 660 O THR A 88 38.511 12.343 14.411 1.00 31.28 O ATOM 661 CB THR A 88 37.683 13.504 11.593 1.00 29.79 C ATOM 662 OG1 THR A 88 36.948 13.312 10.370 1.00 29.49 O ATOM 663 CG2 THR A 88 38.726 14.609 11.394 1.00 30.09 C ATOM 664 N TYR A 89 40.440 12.425 13.223 1.00 29.58 N ATOM 665 CA TYR A 89 41.317 12.635 14.338 1.00 30.27 C ATOM 666 C TYR A 89 41.390 14.142 14.497 1.00 29.99 C ATOM 667 O TYR A 89 41.906 14.849 13.630 1.00 28.77 O ATOM 668 CB TYR A 89 42.701 12.049 14.058 1.00 29.54 C ATOM 669 CG TYR A 89 43.633 11.981 15.241 1.00 30.38 C ATOM 670 CD1 TYR A 89 43.319 11.198 16.370 1.00 29.00 C ATOM 671 CD2 TYR A 89 44.863 12.651 15.226 1.00 30.41 C ATOM 672 CE1 TYR A 89 44.203 11.115 17.482 1.00 30.35 C ATOM 673 CE2 TYR A 89 45.759 12.572 16.317 1.00 30.63 C ATOM 674 CZ TYR A 89 45.426 11.804 17.444 1.00 26.83 C ATOM 675 OH TYR A 89 46.277 11.691 18.524 1.00 33.60 O ATOM 676 N MET A 90 40.826 14.647 15.578 1.00 29.11 N ATOM 677 CA MET A 90 40.697 16.099 15.729 1.00 29.17 C ATOM 678 C MET A 90 40.431 16.506 17.152 1.00 29.04 C ATOM 679 O MET A 90 40.066 15.684 17.998 1.00 28.75 O ATOM 680 CB MET A 90 39.547 16.654 14.885 1.00 31.03 C ATOM 681 CG MET A 90 38.211 16.022 15.229 1.00 33.49 C ATOM 682 SD MET A 90 36.863 16.631 14.181 1.00 41.77 S ATOM 683 CE MET A 90 35.518 15.858 15.042 1.00 38.85 C ATOM 684 N ARG A 91 40.639 17.789 17.397 1.00 27.93 N ATOM 685 CA ARG A 91 40.176 18.406 18.608 1.00 27.75 C ATOM 686 C ARG A 91 38.671 18.657 18.497 1.00 27.89 C ATOM 687 O ARG A 91 38.237 19.504 17.738 1.00 29.57 O ATOM 688 CB ARG A 91 40.953 19.690 18.885 1.00 27.56 C ATOM 689 CG ARG A 91 42.456 19.466 18.950 1.00 28.61 C ATOM 690 CD ARG A 91 43.028 20.354 19.953 1.00 29.39 C ATOM 691 NE ARG A 91 44.396 20.012 20.363 1.00 29.69 N ATOM 692 CZ ARG A 91 45.430 20.827 20.172 1.00 28.03 C ATOM 693 NH1 ARG A 91 45.239 21.978 19.539 1.00 30.79 N ATOM 694 NH2 ARG A 91 46.640 20.486 20.574 1.00 23.20 N ATOM 695 N PRO A 92 37.876 17.923 19.278 1.00 29.14 N ATOM 696 CA PRO A 92 36.425 17.933 19.175 1.00 29.39 C ATOM 697 C PRO A 92 35.802 19.303 19.402 1.00 30.49 C ATOM 698 O PRO A 92 34.676 19.506 19.011 1.00 32.07 O ATOM 699 CB PRO A 92 36.005 16.949 20.263 1.00 30.39 C ATOM 700 CG PRO A 92 37.039 17.179 21.378 1.00 30.04 C ATOM 701 CD PRO A 92 38.335 17.343 20.561 1.00 28.44 C ATOM 702 N TRP A 93 36.505 20.258 20.012 1.00 30.99 N ATOM 703 CA TRP A 93 35.966 21.613 20.194 1.00 30.70 C ATOM 704 C TRP A 93 36.341 22.535 19.032 1.00 32.00 C ATOM 705 O TRP A 93 35.857 23.673 18.933 1.00 31.49 O ATOM 706 CB TRP A 93 36.422 22.224 21.533 1.00 30.69 C ATOM 707 CG TRP A 93 37.885 22.521 21.602 1.00 28.40 C ATOM 708 CD1 TRP A 93 38.510 23.701 21.263 1.00 29.17 C ATOM 709 CD2 TRP A 93 38.915 21.635 22.050 1.00 24.85 C ATOM 710 NE1 TRP A 93 39.870 23.580 21.441 1.00 23.20 N ATOM 711 CE2 TRP A 93 40.142 22.323 21.926 1.00 24.64 C ATOM 712 CE3 TRP A 93 38.921 20.317 22.525 1.00 23.07 C ATOM 713 CZ2 TRP A 93 41.358 21.754 22.300 1.00 20.62 C ATOM 714 CZ3 TRP A 93 40.134 19.741 22.857 1.00 24.80 C ATOM 715 CH2 TRP A 93 41.341 20.464 22.744 1.00 23.39 C ATOM 716 N THR A 94 37.206 22.026 18.164 1.00 32.20 N ATOM 717 CA THR A 94 37.809 22.777 17.079 1.00 33.87 C ATOM 718 C THR A 94 37.280 22.276 15.722 1.00 34.61 C ATOM 719 O THR A 94 37.096 23.053 14.795 1.00 34.53 O ATOM 720 CB THR A 94 39.347 22.582 17.106 1.00 34.55 C ATOM 721 OG1 THR A 94 39.906 23.238 18.260 1.00 34.75 O ATOM 722 CG2 THR A 94 40.007 23.135 15.873 1.00 35.56 C ATOM 723 N GLY A 95 37.032 20.976 15.607 1.00 35.18 N ATOM 724 CA GLY A 95 36.801 20.364 14.306 1.00 37.11 C ATOM 725 C GLY A 95 38.122 20.213 13.570 1.00 38.24 C ATOM 726 O GLY A 95 39.182 20.538 14.129 1.00 38.12 O ATOM 727 N PRO A 96 38.084 19.732 12.311 1.00 39.82 N ATOM 728 CA PRO A 96 39.316 19.426 11.550 1.00 40.13 C ATOM 729 C PRO A 96 40.379 20.532 11.515 1.00 40.86 C ATOM 730 O PRO A 96 40.057 21.711 11.377 1.00 40.87 O ATOM 731 CB PRO A 96 38.776 19.138 10.153 1.00 40.55 C ATOM 732 CG PRO A 96 37.468 18.456 10.446 1.00 39.52 C ATOM 733 CD PRO A 96 36.885 19.322 11.550 1.00 39.51 C ATOM 734 N SER A 97 41.641 20.149 11.676 1.00 41.14 N ATOM 735 CA SER A 97 42.732 21.118 11.616 1.00 41.69 C ATOM 736 C SER A 97 43.930 20.561 10.844 1.00 42.06 C ATOM 737 O SER A 97 43.885 19.428 10.335 1.00 41.52 O ATOM 738 CB SER A 97 43.125 21.632 13.015 1.00 41.54 C ATOM 739 OG SER A 97 43.479 20.592 13.924 1.00 41.93 O ATOM 740 N HIS A 98 44.992 21.356 10.750 1.00 42.51 N ATOM 741 CA HIS A 98 46.157 20.969 9.984 1.00 43.78 C ATOM 742 C HIS A 98 46.597 19.520 10.240 1.00 43.58 C ATOM 743 O HIS A 98 46.876 18.772 9.285 1.00 43.89 O ATOM 744 CB HIS A 98 47.325 21.928 10.219 1.00 44.46 C ATOM 745 CG HIS A 98 48.513 21.634 9.352 1.00 47.62 C ATOM 746 ND1 HIS A 98 49.518 20.766 9.733 1.00 49.37 N ATOM 747 CD2 HIS A 98 48.842 22.070 8.110 1.00 50.43 C ATOM 748 CE1 HIS A 98 50.422 20.696 8.770 1.00 51.01 C ATOM 749 NE2 HIS A 98 50.037 21.478 7.774 1.00 50.91 N ATOM 750 N ASP A 99 46.651 19.136 11.512 1.00 42.83 N ATOM 751 CA ASP A 99 47.193 17.846 11.913 1.00 42.65 C ATOM 752 C ASP A 99 46.155 16.722 11.865 1.00 42.22 C ATOM 753 O ASP A 99 46.503 15.550 12.104 1.00 42.59 O ATOM 754 CB ASP A 99 47.790 17.932 13.334 1.00 42.02 C ATOM 755 CG ASP A 99 49.055 18.803 13.403 1.00 44.45 C ATOM 756 OD1 ASP A 99 49.626 19.162 12.338 1.00 45.11 O ATOM 757 OD2 ASP A 99 49.478 19.137 14.532 1.00 42.64 O ATOM 758 N SER A 100 44.892 17.061 11.598 1.00 41.43 N ATOM 759 CA SER A 100 43.822 16.046 11.579 1.00 41.70 C ATOM 760 C SER A 100 44.049 14.972 10.493 1.00 41.85 C ATOM 761 O SER A 100 44.670 15.229 9.459 1.00 42.30 O ATOM 762 CB SER A 100 42.433 16.702 11.412 1.00 41.54 C ATOM 763 OG SER A 100 42.029 17.398 12.606 1.00 41.31 O ATOM 764 N GLU A 101 43.558 13.766 10.742 1.00 41.64 N ATOM 765 CA GLU A 101 43.584 12.695 9.750 1.00 41.05 C ATOM 766 C GLU A 101 42.189 12.117 9.636 1.00 40.03 C ATOM 767 O GLU A 101 41.386 12.287 10.567 1.00 38.50 O ATOM 768 CB GLU A 101 44.464 11.561 10.234 1.00 42.17 C ATOM 769 CG GLU A 101 45.926 11.874 10.307 1.00 47.75 C ATOM 770 CD GLU A 101 46.690 10.724 10.948 1.00 56.07 C ATOM 771 OE1 GLU A 101 47.919 10.596 10.680 1.00 59.87 O ATOM 772 OE2 GLU A 101 46.052 9.940 11.707 1.00 56.99 O ATOM 773 N ARG A 102 41.911 11.410 8.533 1.00 38.46 N ATOM 774 CA ARG A 102 40.632 10.716 8.402 1.00 38.49 C ATOM 775 C ARG A 102 40.757 9.211 8.256 1.00 36.92 C ATOM 776 O ARG A 102 41.643 8.717 7.545 1.00 38.89 O ATOM 777 CB ARG A 102 39.819 11.299 7.252 1.00 38.52 C ATOM 778 CG ARG A 102 39.178 12.632 7.637 1.00 43.44 C ATOM 779 CD ARG A 102 38.575 13.350 6.429 1.00 50.94 C ATOM 780 NE ARG A 102 37.825 14.544 6.852 1.00 54.85 N ATOM 781 CZ ARG A 102 38.373 15.723 7.145 1.00 56.27 C ATOM 782 NH1 ARG A 102 39.693 15.885 7.085 1.00 57.47 N ATOM 783 NH2 ARG A 102 37.600 16.745 7.513 1.00 57.54 N ATOM 784 N PHE A 103 39.824 8.493 8.868 1.00 34.44 N ATOM 785 CA PHE A 103 39.747 7.041 8.747 1.00 32.30 C ATOM 786 C PHE A 103 38.319 6.641 8.379 1.00 31.57 C ATOM 787 O PHE A 103 37.360 7.072 9.026 1.00 28.86 O ATOM 788 CB PHE A 103 40.150 6.341 10.048 1.00 33.42 C ATOM 789 CG PHE A 103 40.064 4.845 9.947 1.00 31.90 C ATOM 790 CD1 PHE A 103 41.114 4.114 9.365 1.00 33.32 C ATOM 791 CD2 PHE A 103 38.896 4.177 10.329 1.00 28.85 C ATOM 792 CE1 PHE A 103 41.017 2.732 9.213 1.00 33.35 C ATOM 793 CE2 PHE A 103 38.800 2.785 10.212 1.00 28.19 C ATOM 794 CZ PHE A 103 39.854 2.060 9.653 1.00 30.10 C ATOM 795 N THR A 104 38.172 5.855 7.313 1.00 29.99 N ATOM 796 CA THR A 104 36.876 5.316 6.945 1.00 29.56 C ATOM 797 C THR A 104 36.964 3.807 6.773 1.00 29.48 C ATOM 798 O THR A 104 37.908 3.284 6.141 1.00 29.28 O ATOM 799 CB THR A 104 36.341 5.934 5.615 1.00 29.53 C ATOM 800 OG1 THR A 104 35.973 7.291 5.856 1.00 31.47 O ATOM 801 CG2 THR A 104 35.101 5.181 5.091 1.00 26.26 C ATOM 802 N VAL A 105 35.978 3.107 7.330 1.00 28.76 N ATOM 803 CA VAL A 105 35.730 1.744 6.916 1.00 30.40 C ATOM 804 C VAL A 105 34.236 1.584 6.493 1.00 30.96 C ATOM 805 O VAL A 105 33.362 2.241 7.043 1.00 30.55 O ATOM 806 CB VAL A 105 36.273 0.730 7.947 1.00 30.22 C ATOM 807 CG1 VAL A 105 35.551 0.794 9.409 1.00 26.55 C ATOM 808 CG2 VAL A 105 36.308 -0.664 7.409 1.00 29.56 C ATOM 809 N TYR A 106 33.969 0.734 5.518 1.00 30.86 N ATOM 810 CA TYR A 106 32.584 0.449 5.100 1.00 31.52 C ATOM 811 C TYR A 106 32.221 -0.936 5.586 1.00 32.37 C ATOM 812 O TYR A 106 32.958 -1.914 5.360 1.00 33.30 O ATOM 813 CB TYR A 106 32.428 0.498 3.583 1.00 31.61 C ATOM 814 CG TYR A 106 32.871 1.812 2.969 1.00 32.77 C ATOM 815 CD1 TYR A 106 32.010 2.908 2.921 1.00 30.78 C ATOM 816 CD2 TYR A 106 34.154 1.941 2.410 1.00 28.39 C ATOM 817 CE1 TYR A 106 32.437 4.133 2.367 1.00 29.93 C ATOM 818 CE2 TYR A 106 34.587 3.156 1.885 1.00 26.01 C ATOM 819 CZ TYR A 106 33.728 4.229 1.843 1.00 28.57 C ATOM 820 OH TYR A 106 34.193 5.393 1.271 1.00 33.84 O ATOM 821 N LEU A 107 31.064 -1.046 6.215 1.00 32.98 N ATOM 822 CA LEU A 107 30.661 -2.331 6.736 1.00 34.33 C ATOM 823 C LEU A 107 29.488 -2.771 5.920 1.00 34.74 C ATOM 824 O LEU A 107 28.402 -2.181 6.016 1.00 35.30 O ATOM 825 CB LEU A 107 30.301 -2.252 8.218 1.00 34.05 C ATOM 826 CG LEU A 107 31.394 -1.643 9.102 1.00 34.95 C ATOM 827 CD1 LEU A 107 30.914 -1.569 10.530 1.00 35.65 C ATOM 828 CD2 LEU A 107 32.763 -2.359 8.991 1.00 32.92 C ATOM 829 N LYS A 108 29.722 -3.777 5.084 1.00 35.59 N ATOM 830 CA LYS A 108 28.671 -4.304 4.246 1.00 36.54 C ATOM 831 C LYS A 108 28.021 -5.489 4.934 1.00 37.51 C ATOM 832 O LYS A 108 28.668 -6.526 5.175 1.00 37.22 O ATOM 833 CB LYS A 108 29.248 -4.733 2.907 1.00 36.40 C ATOM 834 CG LYS A 108 28.210 -5.046 1.823 1.00 38.89 C ATOM 835 CD LYS A 108 28.708 -6.225 1.022 1.00 39.58 C ATOM 836 CE LYS A 108 27.787 -6.574 -0.137 1.00 44.81 C ATOM 837 NZ LYS A 108 28.283 -5.838 -1.321 1.00 42.65 N ATOM 838 N ALA A 109 26.743 -5.326 5.255 1.00 39.10 N ATOM 839 CA ALA A 109 25.949 -6.397 5.847 1.00 40.78 C ATOM 840 C ALA A 109 24.896 -6.824 4.847 1.00 41.62 C ATOM 841 O ALA A 109 24.137 -5.995 4.354 1.00 40.96 O ATOM 842 CB ALA A 109 25.282 -5.917 7.094 1.00 41.15 C ATOM 843 N ASN A 110 24.841 -8.117 4.558 1.00 43.40 N ATOM 844 CA ASN A 110 23.751 -8.639 3.729 1.00 45.02 C ATOM 845 C ASN A 110 22.542 -9.088 4.549 1.00 45.24 C ATOM 846 O ASN A 110 22.579 -9.103 5.795 1.00 45.87 O ATOM 847 CB ASN A 110 24.258 -9.705 2.748 1.00 45.64 C ATOM 848 CG ASN A 110 25.166 -9.105 1.676 1.00 48.06 C ATOM 849 OD1 ASN A 110 24.742 -8.239 0.903 1.00 50.57 O ATOM 850 ND2 ASN A 110 26.430 -9.533 1.651 1.00 50.06 N ATOM 851 OXT ASN A 110 21.484 -9.396 4.000 1.00 45.50 O TER 852 ASN A 110 ATOM 853 N ILE B 1 51.849 32.421 52.637 1.00 25.49 N ATOM 854 CA ILE B 1 51.767 32.676 51.154 1.00 23.95 C ATOM 855 C ILE B 1 50.440 33.375 50.828 1.00 24.37 C ATOM 856 O ILE B 1 49.533 33.380 51.675 1.00 23.41 O ATOM 857 CB ILE B 1 51.940 31.382 50.329 1.00 25.04 C ATOM 858 CG1 ILE B 1 50.988 30.286 50.804 1.00 23.37 C ATOM 859 CG2 ILE B 1 53.432 30.936 50.372 1.00 25.07 C ATOM 860 CD1 ILE B 1 50.964 29.016 49.871 1.00 23.06 C ATOM 861 N PRO B 2 50.309 33.972 49.610 1.00 22.90 N ATOM 862 CA PRO B 2 49.097 34.759 49.364 1.00 22.25 C ATOM 863 C PRO B 2 47.847 33.889 49.296 1.00 20.97 C ATOM 864 O PRO B 2 47.955 32.688 49.141 1.00 20.28 O ATOM 865 CB PRO B 2 49.365 35.423 47.993 1.00 22.00 C ATOM 866 CG PRO B 2 50.886 35.394 47.838 1.00 24.12 C ATOM 867 CD PRO B 2 51.296 34.101 48.503 1.00 24.30 C ATOM 868 N GLU B 3 46.674 34.487 49.443 1.00 21.06 N ATOM 869 CA GLU B 3 45.416 33.758 49.253 1.00 21.66 C ATOM 870 C GLU B 3 45.215 33.401 47.768 1.00 21.26 C ATOM 871 O GLU B 3 44.708 32.333 47.411 1.00 21.85 O ATOM 872 CB GLU B 3 44.267 34.649 49.677 1.00 22.93 C ATOM 873 CG GLU B 3 42.968 33.915 49.781 1.00 25.28 C ATOM 874 CD GLU B 3 41.797 34.827 50.125 1.00 31.79 C ATOM 875 OE1 GLU B 3 40.722 34.270 50.402 1.00 33.41 O ATOM 876 OE2 GLU B 3 41.955 36.077 50.114 1.00 34.09 O ATOM 877 N TYR B 4 45.632 34.304 46.900 1.00 20.71 N ATOM 878 CA TYR B 4 45.565 34.053 45.447 1.00 19.55 C ATOM 879 C TYR B 4 46.928 34.355 44.880 1.00 20.20 C ATOM 880 O TYR B 4 47.599 35.297 45.313 1.00 19.97 O ATOM 881 CB TYR B 4 44.569 35.003 44.735 1.00 20.65 C ATOM 882 CG TYR B 4 43.116 34.752 45.065 1.00 20.33 C ATOM 883 CD1 TYR B 4 42.362 33.902 44.275 1.00 22.15 C ATOM 884 CD2 TYR B 4 42.493 35.368 46.167 1.00 19.77 C ATOM 885 CE1 TYR B 4 41.038 33.649 44.541 1.00 22.48 C ATOM 886 CE2 TYR B 4 41.151 35.108 46.456 1.00 22.18 C ATOM 887 CZ TYR B 4 40.432 34.262 45.633 1.00 23.24 C ATOM 888 OH TYR B 4 39.108 33.948 45.870 1.00 26.92 O ATOM 889 N VAL B 5 47.309 33.579 43.872 1.00 18.53 N ATOM 890 CA VAL B 5 48.519 33.821 43.099 1.00 18.46 C ATOM 891 C VAL B 5 48.121 33.639 41.647 1.00 17.19 C ATOM 892 O VAL B 5 47.318 32.769 41.353 1.00 17.32 O ATOM 893 CB VAL B 5 49.634 32.828 43.437 1.00 17.58 C ATOM 894 CG1 VAL B 5 50.788 32.943 42.412 1.00 17.45 C ATOM 895 CG2 VAL B 5 50.117 33.036 44.897 1.00 18.03 C ATOM 896 N ASP B 6 48.634 34.506 40.758 1.00 18.21 N ATOM 897 CA ASP B 6 48.427 34.392 39.312 1.00 17.79 C ATOM 898 C ASP B 6 49.568 35.049 38.544 1.00 18.02 C ATOM 899 O ASP B 6 49.572 36.291 38.316 1.00 16.26 O ATOM 900 CB ASP B 6 47.090 35.056 38.871 1.00 19.06 C ATOM 901 CG ASP B 6 46.751 34.791 37.408 1.00 20.24 C ATOM 902 OD1 ASP B 6 47.632 34.368 36.628 1.00 19.81 O ATOM 903 OD2 ASP B 6 45.612 35.099 36.994 1.00 20.04 O ATOM 904 N TRP B 7 50.527 34.220 38.116 1.00 17.55 N ATOM 905 CA TRP B 7 51.739 34.748 37.510 1.00 16.96 C ATOM 906 C TRP B 7 51.466 35.546 36.240 1.00 17.55 C ATOM 907 O TRP B 7 52.289 36.398 35.884 1.00 15.86 O ATOM 908 CB TRP B 7 52.775 33.608 37.264 1.00 17.36 C ATOM 909 CG TRP B 7 53.419 33.269 38.534 1.00 17.61 C ATOM 910 CD1 TRP B 7 53.222 32.142 39.303 1.00 17.41 C ATOM 911 CD2 TRP B 7 54.330 34.099 39.271 1.00 17.61 C ATOM 912 NE1 TRP B 7 53.964 32.230 40.446 1.00 17.51 N ATOM 913 CE2 TRP B 7 54.651 33.416 40.454 1.00 18.51 C ATOM 914 CE3 TRP B 7 54.897 35.364 39.038 1.00 21.29 C ATOM 915 CZ2 TRP B 7 55.560 33.931 41.402 1.00 17.02 C ATOM 916 CZ3 TRP B 7 55.781 35.899 39.995 1.00 19.06 C ATOM 917 CH2 TRP B 7 56.096 35.175 41.162 1.00 18.99 C ATOM 918 N ARG B 8 50.288 35.379 35.617 1.00 17.54 N ATOM 919 CA ARG B 8 49.982 36.114 34.354 1.00 19.46 C ATOM 920 C ARG B 8 49.841 37.577 34.712 1.00 20.14 C ATOM 921 O ARG B 8 50.180 38.465 33.922 1.00 19.42 O ATOM 922 CB ARG B 8 48.672 35.651 33.744 1.00 19.15 C ATOM 923 CG ARG B 8 48.670 34.170 33.310 1.00 19.51 C ATOM 924 CD ARG B 8 47.282 33.818 32.753 1.00 20.37 C ATOM 925 NE ARG B 8 46.305 33.867 33.812 1.00 17.89 N ATOM 926 CZ ARG B 8 45.037 33.462 33.708 1.00 17.63 C ATOM 927 NH1 ARG B 8 44.551 33.019 32.568 1.00 17.37 N ATOM 928 NH2 ARG B 8 44.255 33.543 34.750 1.00 15.43 N ATOM 929 N GLN B 9 49.407 37.818 35.949 1.00 20.34 N ATOM 930 CA GLN B 9 49.246 39.196 36.434 1.00 22.84 C ATOM 931 C GLN B 9 50.533 39.929 36.700 1.00 22.23 C ATOM 932 O GLN B 9 50.527 41.159 36.773 1.00 21.36 O ATOM 933 CB GLN B 9 48.354 39.261 37.669 1.00 23.48 C ATOM 934 CG GLN B 9 46.877 38.976 37.336 1.00 29.94 C ATOM 935 CD GLN B 9 46.025 38.878 38.599 1.00 37.24 C ATOM 936 OE1 GLN B 9 46.541 39.015 39.725 1.00 42.67 O ATOM 937 NE2 GLN B 9 44.727 38.620 38.430 1.00 38.18 N ATOM 938 N LYS B 10 51.624 39.183 36.814 1.00 21.87 N ATOM 939 CA LYS B 10 52.926 39.745 37.011 1.00 21.37 C ATOM 940 C LYS B 10 53.708 39.744 35.717 1.00 20.68 C ATOM 941 O LYS B 10 54.896 40.002 35.744 1.00 20.05 O ATOM 942 CB LYS B 10 53.716 38.932 38.047 1.00 22.38 C ATOM 943 CG LYS B 10 53.097 38.899 39.431 1.00 26.13 C ATOM 944 CD LYS B 10 53.079 40.261 40.078 1.00 34.55 C ATOM 945 CE LYS B 10 52.298 40.198 41.407 1.00 41.96 C ATOM 946 NZ LYS B 10 52.758 39.028 42.262 1.00 45.86 N ATOM 947 N GLY B 11 53.081 39.406 34.594 1.00 19.10 N ATOM 948 CA GLY B 11 53.795 39.503 33.328 1.00 18.11 C ATOM 949 C GLY B 11 54.787 38.359 33.118 1.00 17.90 C ATOM 950 O GLY B 11 55.714 38.474 32.283 1.00 18.06 O ATOM 951 N ALA B 12 54.585 37.255 33.843 1.00 16.98 N ATOM 952 CA ALA B 12 55.572 36.136 33.875 1.00 16.98 C ATOM 953 C ALA B 12 55.099 34.931 33.080 1.00 17.28 C ATOM 954 O ALA B 12 55.721 33.849 33.177 1.00 16.88 O ATOM 955 CB ALA B 12 55.907 35.712 35.366 1.00 17.09 C ATOM 956 N VAL B 13 54.011 35.106 32.302 1.00 14.79 N ATOM 957 CA VAL B 13 53.452 33.971 31.565 1.00 17.03 C ATOM 958 C VAL B 13 53.189 34.425 30.141 1.00 16.13 C ATOM 959 O VAL B 13 52.484 35.418 29.928 1.00 16.68 O ATOM 960 CB VAL B 13 52.135 33.465 32.185 1.00 15.27 C ATOM 961 CG1 VAL B 13 51.568 32.252 31.383 1.00 18.49 C ATOM 962 CG2 VAL B 13 52.331 33.116 33.702 1.00 16.62 C ATOM 963 N THR B 14 53.726 33.691 29.169 1.00 16.91 N ATOM 964 CA THR B 14 53.556 34.047 27.769 1.00 17.74 C ATOM 965 C THR B 14 52.196 33.571 27.228 1.00 18.47 C ATOM 966 O THR B 14 51.486 32.829 27.911 1.00 18.76 O ATOM 967 CB THR B 14 54.639 33.344 26.899 1.00 17.83 C ATOM 968 OG1 THR B 14 54.468 31.920 27.002 1.00 20.07 O ATOM 969 CG2 THR B 14 56.050 33.748 27.291 1.00 16.76 C ATOM 970 N PRO B 15 51.816 33.990 25.986 1.00 18.10 N ATOM 971 CA PRO B 15 50.511 33.470 25.572 1.00 17.82 C ATOM 972 C PRO B 15 50.407 31.932 25.459 1.00 18.03 C ATOM 973 O PRO B 15 51.421 31.206 25.333 1.00 17.67 O ATOM 974 CB PRO B 15 50.317 34.082 24.195 1.00 17.53 C ATOM 975 CG PRO B 15 51.122 35.412 24.246 1.00 15.76 C ATOM 976 CD PRO B 15 52.388 34.856 24.927 1.00 19.22 C ATOM 977 N VAL B 16 49.170 31.457 25.484 1.00 17.33 N ATOM 978 CA VAL B 16 48.870 30.032 25.385 1.00 17.18 C ATOM 979 C VAL B 16 49.261 29.514 24.017 1.00 17.99 C ATOM 980 O VAL B 16 49.002 30.169 23.021 1.00 18.98 O ATOM 981 CB VAL B 16 47.372 29.790 25.615 1.00 17.21 C ATOM 982 CG1 VAL B 16 46.949 28.336 25.104 1.00 13.65 C ATOM 983 CG2 VAL B 16 47.058 30.042 27.117 1.00 16.74 C ATOM 984 N LYS B 17 49.905 28.353 24.003 1.00 18.67 N ATOM 985 CA LYS B 17 50.441 27.734 22.843 1.00 19.26 C ATOM 986 C LYS B 17 49.611 26.528 22.425 1.00 20.09 C ATOM 987 O LYS B 17 48.745 26.069 23.159 1.00 18.90 O ATOM 988 CB LYS B 17 51.888 27.258 23.105 1.00 19.46 C ATOM 989 CG LYS B 17 52.897 28.310 23.465 1.00 21.17 C ATOM 990 CD LYS B 17 52.732 29.583 22.694 1.00 27.52 C ATOM 991 CE LYS B 17 53.932 30.520 22.931 1.00 31.15 C ATOM 992 NZ LYS B 17 53.839 31.226 24.247 1.00 31.07 N ATOM 993 N ASN B 18 49.911 26.017 21.239 1.00 19.28 N ATOM 994 CA ASN B 18 49.215 24.863 20.699 1.00 20.83 C ATOM 995 C ASN B 18 50.253 23.874 20.269 1.00 20.76 C ATOM 996 O ASN B 18 50.976 24.133 19.313 1.00 22.79 O ATOM 997 CB ASN B 18 48.362 25.314 19.493 1.00 20.57 C ATOM 998 CG ASN B 18 47.545 24.185 18.871 1.00 24.50 C ATOM 999 OD1 ASN B 18 47.759 22.991 19.110 1.00 24.47 O ATOM 1000 ND2 ASN B 18 46.566 24.584 18.057 1.00 28.91 N ATOM 1001 N GLN B 19 50.350 22.747 20.973 1.00 19.65 N ATOM 1002 CA GLN B 19 51.334 21.707 20.675 1.00 19.30 C ATOM 1003 C GLN B 19 51.000 20.873 19.416 1.00 20.00 C ATOM 1004 O GLN B 19 51.838 20.091 18.935 1.00 21.22 O ATOM 1005 CB GLN B 19 51.499 20.788 21.920 1.00 18.44 C ATOM 1006 CG GLN B 19 50.223 20.017 22.192 1.00 19.18 C ATOM 1007 CD GLN B 19 50.374 19.005 23.268 1.00 22.29 C ATOM 1008 OE1 GLN B 19 50.217 19.339 24.417 1.00 15.47 O ATOM 1009 NE2 GLN B 19 50.724 17.782 22.917 1.00 14.89 N ATOM 1010 N GLY B 20 49.802 21.035 18.861 1.00 19.68 N ATOM 1011 CA GLY B 20 49.364 20.189 17.783 1.00 20.76 C ATOM 1012 C GLY B 20 49.220 18.723 18.166 1.00 20.84 C ATOM 1013 O GLY B 20 49.007 18.402 19.320 1.00 20.90 O ATOM 1014 N SER B 21 49.325 17.818 17.191 1.00 21.54 N ATOM 1015 CA SER B 21 49.097 16.410 17.472 1.00 23.37 C ATOM 1016 C SER B 21 50.382 15.734 17.967 1.00 24.11 C ATOM 1017 O SER B 21 50.376 14.580 18.362 1.00 25.85 O ATOM 1018 CB SER B 21 48.500 15.698 16.254 1.00 23.81 C ATOM 1019 OG SER B 21 49.416 15.694 15.211 1.00 26.08 O ATOM 1020 N CYS B 22 51.474 16.479 17.978 1.00 24.22 N ATOM 1021 CA CYS B 22 52.758 15.968 18.494 1.00 23.78 C ATOM 1022 C CYS B 22 52.684 15.636 20.003 1.00 22.46 C ATOM 1023 O CYS B 22 52.087 16.368 20.811 1.00 23.62 O ATOM 1024 CB CYS B 22 53.867 16.986 18.153 1.00 24.21 C ATOM 1025 SG CYS B 22 55.466 16.649 18.913 1.00 24.73 S ATOM 1026 N GLY B 23 53.313 14.551 20.425 1.00 22.04 N ATOM 1027 CA GLY B 23 53.270 14.206 21.856 1.00 20.71 C ATOM 1028 C GLY B 23 54.354 14.966 22.637 1.00 19.67 C ATOM 1029 O GLY B 23 55.230 14.361 23.241 1.00 18.76 O ATOM 1030 N SER B 24 54.254 16.292 22.635 1.00 18.58 N ATOM 1031 CA SER B 24 55.303 17.172 23.157 1.00 19.49 C ATOM 1032 C SER B 24 54.930 17.913 24.451 1.00 17.83 C ATOM 1033 O SER B 24 55.570 18.898 24.767 1.00 18.47 O ATOM 1034 CB SER B 24 55.637 18.214 22.108 1.00 19.04 C ATOM 1035 OG SER B 24 54.460 18.869 21.638 1.00 20.89 O ATOM 1036 N CYS B 25 53.846 17.535 25.128 1.00 16.67 N ATOM 1037 CA CYS B 25 53.435 18.239 26.362 1.00 16.83 C ATOM 1038 C CYS B 25 54.534 18.399 27.414 1.00 16.32 C ATOM 1039 O CYS B 25 54.618 19.435 28.057 1.00 16.31 O ATOM 1040 CB CYS B 25 52.264 17.545 27.039 1.00 14.91 C ATOM 1041 SG CYS B 25 52.539 15.807 27.407 1.00 18.79 S ATOM 1042 N TRP B 26 55.352 17.361 27.589 1.00 16.52 N ATOM 1043 CA TRP B 26 56.528 17.393 28.404 1.00 16.30 C ATOM 1044 C TRP B 26 57.449 18.616 28.149 1.00 16.33 C ATOM 1045 O TRP B 26 57.919 19.219 29.108 1.00 17.42 O ATOM 1046 CB TRP B 26 57.280 16.038 28.296 1.00 16.28 C ATOM 1047 CG TRP B 26 57.819 15.763 26.954 1.00 17.79 C ATOM 1048 CD1 TRP B 26 57.172 15.174 25.900 1.00 18.62 C ATOM 1049 CD2 TRP B 26 59.145 16.039 26.516 1.00 19.74 C ATOM 1050 NE1 TRP B 26 58.033 15.052 24.824 1.00 19.88 N ATOM 1051 CE2 TRP B 26 59.242 15.610 25.173 1.00 18.04 C ATOM 1052 CE3 TRP B 26 60.274 16.600 27.136 1.00 20.48 C ATOM 1053 CZ2 TRP B 26 60.425 15.726 24.437 1.00 21.43 C ATOM 1054 CZ3 TRP B 26 61.457 16.739 26.383 1.00 18.18 C ATOM 1055 CH2 TRP B 26 61.514 16.305 25.062 1.00 18.80 C ATOM 1056 N ALA B 27 57.635 18.996 26.889 1.00 16.88 N ATOM 1057 CA ALA B 27 58.492 20.119 26.476 1.00 15.56 C ATOM 1058 C ALA B 27 57.779 21.450 26.684 1.00 16.67 C ATOM 1059 O ALA B 27 58.399 22.431 27.072 1.00 17.65 O ATOM 1060 CB ALA B 27 58.957 19.978 24.995 1.00 17.36 C ATOM 1061 N PHE B 28 56.490 21.476 26.415 1.00 16.45 N ATOM 1062 CA PHE B 28 55.698 22.693 26.606 1.00 16.60 C ATOM 1063 C PHE B 28 55.656 23.030 28.081 1.00 16.64 C ATOM 1064 O PHE B 28 55.909 24.183 28.467 1.00 16.49 O ATOM 1065 CB PHE B 28 54.292 22.500 26.057 1.00 16.75 C ATOM 1066 CG PHE B 28 54.227 22.810 24.593 1.00 17.64 C ATOM 1067 CD1 PHE B 28 54.678 21.870 23.679 1.00 16.80 C ATOM 1068 CD2 PHE B 28 53.893 24.082 24.161 1.00 16.53 C ATOM 1069 CE1 PHE B 28 54.661 22.144 22.314 1.00 20.39 C ATOM 1070 CE2 PHE B 28 53.892 24.384 22.759 1.00 21.66 C ATOM 1071 CZ PHE B 28 54.292 23.433 21.864 1.00 17.12 C ATOM 1072 N SER B 29 55.342 22.024 28.894 1.00 16.81 N ATOM 1073 CA SER B 29 55.331 22.172 30.344 1.00 15.79 C ATOM 1074 C SER B 29 56.636 22.769 30.911 1.00 16.88 C ATOM 1075 O SER B 29 56.625 23.708 31.729 1.00 15.57 O ATOM 1076 CB SER B 29 55.051 20.780 30.936 1.00 17.65 C ATOM 1077 OG SER B 29 55.177 20.767 32.338 1.00 17.38 O ATOM 1078 N ALA B 30 57.772 22.196 30.508 1.00 14.91 N ATOM 1079 CA ALA B 30 59.045 22.709 30.936 1.00 16.13 C ATOM 1080 C ALA B 30 59.236 24.179 30.565 1.00 15.09 C ATOM 1081 O ALA B 30 59.697 25.011 31.355 1.00 15.71 O ATOM 1082 CB ALA B 30 60.147 21.838 30.344 1.00 13.71 C ATOM 1083 N VAL B 31 58.900 24.513 29.333 1.00 16.59 N ATOM 1084 CA VAL B 31 59.179 25.840 28.868 1.00 15.73 C ATOM 1085 C VAL B 31 58.382 26.875 29.618 1.00 15.92 C ATOM 1086 O VAL B 31 58.888 27.925 29.801 1.00 16.15 O ATOM 1087 CB VAL B 31 58.937 25.958 27.378 1.00 13.99 C ATOM 1088 CG1 VAL B 31 58.826 27.398 26.973 1.00 14.65 C ATOM 1089 CG2 VAL B 31 60.123 25.226 26.636 1.00 14.42 C ATOM 1090 N VAL B 32 57.146 26.574 30.031 1.00 16.60 N ATOM 1091 CA VAL B 32 56.375 27.541 30.867 1.00 16.20 C ATOM 1092 C VAL B 32 57.179 27.945 32.128 1.00 16.20 C ATOM 1093 O VAL B 32 57.249 29.136 32.457 1.00 14.90 O ATOM 1094 CB VAL B 32 55.003 26.988 31.308 1.00 16.41 C ATOM 1095 CG1 VAL B 32 54.209 28.066 32.079 1.00 19.00 C ATOM 1096 CG2 VAL B 32 54.179 26.517 30.160 1.00 17.59 C ATOM 1097 N THR B 33 57.809 26.967 32.798 1.00 12.95 N ATOM 1098 CA THR B 33 58.588 27.267 33.987 1.00 16.32 C ATOM 1099 C THR B 33 59.807 28.127 33.670 1.00 15.98 C ATOM 1100 O THR B 33 60.207 28.965 34.507 1.00 16.86 O ATOM 1101 CB THR B 33 59.001 25.970 34.750 1.00 15.59 C ATOM 1102 OG1 THR B 33 59.943 25.237 33.931 1.00 17.68 O ATOM 1103 CG2 THR B 33 57.714 25.074 35.009 1.00 17.72 C ATOM 1104 N ILE B 34 60.448 27.861 32.541 1.00 16.75 N ATOM 1105 CA AILE B 34 61.653 28.599 32.182 0.50 17.04 C ATOM 1106 CA BILE B 34 61.653 28.601 32.155 0.50 16.95 C ATOM 1107 C ILE B 34 61.277 30.057 31.868 1.00 17.31 C ATOM 1108 O ILE B 34 61.880 30.991 32.386 1.00 16.69 O ATOM 1109 CB AILE B 34 62.404 27.965 30.977 0.50 16.67 C ATOM 1110 CB BILE B 34 62.351 28.032 30.880 0.50 16.42 C ATOM 1111 CG1AILE B 34 62.797 26.517 31.287 0.50 17.48 C ATOM 1112 CG1BILE B 34 62.796 26.586 31.086 0.50 16.58 C ATOM 1113 CG2AILE B 34 63.648 28.772 30.660 0.50 15.87 C ATOM 1114 CG2BILE B 34 63.563 28.878 30.544 0.50 16.13 C ATOM 1115 CD1AILE B 34 63.247 25.750 30.081 0.50 16.61 C ATOM 1116 CD1BILE B 34 63.485 26.379 32.384 0.50 13.64 C ATOM 1117 N GLU B 35 60.283 30.230 31.007 1.00 16.72 N ATOM 1118 CA GLU B 35 59.754 31.576 30.722 1.00 17.16 C ATOM 1119 C GLU B 35 59.423 32.343 32.031 1.00 15.88 C ATOM 1120 O GLU B 35 59.775 33.492 32.203 1.00 15.33 O ATOM 1121 CB GLU B 35 58.518 31.422 29.840 1.00 16.74 C ATOM 1122 CG GLU B 35 58.869 31.090 28.394 1.00 19.47 C ATOM 1123 CD GLU B 35 57.679 30.666 27.568 1.00 21.93 C ATOM 1124 OE1 GLU B 35 56.532 30.550 28.090 1.00 21.07 O ATOM 1125 OE2 GLU B 35 57.899 30.482 26.363 1.00 21.90 O ATOM 1126 N GLY B 36 58.763 31.672 32.950 1.00 15.91 N ATOM 1127 CA GLY B 36 58.396 32.244 34.236 1.00 16.35 C ATOM 1128 C GLY B 36 59.570 32.636 35.125 1.00 16.87 C ATOM 1129 O GLY B 36 59.650 33.775 35.575 1.00 16.03 O ATOM 1130 N ILE B 37 60.528 31.719 35.323 1.00 17.15 N ATOM 1131 CA ILE B 37 61.635 32.026 36.206 1.00 16.13 C ATOM 1132 C ILE B 37 62.531 33.135 35.572 1.00 15.53 C ATOM 1133 O ILE B 37 63.062 33.992 36.284 1.00 15.49 O ATOM 1134 CB ILE B 37 62.459 30.768 36.643 1.00 16.49 C ATOM 1135 CG1 ILE B 37 63.326 31.087 37.863 1.00 15.83 C ATOM 1136 CG2 ILE B 37 63.314 30.227 35.449 1.00 16.39 C ATOM 1137 CD1 ILE B 37 62.541 31.602 39.125 1.00 17.32 C ATOM 1138 N ILE B 38 62.696 33.146 34.249 1.00 14.63 N ATOM 1139 CA ILE B 38 63.504 34.224 33.637 1.00 14.61 C ATOM 1140 C ILE B 38 62.834 35.599 33.854 1.00 13.95 C ATOM 1141 O ILE B 38 63.518 36.606 34.088 1.00 15.55 O ATOM 1142 CB ILE B 38 63.830 33.931 32.102 1.00 13.25 C ATOM 1143 CG1 ILE B 38 64.649 32.614 31.943 1.00 16.70 C ATOM 1144 CG2 ILE B 38 64.499 35.174 31.446 1.00 15.87 C ATOM 1145 CD1 ILE B 38 65.989 32.599 32.598 1.00 20.02 C ATOM 1146 N LYS B 39 61.509 35.667 33.813 1.00 14.70 N ATOM 1147 CA LYS B 39 60.847 36.964 34.090 1.00 15.36 C ATOM 1148 C LYS B 39 61.039 37.361 35.560 1.00 16.75 C ATOM 1149 O LYS B 39 61.381 38.489 35.914 1.00 15.16 O ATOM 1150 CB LYS B 39 59.358 36.894 33.750 1.00 16.56 C ATOM 1151 CG LYS B 39 58.555 38.126 34.261 1.00 18.57 C ATOM 1152 CD LYS B 39 58.880 39.379 33.455 1.00 19.58 C ATOM 1153 CE LYS B 39 57.976 40.512 34.015 1.00 17.10 C ATOM 1154 NZ LYS B 39 58.309 41.796 33.332 1.00 19.02 N ATOM 1155 N ILE B 40 60.853 36.382 36.416 1.00 16.03 N ATOM 1156 CA ILE B 40 60.969 36.655 37.858 1.00 15.98 C ATOM 1157 C ILE B 40 62.368 37.229 38.215 1.00 16.54 C ATOM 1158 O ILE B 40 62.481 38.206 38.955 1.00 17.80 O ATOM 1159 CB ILE B 40 60.615 35.387 38.670 1.00 15.37 C ATOM 1160 CG1 ILE B 40 59.108 35.123 38.551 1.00 17.28 C ATOM 1161 CG2 ILE B 40 60.990 35.577 40.159 1.00 13.49 C ATOM 1162 CD1 ILE B 40 58.655 33.729 39.047 1.00 17.64 C ATOM 1163 N ARG B 41 63.416 36.639 37.662 1.00 16.98 N ATOM 1164 CA ARG B 41 64.785 37.035 37.972 1.00 17.38 C ATOM 1165 C ARG B 41 65.245 38.269 37.188 1.00 17.70 C ATOM 1166 O ARG B 41 65.961 39.143 37.718 1.00 17.58 O ATOM 1167 CB ARG B 41 65.749 35.866 37.688 1.00 17.76 C ATOM 1168 CG ARG B 41 65.582 34.620 38.560 1.00 22.00 C ATOM 1169 CD ARG B 41 65.764 34.971 39.997 1.00 24.37 C ATOM 1170 NE ARG B 41 65.776 33.775 40.818 1.00 27.47 N ATOM 1171 CZ ARG B 41 64.825 33.460 41.686 1.00 32.01 C ATOM 1172 NH1 ARG B 41 63.771 34.270 41.884 1.00 34.35 N ATOM 1173 NH2 ARG B 41 64.908 32.323 42.359 1.00 35.15 N ATOM 1174 N THR B 42 64.892 38.337 35.910 1.00 17.86 N ATOM 1175 CA THR B 42 65.507 39.345 35.008 1.00 18.91 C ATOM 1176 C THR B 42 64.601 40.495 34.652 1.00 17.94 C ATOM 1177 O THR B 42 65.058 41.501 34.155 1.00 19.59 O ATOM 1178 CB THR B 42 66.028 38.722 33.667 1.00 18.45 C ATOM 1179 OG1 THR B 42 64.937 38.493 32.759 1.00 21.08 O ATOM 1180 CG2 THR B 42 66.836 37.455 33.912 1.00 17.44 C ATOM 1181 N GLY B 43 63.306 40.327 34.880 1.00 18.74 N ATOM 1182 CA GLY B 43 62.344 41.317 34.470 1.00 18.56 C ATOM 1183 C GLY B 43 61.914 41.249 33.017 1.00 18.85 C ATOM 1184 O GLY B 43 61.049 41.987 32.649 1.00 19.39 O ATOM 1185 N ASN B 44 62.456 40.320 32.216 1.00 18.24 N ATOM 1186 CA ASN B 44 62.034 40.144 30.838 1.00 18.27 C ATOM 1187 C ASN B 44 61.247 38.847 30.613 1.00 18.77 C ATOM 1188 O ASN B 44 61.678 37.774 31.052 1.00 18.59 O ATOM 1189 CB ASN B 44 63.264 40.060 29.935 1.00 19.26 C ATOM 1190 CG ASN B 44 64.081 41.339 29.962 1.00 21.94 C ATOM 1191 OD1 ASN B 44 65.039 41.448 30.713 1.00 29.90 O ATOM 1192 ND2 ASN B 44 63.700 42.297 29.153 1.00 23.68 N ATOM 1193 N LEU B 45 60.124 38.973 29.924 1.00 17.70 N ATOM 1194 CA LEU B 45 59.338 37.834 29.465 1.00 17.90 C ATOM 1195 C LEU B 45 59.745 37.493 28.036 1.00 18.24 C ATOM 1196 O LEU B 45 59.496 38.269 27.096 1.00 17.41 O ATOM 1197 CB LEU B 45 57.825 38.167 29.549 1.00 18.29 C ATOM 1198 CG LEU B 45 56.922 36.960 29.190 1.00 16.71 C ATOM 1199 CD1 LEU B 45 57.103 35.710 30.182 1.00 16.92 C ATOM 1200 CD2 LEU B 45 55.483 37.423 29.036 1.00 19.42 C ATOM 1201 N ASN B 46 60.389 36.345 27.873 1.00 17.14 N ATOM 1202 CA ASN B 46 60.763 35.858 26.544 1.00 17.49 C ATOM 1203 C ASN B 46 60.070 34.539 26.301 1.00 18.76 C ATOM 1204 O ASN B 46 59.632 33.884 27.277 1.00 19.19 O ATOM 1205 CB ASN B 46 62.290 35.628 26.461 1.00 16.39 C ATOM 1206 CG ASN B 46 63.109 36.852 26.921 1.00 19.68 C ATOM 1207 OD1 ASN B 46 63.931 36.771 27.859 1.00 21.89 O ATOM 1208 ND2 ASN B 46 62.859 37.982 26.313 1.00 13.47 N ATOM 1209 N GLU B 47 60.017 34.124 25.024 1.00 18.02 N ATOM 1210 CA GLU B 47 59.532 32.800 24.684 1.00 19.83 C ATOM 1211 C GLU B 47 60.742 31.958 24.363 1.00 18.88 C ATOM 1212 O GLU B 47 61.666 32.450 23.732 1.00 20.83 O ATOM 1213 CB GLU B 47 58.570 32.907 23.491 1.00 20.47 C ATOM 1214 CG GLU B 47 57.287 33.631 23.891 1.00 24.84 C ATOM 1215 CD GLU B 47 56.168 33.457 22.921 1.00 29.92 C ATOM 1216 OE1 GLU B 47 56.427 33.271 21.726 1.00 37.13 O ATOM 1217 OE2 GLU B 47 55.020 33.517 23.339 1.00 29.03 O ATOM 1218 N TYR B 48 60.748 30.712 24.840 1.00 19.58 N ATOM 1219 CA TYR B 48 61.851 29.745 24.638 1.00 17.95 C ATOM 1220 C TYR B 48 61.328 28.540 23.843 1.00 18.71 C ATOM 1221 O TYR B 48 60.109 28.382 23.649 1.00 17.35 O ATOM 1222 CB TYR B 48 62.517 29.341 25.988 1.00 18.07 C ATOM 1223 CG TYR B 48 63.177 30.525 26.625 1.00 19.57 C ATOM 1224 CD1 TYR B 48 64.412 31.026 26.149 1.00 18.74 C ATOM 1225 CD2 TYR B 48 62.539 31.223 27.603 1.00 16.38 C ATOM 1226 CE1 TYR B 48 65.012 32.152 26.728 1.00 17.36 C ATOM 1227 CE2 TYR B 48 63.123 32.358 28.185 1.00 17.49 C ATOM 1228 CZ TYR B 48 64.358 32.808 27.747 1.00 17.76 C ATOM 1229 OH TYR B 48 64.919 33.947 28.308 1.00 20.28 O ATOM 1230 N SER B 49 62.244 27.703 23.374 1.00 19.31 N ATOM 1231 CA SER B 49 61.963 26.825 22.227 1.00 19.01 C ATOM 1232 C SER B 49 61.537 25.448 22.725 1.00 19.24 C ATOM 1233 O SER B 49 62.360 24.709 23.252 1.00 20.01 O ATOM 1234 CB SER B 49 63.209 26.695 21.360 1.00 18.95 C ATOM 1235 OG SER B 49 63.033 25.725 20.323 1.00 18.15 O ATOM 1236 N GLU B 50 60.252 25.121 22.586 1.00 18.65 N ATOM 1237 CA GLU B 50 59.809 23.745 22.812 1.00 17.90 C ATOM 1238 C GLU B 50 60.472 22.803 21.838 1.00 18.07 C ATOM 1239 O GLU B 50 60.830 21.673 22.225 1.00 16.83 O ATOM 1240 CB GLU B 50 58.276 23.619 22.734 1.00 18.79 C ATOM 1241 CG GLU B 50 57.517 24.312 23.910 1.00 18.89 C ATOM 1242 CD GLU B 50 57.181 25.745 23.614 1.00 22.56 C ATOM 1243 OE1 GLU B 50 57.467 26.211 22.491 1.00 24.34 O ATOM 1244 OE2 GLU B 50 56.581 26.396 24.492 1.00 22.24 O ATOM 1245 N GLN B 51 60.584 23.237 20.562 1.00 16.53 N ATOM 1246 CA GLN B 51 61.170 22.443 19.447 1.00 18.40 C ATOM 1247 C GLN B 51 62.569 21.976 19.793 1.00 18.21 C ATOM 1248 O GLN B 51 62.939 20.829 19.547 1.00 16.45 O ATOM 1249 CB GLN B 51 61.240 23.298 18.175 1.00 18.06 C ATOM 1250 CG GLN B 51 61.596 22.501 16.824 1.00 19.65 C ATOM 1251 CD GLN B 51 60.555 21.447 16.538 1.00 19.78 C ATOM 1252 OE1 GLN B 51 59.350 21.722 16.575 1.00 19.92 O ATOM 1253 NE2 GLN B 51 61.006 20.227 16.287 1.00 16.24 N ATOM 1254 N GLU B 52 63.375 22.887 20.324 1.00 18.79 N ATOM 1255 CA GLU B 52 64.733 22.489 20.751 1.00 19.35 C ATOM 1256 C GLU B 52 64.724 21.301 21.761 1.00 19.51 C ATOM 1257 O GLU B 52 65.521 20.356 21.648 1.00 20.71 O ATOM 1258 CB GLU B 52 65.463 23.689 21.311 1.00 18.12 C ATOM 1259 CG GLU B 52 66.917 23.365 21.678 1.00 19.44 C ATOM 1260 CD GLU B 52 67.710 24.620 21.825 1.00 24.27 C ATOM 1261 OE1 GLU B 52 67.255 25.518 22.537 1.00 23.76 O ATOM 1262 OE2 GLU B 52 68.780 24.751 21.183 1.00 28.77 O ATOM 1263 N LEU B 53 63.811 21.323 22.724 1.00 21.01 N ATOM 1264 CA LEU B 53 63.738 20.250 23.725 1.00 19.58 C ATOM 1265 C LEU B 53 63.323 18.949 23.041 1.00 20.85 C ATOM 1266 O LEU B 53 63.921 17.899 23.268 1.00 19.37 O ATOM 1267 CB LEU B 53 62.765 20.623 24.861 1.00 20.76 C ATOM 1268 CG LEU B 53 63.105 21.914 25.594 1.00 18.55 C ATOM 1269 CD1 LEU B 53 61.975 22.299 26.523 1.00 18.04 C ATOM 1270 CD2 LEU B 53 64.413 21.748 26.336 1.00 15.52 C ATOM 1271 N LEU B 54 62.343 19.070 22.143 1.00 21.29 N ATOM 1272 CA LEU B 54 61.873 17.965 21.305 1.00 22.68 C ATOM 1273 C LEU B 54 63.022 17.325 20.539 1.00 22.41 C ATOM 1274 O LEU B 54 63.215 16.104 20.596 1.00 22.67 O ATOM 1275 CB LEU B 54 60.864 18.538 20.312 1.00 23.66 C ATOM 1276 CG LEU B 54 59.738 17.646 19.828 1.00 28.74 C ATOM 1277 CD1 LEU B 54 59.038 17.094 21.065 1.00 31.69 C ATOM 1278 CD2 LEU B 54 58.805 18.518 18.997 1.00 30.19 C ATOM 1279 N ASP B 55 63.797 18.148 19.828 1.00 20.82 N ATOM 1280 CA ASP B 55 64.826 17.615 18.951 1.00 20.00 C ATOM 1281 C ASP B 55 66.005 17.150 19.809 1.00 20.09 C ATOM 1282 O ASP B 55 66.649 16.183 19.447 1.00 18.35 O ATOM 1283 CB ASP B 55 65.355 18.703 18.033 1.00 19.48 C ATOM 1284 CG ASP B 55 64.331 19.208 17.048 1.00 20.57 C ATOM 1285 OD1 ASP B 55 63.337 18.489 16.761 1.00 18.86 O ATOM 1286 OD2 ASP B 55 64.563 20.313 16.505 1.00 23.72 O ATOM 1287 N CYS B 56 66.295 17.816 20.930 1.00 20.18 N ATOM 1288 CA CYS B 56 67.622 17.626 21.601 1.00 21.01 C ATOM 1289 C CYS B 56 67.700 16.808 22.880 1.00 21.35 C ATOM 1290 O CYS B 56 68.808 16.463 23.341 1.00 20.50 O ATOM 1291 CB CYS B 56 68.302 18.974 21.863 1.00 21.23 C ATOM 1292 SG CYS B 56 68.427 20.013 20.398 1.00 23.17 S ATOM 1293 N ASP B 57 66.557 16.525 23.498 1.00 20.16 N ATOM 1294 CA ASP B 57 66.580 15.754 24.730 1.00 20.48 C ATOM 1295 C ASP B 57 66.652 14.295 24.327 1.00 21.51 C ATOM 1296 O ASP B 57 65.668 13.712 23.829 1.00 20.93 O ATOM 1297 CB ASP B 57 65.355 16.031 25.575 1.00 18.53 C ATOM 1298 CG ASP B 57 65.356 15.251 26.890 1.00 20.86 C ATOM 1299 OD1 ASP B 57 66.302 14.490 27.204 1.00 19.92 O ATOM 1300 OD2 ASP B 57 64.349 15.366 27.585 1.00 22.56 O ATOM 1301 N ARG B 58 67.842 13.741 24.515 1.00 21.45 N ATOM 1302 CA ARG B 58 68.133 12.359 24.127 1.00 22.30 C ATOM 1303 C ARG B 58 67.494 11.344 25.062 1.00 21.66 C ATOM 1304 O ARG B 58 67.383 10.171 24.698 1.00 20.71 O ATOM 1305 CB ARG B 58 69.645 12.146 24.043 1.00 22.60 C ATOM 1306 CG ARG B 58 70.240 12.906 22.810 1.00 25.50 C ATOM 1307 CD ARG B 58 71.749 13.049 22.944 1.00 35.70 C ATOM 1308 NE ARG B 58 72.031 13.749 24.206 1.00 40.93 N ATOM 1309 CZ ARG B 58 73.230 14.140 24.641 1.00 45.80 C ATOM 1310 NH1 ARG B 58 74.335 13.894 23.927 1.00 46.61 N ATOM 1311 NH2 ARG B 58 73.322 14.781 25.813 1.00 47.01 N ATOM 1312 N ARG B 59 67.109 11.782 26.260 1.00 19.37 N ATOM 1313 CA ARG B 59 66.433 10.921 27.222 1.00 20.57 C ATOM 1314 C ARG B 59 64.928 10.748 26.892 1.00 21.25 C ATOM 1315 O ARG B 59 64.318 9.736 27.315 1.00 23.08 O ATOM 1316 CB ARG B 59 66.586 11.457 28.663 1.00 19.60 C ATOM 1317 CG ARG B 59 68.018 11.473 29.234 1.00 20.40 C ATOM 1318 CD ARG B 59 67.992 12.068 30.678 1.00 22.64 C ATOM 1319 NE ARG B 59 67.689 13.499 30.592 1.00 23.44 N ATOM 1320 CZ ARG B 59 68.611 14.444 30.436 1.00 22.32 C ATOM 1321 NH1 ARG B 59 69.915 14.113 30.416 1.00 21.04 N ATOM 1322 NH2 ARG B 59 68.240 15.713 30.296 1.00 21.44 N ATOM 1323 N SER B 60 64.336 11.727 26.198 1.00 20.26 N ATOM 1324 CA SER B 60 62.917 11.708 25.784 1.00 18.27 C ATOM 1325 C SER B 60 62.800 11.166 24.380 1.00 19.61 C ATOM 1326 O SER B 60 63.821 10.917 23.739 1.00 17.35 O ATOM 1327 CB SER B 60 62.348 13.099 25.856 1.00 17.87 C ATOM 1328 OG SER B 60 62.267 13.529 27.237 1.00 16.23 O ATOM 1329 N TYR B 61 61.573 11.018 23.899 1.00 19.76 N ATOM 1330 CA TYR B 61 61.322 10.478 22.588 1.00 20.32 C ATOM 1331 C TYR B 61 60.571 11.404 21.634 1.00 20.65 C ATOM 1332 O TYR B 61 59.690 10.957 20.917 1.00 19.88 O ATOM 1333 CB TYR B 61 60.570 9.143 22.733 1.00 20.31 C ATOM 1334 CG TYR B 61 61.456 8.118 23.392 1.00 21.95 C ATOM 1335 CD1 TYR B 61 62.241 7.295 22.627 1.00 22.70 C ATOM 1336 CD2 TYR B 61 61.548 8.018 24.788 1.00 19.54 C ATOM 1337 CE1 TYR B 61 63.044 6.388 23.177 1.00 24.75 C ATOM 1338 CE2 TYR B 61 62.391 7.084 25.356 1.00 22.59 C ATOM 1339 CZ TYR B 61 63.119 6.277 24.541 1.00 24.12 C ATOM 1340 OH TYR B 61 63.979 5.320 25.006 1.00 25.51 O ATOM 1341 N GLY B 62 60.905 12.685 21.631 1.00 19.89 N ATOM 1342 CA GLY B 62 60.313 13.576 20.654 1.00 21.87 C ATOM 1343 C GLY B 62 58.801 13.627 20.801 1.00 22.56 C ATOM 1344 O GLY B 62 58.299 13.768 21.908 1.00 19.69 O ATOM 1345 N CYS B 63 58.078 13.466 19.691 1.00 22.50 N ATOM 1346 CA CYS B 63 56.612 13.496 19.759 1.00 24.45 C ATOM 1347 C CYS B 63 56.025 12.216 20.296 1.00 24.15 C ATOM 1348 O CYS B 63 54.808 12.095 20.347 1.00 26.02 O ATOM 1349 CB CYS B 63 56.012 13.721 18.369 1.00 25.01 C ATOM 1350 SG CYS B 63 56.440 15.327 17.698 1.00 31.31 S ATOM 1351 N ASN B 64 56.872 11.253 20.626 1.00 24.75 N ATOM 1352 CA ASN B 64 56.448 9.989 21.251 1.00 25.54 C ATOM 1353 C ASN B 64 56.508 10.050 22.798 1.00 23.80 C ATOM 1354 O ASN B 64 56.398 9.029 23.488 1.00 23.30 O ATOM 1355 CB ASN B 64 57.292 8.802 20.709 1.00 25.97 C ATOM 1356 CG ASN B 64 57.250 8.685 19.186 1.00 30.48 C ATOM 1357 OD1 ASN B 64 56.179 8.665 18.578 1.00 33.88 O ATOM 1358 ND2 ASN B 64 58.434 8.602 18.567 1.00 33.50 N ATOM 1359 N GLY B 65 56.696 11.244 23.352 1.00 23.61 N ATOM 1360 CA GLY B 65 56.648 11.410 24.807 1.00 22.23 C ATOM 1361 C GLY B 65 57.986 11.704 25.474 1.00 22.03 C ATOM 1362 O GLY B 65 59.052 11.528 24.891 1.00 22.07 O ATOM 1363 N GLY B 66 57.944 12.122 26.729 1.00 21.12 N ATOM 1364 CA GLY B 66 59.161 12.595 27.373 1.00 19.26 C ATOM 1365 C GLY B 66 58.868 12.935 28.807 1.00 19.98 C ATOM 1366 O GLY B 66 57.814 12.533 29.343 1.00 19.81 O ATOM 1367 N TYR B 67 59.803 13.640 29.436 1.00 18.69 N ATOM 1368 CA ATYR B 67 59.697 13.966 30.864 0.50 18.56 C ATOM 1369 CA BTYR B 67 59.623 13.998 30.844 0.50 18.30 C ATOM 1370 C TYR B 67 59.968 15.474 31.024 1.00 18.10 C ATOM 1371 O TYR B 67 61.016 15.905 30.609 1.00 19.37 O ATOM 1372 CB ATYR B 67 60.758 13.190 31.651 0.50 18.34 C ATOM 1373 CB BTYR B 67 60.478 13.131 31.767 0.50 18.09 C ATOM 1374 CG ATYR B 67 60.780 11.691 31.396 0.50 18.77 C ATOM 1375 CG BTYR B 67 60.038 11.676 31.882 0.50 16.42 C ATOM 1376 CD1ATYR B 67 59.846 10.853 31.986 0.50 17.94 C ATOM 1377 CD1BTYR B 67 58.810 11.327 32.428 0.50 14.74 C ATOM 1378 CD2ATYR B 67 61.727 11.122 30.545 0.50 18.39 C ATOM 1379 CD2BTYR B 67 60.861 10.655 31.442 0.50 14.51 C ATOM 1380 CE1ATYR B 67 59.855 9.494 31.748 0.50 17.27 C ATOM 1381 CE1BTYR B 67 58.415 9.972 32.517 0.50 16.24 C ATOM 1382 CE2ATYR B 67 61.747 9.752 30.307 0.50 20.36 C ATOM 1383 CE2BTYR B 67 60.474 9.330 31.523 0.50 14.29 C ATOM 1384 CZ ATYR B 67 60.809 8.953 30.902 0.50 17.14 C ATOM 1385 CZ BTYR B 67 59.257 8.997 32.065 0.50 12.07 C ATOM 1386 OH ATYR B 67 60.829 7.614 30.650 0.50 20.39 O ATOM 1387 OH BTYR B 67 58.926 7.664 32.135 0.50 16.71 O ATOM 1388 N PRO B 68 59.033 16.271 31.615 1.00 17.71 N ATOM 1389 CA PRO B 68 59.394 17.672 31.944 1.00 17.75 C ATOM 1390 C PRO B 68 60.690 17.770 32.765 1.00 16.70 C ATOM 1391 O PRO B 68 61.481 18.667 32.493 1.00 15.81 O ATOM 1392 CB PRO B 68 58.233 18.143 32.829 1.00 18.32 C ATOM 1393 CG PRO B 68 57.071 17.304 32.309 1.00 15.90 C ATOM 1394 CD PRO B 68 57.650 15.964 32.062 1.00 17.45 C ATOM 1395 N TRP B 69 60.944 16.863 33.721 1.00 15.84 N ATOM 1396 CA TRP B 69 62.196 17.001 34.492 1.00 15.47 C ATOM 1397 C TRP B 69 63.421 16.866 33.568 1.00 16.28 C ATOM 1398 O TRP B 69 64.464 17.477 33.805 1.00 16.67 O ATOM 1399 CB TRP B 69 62.272 15.983 35.685 1.00 15.36 C ATOM 1400 CG TRP B 69 62.195 14.524 35.263 1.00 13.86 C ATOM 1401 CD1 TRP B 69 61.128 13.700 35.399 1.00 16.11 C ATOM 1402 CD2 TRP B 69 63.254 13.730 34.785 1.00 16.03 C ATOM 1403 NE1 TRP B 69 61.435 12.441 35.013 1.00 15.50 N ATOM 1404 CE2 TRP B 69 62.731 12.428 34.575 1.00 16.34 C ATOM 1405 CE3 TRP B 69 64.591 13.994 34.437 1.00 16.75 C ATOM 1406 CZ2 TRP B 69 63.501 11.377 34.060 1.00 16.08 C ATOM 1407 CZ3 TRP B 69 65.366 12.936 33.859 1.00 18.77 C ATOM 1408 CH2 TRP B 69 64.809 11.646 33.704 1.00 15.51 C ATOM 1409 N SER B 70 63.308 15.988 32.563 1.00 16.55 N ATOM 1410 CA SER B 70 64.412 15.707 31.622 1.00 15.33 C ATOM 1411 C SER B 70 64.697 16.940 30.743 1.00 15.11 C ATOM 1412 O SER B 70 65.833 17.338 30.548 1.00 14.51 O ATOM 1413 CB SER B 70 64.090 14.454 30.798 1.00 16.54 C ATOM 1414 OG SER B 70 65.190 14.163 29.927 1.00 18.75 O ATOM 1415 N ALA B 71 63.632 17.586 30.281 1.00 14.32 N ATOM 1416 CA ALA B 71 63.758 18.880 29.585 1.00 15.36 C ATOM 1417 C ALA B 71 64.385 19.941 30.503 1.00 15.27 C ATOM 1418 O ALA B 71 65.318 20.635 30.081 1.00 17.26 O ATOM 1419 CB ALA B 71 62.370 19.342 29.136 1.00 15.87 C ATOM 1420 N LEU B 72 63.941 20.052 31.761 1.00 15.35 N ATOM 1421 CA LEU B 72 64.592 20.995 32.703 1.00 15.58 C ATOM 1422 C LEU B 72 66.067 20.661 32.951 1.00 15.17 C ATOM 1423 O LEU B 72 66.928 21.541 33.074 1.00 14.80 O ATOM 1424 CB LEU B 72 63.805 21.048 33.994 1.00 14.70 C ATOM 1425 CG LEU B 72 62.371 21.627 33.789 1.00 16.39 C ATOM 1426 CD1 LEU B 72 61.674 21.686 35.170 1.00 21.26 C ATOM 1427 CD2 LEU B 72 62.459 23.059 33.136 1.00 19.58 C ATOM 1428 N GLN B 73 66.364 19.367 33.028 1.00 15.23 N ATOM 1429 CA GLN B 73 67.732 18.923 33.254 1.00 16.31 C ATOM 1430 C GLN B 73 68.588 19.336 32.058 1.00 15.77 C ATOM 1431 O GLN B 73 69.730 19.815 32.212 1.00 16.38 O ATOM 1432 CB GLN B 73 67.690 17.412 33.430 1.00 17.09 C ATOM 1433 CG GLN B 73 68.818 16.809 34.185 1.00 24.55 C ATOM 1434 CD GLN B 73 68.456 15.374 34.641 1.00 21.33 C ATOM 1435 OE1 GLN B 73 67.626 15.162 35.552 1.00 20.93 O ATOM 1436 NE2 GLN B 73 69.074 14.422 34.021 1.00 23.56 N ATOM 1437 N LEU B 74 68.045 19.190 30.839 1.00 17.44 N ATOM 1438 CA LEU B 74 68.770 19.626 29.659 1.00 17.90 C ATOM 1439 C LEU B 74 69.066 21.156 29.735 1.00 18.75 C ATOM 1440 O LEU B 74 70.176 21.601 29.432 1.00 18.24 O ATOM 1441 CB LEU B 74 67.964 19.282 28.382 1.00 18.38 C ATOM 1442 CG LEU B 74 68.487 19.824 27.027 1.00 19.62 C ATOM 1443 CD1 LEU B 74 69.866 19.425 26.811 1.00 26.96 C ATOM 1444 CD2 LEU B 74 67.648 19.244 25.895 1.00 24.19 C ATOM 1445 N VAL B 75 68.059 21.942 30.122 1.00 18.43 N ATOM 1446 CA VAL B 75 68.209 23.396 30.117 1.00 18.02 C ATOM 1447 C VAL B 75 69.226 23.845 31.180 1.00 18.51 C ATOM 1448 O VAL B 75 69.941 24.821 30.999 1.00 16.66 O ATOM 1449 CB VAL B 75 66.836 24.109 30.327 1.00 18.58 C ATOM 1450 CG1 VAL B 75 67.041 25.657 30.415 1.00 16.46 C ATOM 1451 CG2 VAL B 75 65.911 23.777 29.148 1.00 18.36 C ATOM 1452 N ALA B 76 69.282 23.106 32.278 1.00 17.31 N ATOM 1453 CA ALA B 76 70.261 23.363 33.327 1.00 17.92 C ATOM 1454 C ALA B 76 71.655 23.005 32.851 1.00 18.66 C ATOM 1455 O ALA B 76 72.628 23.665 33.228 1.00 19.54 O ATOM 1456 CB ALA B 76 69.874 22.590 34.615 1.00 16.88 C ATOM 1457 N GLN B 77 71.770 22.002 31.986 1.00 18.51 N ATOM 1458 CA GLN B 77 73.087 21.519 31.624 1.00 19.50 C ATOM 1459 C GLN B 77 73.630 22.295 30.412 1.00 19.87 C ATOM 1460 O GLN B 77 74.816 22.648 30.384 1.00 18.71 O ATOM 1461 CB GLN B 77 73.081 19.999 31.422 1.00 18.21 C ATOM 1462 CG GLN B 77 74.501 19.390 31.156 1.00 21.36 C ATOM 1463 CD GLN B 77 74.447 17.884 31.148 1.00 24.63 C ATOM 1464 OE1 GLN B 77 73.370 17.311 31.251 1.00 24.03 O ATOM 1465 NE2 GLN B 77 75.598 17.224 31.004 1.00 28.34 N ATOM 1466 N TYR B 78 72.747 22.598 29.458 1.00 21.15 N ATOM 1467 CA TYR B 78 73.129 23.190 28.152 1.00 22.04 C ATOM 1468 C TYR B 78 72.453 24.496 27.752 1.00 22.65 C ATOM 1469 O TYR B 78 72.877 25.140 26.798 1.00 25.41 O ATOM 1470 CB TYR B 78 72.788 22.206 27.038 1.00 22.01 C ATOM 1471 CG TYR B 78 73.595 20.925 27.117 1.00 24.58 C ATOM 1472 CD1 TYR B 78 74.961 20.914 26.856 1.00 28.05 C ATOM 1473 CD2 TYR B 78 72.980 19.739 27.473 1.00 27.03 C ATOM 1474 CE1 TYR B 78 75.685 19.702 26.934 1.00 30.04 C ATOM 1475 CE2 TYR B 78 73.663 18.551 27.535 1.00 29.81 C ATOM 1476 CZ TYR B 78 75.002 18.529 27.277 1.00 31.70 C ATOM 1477 OH TYR B 78 75.643 17.310 27.364 1.00 35.80 O ATOM 1478 N GLY B 79 71.346 24.826 28.399 1.00 21.91 N ATOM 1479 CA GLY B 79 70.619 26.038 28.091 1.00 20.55 C ATOM 1480 C GLY B 79 69.608 25.822 26.985 1.00 19.45 C ATOM 1481 O GLY B 79 69.317 24.683 26.601 1.00 17.76 O ATOM 1482 N ILE B 80 69.025 26.920 26.506 1.00 19.19 N ATOM 1483 CA ILE B 80 67.903 26.863 25.571 1.00 18.61 C ATOM 1484 C ILE B 80 67.867 28.136 24.784 1.00 18.39 C ATOM 1485 O ILE B 80 68.272 29.190 25.292 1.00 17.33 O ATOM 1486 CB ILE B 80 66.526 26.708 26.319 1.00 19.01 C ATOM 1487 CG1 ILE B 80 65.387 26.356 25.315 1.00 18.69 C ATOM 1488 CG2 ILE B 80 66.216 27.950 27.203 1.00 16.55 C ATOM 1489 CD1 ILE B 80 64.083 25.803 26.027 1.00 19.34 C ATOM 1490 N HIS B 81 67.405 28.021 23.538 1.00 16.83 N ATOM 1491 CA HIS B 81 67.336 29.165 22.632 1.00 17.56 C ATOM 1492 C HIS B 81 65.931 29.771 22.613 1.00 18.40 C ATOM 1493 O HIS B 81 64.954 29.148 23.035 1.00 17.51 O ATOM 1494 CB HIS B 81 67.683 28.698 21.225 1.00 15.45 C ATOM 1495 CG HIS B 81 69.140 28.443 21.019 1.00 16.78 C ATOM 1496 ND1 HIS B 81 69.705 27.185 21.101 1.00 18.75 N ATOM 1497 CD2 HIS B 81 70.148 29.300 20.721 1.00 19.50 C ATOM 1498 CE1 HIS B 81 71.009 27.285 20.879 1.00 21.73 C ATOM 1499 NE2 HIS B 81 71.298 28.557 20.618 1.00 21.23 N ATOM 1500 N TYR B 82 65.829 30.998 22.104 1.00 19.01 N ATOM 1501 CA TYR B 82 64.519 31.631 21.923 1.00 20.14 C ATOM 1502 C TYR B 82 63.676 30.885 20.919 1.00 20.74 C ATOM 1503 O TYR B 82 64.192 30.318 19.935 1.00 20.94 O ATOM 1504 CB TYR B 82 64.687 33.062 21.409 1.00 19.13 C ATOM 1505 CG TYR B 82 65.312 34.008 22.401 1.00 20.49 C ATOM 1506 CD1 TYR B 82 64.799 34.134 23.706 1.00 17.31 C ATOM 1507 CD2 TYR B 82 66.434 34.769 22.052 1.00 19.83 C ATOM 1508 CE1 TYR B 82 65.365 35.019 24.590 1.00 19.14 C ATOM 1509 CE2 TYR B 82 67.005 35.670 22.944 1.00 18.31 C ATOM 1510 CZ TYR B 82 66.473 35.765 24.230 1.00 21.20 C ATOM 1511 OH TYR B 82 66.966 36.609 25.207 1.00 20.25 O ATOM 1512 N ARG B 83 62.368 30.985 21.126 1.00 22.53 N ATOM 1513 CA ARG B 83 61.386 30.483 20.191 1.00 24.00 C ATOM 1514 C ARG B 83 61.570 31.018 18.764 1.00 24.82 C ATOM 1515 O ARG B 83 61.548 30.216 17.843 1.00 23.35 O ATOM 1516 CB ARG B 83 59.967 30.786 20.696 1.00 24.78 C ATOM 1517 CG ARG B 83 58.929 29.793 20.175 1.00 29.95 C ATOM 1518 CD ARG B 83 57.679 29.779 21.073 1.00 35.86 C ATOM 1519 NE ARG B 83 56.937 28.506 21.000 1.00 38.97 N ATOM 1520 CZ ARG B 83 55.799 28.308 20.323 1.00 39.44 C ATOM 1521 NH1 ARG B 83 55.230 29.301 19.621 1.00 38.95 N ATOM 1522 NH2 ARG B 83 55.228 27.103 20.347 1.00 36.96 N ATOM 1523 N ASN B 84 61.772 32.336 18.563 1.00 25.14 N ATOM 1524 CA ASN B 84 61.933 32.822 17.193 1.00 26.95 C ATOM 1525 C ASN B 84 63.215 32.290 16.562 1.00 25.58 C ATOM 1526 O ASN B 84 63.289 32.179 15.357 1.00 27.27 O ATOM 1527 CB ASN B 84 61.763 34.351 17.007 1.00 27.62 C ATOM 1528 CG ASN B 84 62.454 35.171 18.095 1.00 33.99 C ATOM 1529 OD1 ASN B 84 63.602 34.888 18.493 1.00 39.77 O ATOM 1530 ND2 ASN B 84 61.770 36.233 18.555 1.00 38.49 N ATOM 1531 N THR B 85 64.206 31.955 17.380 1.00 25.09 N ATOM 1532 CA THR B 85 65.452 31.391 16.894 1.00 24.45 C ATOM 1533 C THR B 85 65.254 29.936 16.483 1.00 24.59 C ATOM 1534 O THR B 85 65.926 29.448 15.587 1.00 23.15 O ATOM 1535 CB THR B 85 66.567 31.440 17.966 1.00 23.81 C ATOM 1536 OG1 THR B 85 66.752 32.797 18.381 1.00 25.54 O ATOM 1537 CG2 THR B 85 67.893 30.953 17.404 1.00 24.25 C ATOM 1538 N TYR B 86 64.344 29.232 17.159 1.00 23.51 N ATOM 1539 CA TYR B 86 64.237 27.797 16.979 1.00 22.72 C ATOM 1540 C TYR B 86 62.727 27.514 17.062 1.00 22.56 C ATOM 1541 O TYR B 86 62.252 26.998 18.066 1.00 22.80 O ATOM 1542 CB TYR B 86 65.012 27.106 18.130 1.00 22.84 C ATOM 1543 CG TYR B 86 65.456 25.681 17.836 1.00 22.97 C ATOM 1544 CD1 TYR B 86 64.652 24.815 17.083 1.00 21.36 C ATOM 1545 CD2 TYR B 86 66.666 25.165 18.361 1.00 23.80 C ATOM 1546 CE1 TYR B 86 65.038 23.500 16.832 1.00 21.40 C ATOM 1547 CE2 TYR B 86 67.077 23.825 18.072 1.00 24.27 C ATOM 1548 CZ TYR B 86 66.235 23.009 17.323 1.00 21.56 C ATOM 1549 OH TYR B 86 66.564 21.699 17.030 1.00 20.93 O ATOM 1550 N PRO B 87 61.963 27.892 16.008 1.00 22.78 N ATOM 1551 CA PRO B 87 60.484 27.780 16.091 1.00 22.28 C ATOM 1552 C PRO B 87 59.856 26.373 16.079 1.00 21.97 C ATOM 1553 O PRO B 87 60.451 25.413 15.611 1.00 19.76 O ATOM 1554 CB PRO B 87 59.973 28.656 14.947 1.00 22.35 C ATOM 1555 CG PRO B 87 61.147 28.702 13.935 1.00 23.46 C ATOM 1556 CD PRO B 87 62.439 28.382 14.697 1.00 22.80 C ATOM 1557 N TYR B 88 58.653 26.282 16.640 1.00 22.59 N ATOM 1558 CA TYR B 88 57.943 25.004 16.753 1.00 23.35 C ATOM 1559 C TYR B 88 57.467 24.471 15.429 1.00 24.71 C ATOM 1560 O TYR B 88 56.819 25.198 14.666 1.00 26.23 O ATOM 1561 CB TYR B 88 56.736 25.144 17.675 1.00 22.91 C ATOM 1562 CG TYR B 88 56.120 23.803 18.042 1.00 21.52 C ATOM 1563 CD1 TYR B 88 56.877 22.810 18.710 1.00 21.68 C ATOM 1564 CD2 TYR B 88 54.770 23.534 17.763 1.00 20.24 C ATOM 1565 CE1 TYR B 88 56.311 21.579 19.062 1.00 18.86 C ATOM 1566 CE2 TYR B 88 54.195 22.323 18.150 1.00 18.36 C ATOM 1567 CZ TYR B 88 54.949 21.365 18.776 1.00 15.64 C ATOM 1568 OH TYR B 88 54.359 20.186 19.133 1.00 18.28 O ATOM 1569 N GLU B 89 57.786 23.215 15.142 1.00 24.88 N ATOM 1570 CA GLU B 89 57.371 22.602 13.890 1.00 25.55 C ATOM 1571 C GLU B 89 56.364 21.486 14.136 1.00 26.40 C ATOM 1572 O GLU B 89 55.732 21.023 13.197 1.00 26.56 O ATOM 1573 CB GLU B 89 58.574 22.069 13.108 1.00 25.19 C ATOM 1574 CG GLU B 89 59.581 23.150 12.788 1.00 24.73 C ATOM 1575 CD GLU B 89 60.795 22.608 12.099 1.00 27.08 C ATOM 1576 OE1 GLU B 89 60.637 22.043 10.984 1.00 26.94 O ATOM 1577 OE2 GLU B 89 61.912 22.761 12.642 1.00 27.39 O ATOM 1578 N GLY B 90 56.258 21.034 15.387 1.00 26.57 N ATOM 1579 CA GLY B 90 55.284 20.012 15.749 1.00 26.34 C ATOM 1580 C GLY B 90 55.603 18.649 15.162 1.00 25.72 C ATOM 1581 O GLY B 90 54.714 17.821 15.002 1.00 25.27 O ATOM 1582 N VAL B 91 56.878 18.421 14.862 1.00 25.14 N ATOM 1583 CA VAL B 91 57.405 17.105 14.520 1.00 25.63 C ATOM 1584 C VAL B 91 58.868 17.096 14.993 1.00 24.95 C ATOM 1585 O VAL B 91 59.511 18.135 14.961 1.00 25.08 O ATOM 1586 CB VAL B 91 57.299 16.865 12.993 1.00 26.26 C ATOM 1587 CG1 VAL B 91 57.978 17.967 12.248 1.00 26.71 C ATOM 1588 CG2 VAL B 91 57.864 15.526 12.588 1.00 28.88 C ATOM 1589 N GLN B 92 59.403 15.951 15.402 1.00 23.50 N ATOM 1590 CA GLN B 92 60.794 15.936 15.807 1.00 23.51 C ATOM 1591 C GLN B 92 61.714 15.927 14.580 1.00 24.50 C ATOM 1592 O GLN B 92 61.489 15.195 13.642 1.00 22.76 O ATOM 1593 CB GLN B 92 61.120 14.728 16.649 1.00 23.71 C ATOM 1594 CG GLN B 92 62.483 14.871 17.318 1.00 22.06 C ATOM 1595 CD GLN B 92 62.914 13.600 18.027 1.00 25.91 C ATOM 1596 OE1 GLN B 92 62.673 12.500 17.536 1.00 25.65 O ATOM 1597 NE2 GLN B 92 63.513 13.748 19.231 1.00 22.64 N ATOM 1598 N ARG B 93 62.754 16.733 14.631 1.00 24.93 N ATOM 1599 CA AARG B 93 63.780 16.771 13.596 0.50 25.97 C ATOM 1600 CA BARG B 93 63.770 16.707 13.588 0.50 26.03 C ATOM 1601 C ARG B 93 65.130 16.614 14.273 1.00 25.94 C ATOM 1602 O ARG B 93 65.194 16.314 15.473 1.00 26.87 O ATOM 1603 CB AARG B 93 63.714 18.100 12.864 0.50 25.92 C ATOM 1604 CB BARG B 93 63.594 17.897 12.629 0.50 25.98 C ATOM 1605 CG AARG B 93 62.345 18.429 12.306 0.50 26.32 C ATOM 1606 CG BARG B 93 62.562 17.577 11.520 0.50 26.75 C ATOM 1607 CD AARG B 93 62.457 19.597 11.371 0.50 27.72 C ATOM 1608 CD BARG B 93 61.848 18.768 10.868 0.50 27.85 C ATOM 1609 NE AARG B 93 63.135 19.270 10.125 0.50 27.67 N ATOM 1610 NE BARG B 93 60.877 18.263 9.891 0.50 29.69 N ATOM 1611 CZ AARG B 93 63.342 20.149 9.154 0.50 28.43 C ATOM 1612 CZ BARG B 93 59.808 18.916 9.441 0.50 30.79 C ATOM 1613 NH1AARG B 93 62.925 21.407 9.298 0.50 27.98 N ATOM 1614 NH1BARG B 93 59.526 20.144 9.846 0.50 31.70 N ATOM 1615 NH2AARG B 93 63.954 19.775 8.036 0.50 28.38 N ATOM 1616 NH2BARG B 93 59.004 18.326 8.574 0.50 32.34 N ATOM 1617 N TYR B 94 66.205 16.838 13.535 1.00 26.13 N ATOM 1618 CA TYR B 94 67.546 16.762 14.099 1.00 26.44 C ATOM 1619 C TYR B 94 67.765 17.903 15.060 1.00 25.63 C ATOM 1620 O TYR B 94 67.183 18.968 14.871 1.00 24.81 O ATOM 1621 CB TYR B 94 68.589 16.818 12.996 1.00 27.80 C ATOM 1622 CG TYR B 94 68.559 15.589 12.112 1.00 31.89 C ATOM 1623 CD1 TYR B 94 68.895 14.331 12.639 1.00 35.61 C ATOM 1624 CD2 TYR B 94 68.170 15.664 10.776 1.00 35.79 C ATOM 1625 CE1 TYR B 94 68.872 13.184 11.856 1.00 37.96 C ATOM 1626 CE2 TYR B 94 68.152 14.505 9.956 1.00 37.55 C ATOM 1627 CZ TYR B 94 68.511 13.273 10.519 1.00 38.41 C ATOM 1628 OH TYR B 94 68.494 12.116 9.781 1.00 39.51 O ATOM 1629 N CYS B 95 68.600 17.674 16.074 1.00 24.28 N ATOM 1630 CA CYS B 95 69.000 18.722 17.016 1.00 25.37 C ATOM 1631 C CYS B 95 69.854 19.775 16.325 1.00 24.50 C ATOM 1632 O CYS B 95 70.965 19.495 15.868 1.00 23.56 O ATOM 1633 CB CYS B 95 69.762 18.152 18.210 1.00 25.15 C ATOM 1634 SG CYS B 95 70.225 19.398 19.530 1.00 31.69 S ATOM 1635 N ARG B 96 69.337 20.995 16.291 1.00 24.03 N ATOM 1636 CA ARG B 96 69.951 22.061 15.538 1.00 23.67 C ATOM 1637 C ARG B 96 70.496 23.182 16.422 1.00 23.75 C ATOM 1638 O ARG B 96 70.697 24.323 15.951 1.00 24.57 O ATOM 1639 CB ARG B 96 68.922 22.592 14.546 1.00 22.46 C ATOM 1640 CG ARG B 96 68.770 21.679 13.308 1.00 22.84 C ATOM 1641 CD ARG B 96 67.397 21.861 12.693 1.00 21.82 C ATOM 1642 NE ARG B 96 66.264 21.494 13.573 1.00 22.83 N ATOM 1643 CZ ARG B 96 65.002 21.800 13.268 1.00 24.78 C ATOM 1644 NH1 ARG B 96 64.749 22.463 12.125 1.00 26.22 N ATOM 1645 NH2 ARG B 96 63.994 21.443 14.055 1.00 24.77 N ATOM 1646 N SER B 97 70.756 22.863 17.689 1.00 23.96 N ATOM 1647 CA ASER B 97 71.176 23.859 18.669 0.50 24.20 C ATOM 1648 CA BSER B 97 71.152 23.875 18.655 0.50 24.28 C ATOM 1649 C SER B 97 72.484 24.522 18.263 1.00 25.13 C ATOM 1650 O SER B 97 72.624 25.735 18.328 1.00 23.55 O ATOM 1651 CB ASER B 97 71.333 23.221 20.042 0.50 23.99 C ATOM 1652 CB BSER B 97 71.200 23.295 20.070 0.50 24.02 C ATOM 1653 OG ASER B 97 70.112 22.668 20.458 0.50 23.51 O ATOM 1654 OG BSER B 97 71.916 22.078 20.102 0.50 24.23 O ATOM 1655 N ARG B 98 73.433 23.707 17.809 1.00 26.79 N ATOM 1656 CA ARG B 98 74.742 24.198 17.437 1.00 29.79 C ATOM 1657 C ARG B 98 74.745 25.139 16.239 1.00 30.22 C ATOM 1658 O ARG B 98 75.691 25.876 16.054 1.00 31.51 O ATOM 1659 CB ARG B 98 75.683 23.025 17.171 1.00 30.87 C ATOM 1660 CG ARG B 98 76.417 22.598 18.427 1.00 36.36 C ATOM 1661 CD ARG B 98 75.821 21.322 18.977 1.00 45.70 C ATOM 1662 NE ARG B 98 76.413 20.903 20.256 1.00 52.32 N ATOM 1663 CZ ARG B 98 77.510 20.151 20.383 1.00 54.59 C ATOM 1664 NH1 ARG B 98 78.167 19.723 19.303 1.00 55.47 N ATOM 1665 NH2 ARG B 98 77.947 19.823 21.601 1.00 55.40 N ATOM 1666 N GLU B 99 73.709 25.097 15.420 1.00 30.40 N ATOM 1667 CA GLU B 99 73.597 25.992 14.293 1.00 30.99 C ATOM 1668 C GLU B 99 72.969 27.301 14.724 1.00 30.00 C ATOM 1669 O GLU B 99 72.890 28.229 13.934 1.00 29.42 O ATOM 1670 CB GLU B 99 72.729 25.363 13.206 1.00 32.63 C ATOM 1671 CG GLU B 99 73.204 23.968 12.796 1.00 37.30 C ATOM 1672 CD GLU B 99 72.103 23.161 12.092 1.00 42.95 C ATOM 1673 OE1 GLU B 99 72.199 21.896 12.094 1.00 42.97 O ATOM 1674 OE2 GLU B 99 71.149 23.795 11.549 1.00 43.65 O ATOM 1675 N LYS B 100 72.544 27.395 15.983 1.00 27.77 N ATOM 1676 CA LYS B 100 71.767 28.549 16.395 1.00 27.86 C ATOM 1677 C LYS B 100 72.511 29.592 17.266 1.00 26.96 C ATOM 1678 O LYS B 100 71.896 30.463 17.890 1.00 27.58 O ATOM 1679 CB LYS B 100 70.428 28.068 16.985 1.00 27.16 C ATOM 1680 CG LYS B 100 69.447 27.810 15.829 1.00 28.53 C ATOM 1681 CD LYS B 100 68.414 26.804 16.146 1.00 29.64 C ATOM 1682 CE LYS B 100 67.684 26.299 14.896 1.00 28.62 C ATOM 1683 NZ LYS B 100 67.043 27.370 14.065 1.00 28.61 N ATOM 1684 N GLY B 101 73.832 29.518 17.276 1.00 25.36 N ATOM 1685 CA GLY B 101 74.625 30.359 18.151 1.00 25.04 C ATOM 1686 C GLY B 101 74.439 30.028 19.640 1.00 24.74 C ATOM 1687 O GLY B 101 73.799 29.030 19.996 1.00 23.83 O ATOM 1688 N PRO B 102 74.979 30.885 20.513 1.00 24.38 N ATOM 1689 CA PRO B 102 75.003 30.576 21.940 1.00 23.87 C ATOM 1690 C PRO B 102 73.586 30.482 22.465 1.00 22.14 C ATOM 1691 O PRO B 102 72.672 31.094 21.900 1.00 20.58 O ATOM 1692 CB PRO B 102 75.719 31.788 22.550 1.00 24.91 C ATOM 1693 CG PRO B 102 76.513 32.357 21.394 1.00 26.64 C ATOM 1694 CD PRO B 102 75.600 32.190 20.221 1.00 24.85 C ATOM 1695 N TYR B 103 73.394 29.719 23.544 1.00 22.22 N ATOM 1696 CA TYR B 103 72.056 29.598 24.112 1.00 21.42 C ATOM 1697 C TYR B 103 71.608 30.971 24.630 1.00 21.41 C ATOM 1698 O TYR B 103 72.462 31.859 24.867 1.00 21.80 O ATOM 1699 CB TYR B 103 72.048 28.575 25.220 1.00 21.95 C ATOM 1700 CG TYR B 103 72.981 28.920 26.379 1.00 27.47 C ATOM 1701 CD1 TYR B 103 72.658 29.942 27.312 1.00 28.88 C ATOM 1702 CD2 TYR B 103 74.153 28.184 26.600 1.00 30.72 C ATOM 1703 CE1 TYR B 103 73.503 30.235 28.393 1.00 31.59 C ATOM 1704 CE2 TYR B 103 74.998 28.471 27.702 1.00 30.48 C ATOM 1705 CZ TYR B 103 74.668 29.501 28.567 1.00 33.67 C ATOM 1706 OH TYR B 103 75.484 29.783 29.636 1.00 35.80 O ATOM 1707 N ALA B 104 70.289 31.151 24.741 1.00 21.15 N ATOM 1708 CA ALA B 104 69.674 32.419 25.172 1.00 21.16 C ATOM 1709 C ALA B 104 69.673 32.490 26.690 1.00 21.45 C ATOM 1710 O ALA B 104 70.022 33.502 27.242 1.00 22.18 O ATOM 1711 CB ALA B 104 68.234 32.555 24.612 1.00 21.12 C ATOM 1712 N ALA B 105 69.320 31.394 27.354 1.00 21.49 N ATOM 1713 CA ALA B 105 69.263 31.318 28.820 1.00 22.53 C ATOM 1714 C ALA B 105 69.694 29.924 29.257 1.00 21.72 C ATOM 1715 O ALA B 105 69.566 28.972 28.511 1.00 22.94 O ATOM 1716 CB ALA B 105 67.832 31.567 29.335 1.00 23.52 C ATOM 1717 N LYS B 106 70.177 29.822 30.478 1.00 21.99 N ATOM 1718 CA LYS B 106 70.473 28.521 31.054 1.00 22.28 C ATOM 1719 C LYS B 106 70.060 28.590 32.515 1.00 21.77 C ATOM 1720 O LYS B 106 70.134 29.649 33.134 1.00 22.39 O ATOM 1721 CB LYS B 106 71.942 28.225 30.892 1.00 22.48 C ATOM 1722 CG LYS B 106 72.448 27.020 31.558 1.00 25.39 C ATOM 1723 CD LYS B 106 73.972 27.106 31.500 1.00 24.95 C ATOM 1724 CE LYS B 106 74.577 25.942 32.230 1.00 29.44 C ATOM 1725 NZ LYS B 106 74.122 25.971 33.683 1.00 27.63 N ATOM 1726 N THR B 107 69.569 27.488 33.047 1.00 18.95 N ATOM 1727 CA THR B 107 69.167 27.493 34.458 1.00 19.08 C ATOM 1728 C THR B 107 70.284 26.878 35.246 1.00 19.01 C ATOM 1729 O THR B 107 71.275 26.400 34.666 1.00 19.55 O ATOM 1730 CB THR B 107 67.851 26.720 34.632 1.00 18.48 C ATOM 1731 OG1 THR B 107 68.031 25.422 34.059 1.00 20.25 O ATOM 1732 CG2 THR B 107 66.734 27.496 33.899 1.00 16.89 C ATOM 1733 N ASP B 108 70.128 26.888 36.562 1.00 19.13 N ATOM 1734 CA ASP B 108 71.138 26.395 37.463 1.00 20.35 C ATOM 1735 C ASP B 108 70.877 24.987 37.979 1.00 18.87 C ATOM 1736 O ASP B 108 71.775 24.351 38.515 1.00 20.71 O ATOM 1737 CB ASP B 108 71.264 27.375 38.628 1.00 21.22 C ATOM 1738 CG ASP B 108 71.767 28.714 38.155 1.00 23.27 C ATOM 1739 OD1 ASP B 108 72.732 28.713 37.367 1.00 29.16 O ATOM 1740 OD2 ASP B 108 71.203 29.748 38.517 1.00 28.13 O ATOM 1741 N GLY B 109 69.686 24.459 37.755 1.00 17.32 N ATOM 1742 CA GLY B 109 69.419 23.110 38.224 1.00 16.66 C ATOM 1743 C GLY B 109 67.914 22.880 38.105 1.00 17.00 C ATOM 1744 O GLY B 109 67.195 23.706 37.555 1.00 17.09 O ATOM 1745 N VAL B 110 67.475 21.727 38.617 1.00 18.14 N ATOM 1746 CA VAL B 110 66.057 21.293 38.592 1.00 18.94 C ATOM 1747 C VAL B 110 65.748 20.772 39.936 1.00 18.36 C ATOM 1748 O VAL B 110 66.544 20.001 40.471 1.00 17.72 O ATOM 1749 CB VAL B 110 65.862 20.035 37.692 1.00 21.52 C ATOM 1750 CG1 VAL B 110 64.323 19.724 37.467 1.00 19.25 C ATOM 1751 CG2 VAL B 110 66.561 20.204 36.429 1.00 19.39 C ATOM 1752 N ARG B 111 64.592 21.152 40.495 1.00 17.69 N ATOM 1753 CA ARG B 111 64.206 20.644 41.776 1.00 16.36 C ATOM 1754 C ARG B 111 62.800 20.063 41.691 1.00 15.92 C ATOM 1755 O ARG B 111 61.960 20.532 40.906 1.00 15.93 O ATOM 1756 CB ARG B 111 64.292 21.725 42.883 1.00 17.26 C ATOM 1757 CG ARG B 111 65.717 21.959 43.463 1.00 15.91 C ATOM 1758 CD ARG B 111 65.671 23.205 44.406 1.00 22.64 C ATOM 1759 NE ARG B 111 67.054 23.600 44.723 1.00 27.58 N ATOM 1760 CZ ARG B 111 67.478 24.837 44.988 1.00 27.62 C ATOM 1761 NH1 ARG B 111 66.642 25.875 44.986 1.00 23.61 N ATOM 1762 NH2 ARG B 111 68.780 25.030 45.199 1.00 30.28 N ATOM 1763 N GLN B 112 62.610 18.987 42.422 1.00 16.73 N ATOM 1764 CA GLN B 112 61.264 18.369 42.567 1.00 16.40 C ATOM 1765 C GLN B 112 60.614 18.893 43.833 1.00 15.97 C ATOM 1766 O GLN B 112 61.247 19.037 44.891 1.00 17.59 O ATOM 1767 CB GLN B 112 61.369 16.837 42.630 1.00 16.87 C ATOM 1768 CG GLN B 112 59.934 16.255 42.452 1.00 14.96 C ATOM 1769 CD GLN B 112 59.828 14.742 42.506 1.00 16.40 C ATOM 1770 OE1 GLN B 112 58.699 14.170 42.590 1.00 20.73 O ATOM 1771 NE2 GLN B 112 60.936 14.098 42.396 1.00 14.82 N ATOM 1772 N VAL B 113 59.327 19.176 43.736 1.00 15.66 N ATOM 1773 CA VAL B 113 58.494 19.503 44.906 1.00 16.22 C ATOM 1774 C VAL B 113 58.184 18.244 45.716 1.00 14.64 C ATOM 1775 O VAL B 113 58.010 17.189 45.147 1.00 14.78 O ATOM 1776 CB VAL B 113 57.119 20.060 44.362 1.00 15.42 C ATOM 1777 CG1 VAL B 113 56.218 20.405 45.622 1.00 17.55 C ATOM 1778 CG2 VAL B 113 57.359 21.334 43.587 1.00 15.05 C ATOM 1779 N GLN B 114 58.158 18.298 47.062 1.00 16.10 N ATOM 1780 CA GLN B 114 57.717 17.131 47.805 1.00 16.58 C ATOM 1781 C GLN B 114 56.393 16.639 47.212 1.00 17.79 C ATOM 1782 O GLN B 114 55.424 17.403 47.146 1.00 18.56 O ATOM 1783 CB GLN B 114 57.487 17.497 49.286 1.00 18.52 C ATOM 1784 CG GLN B 114 56.942 16.345 50.103 1.00 17.92 C ATOM 1785 CD GLN B 114 56.576 16.795 51.518 1.00 24.02 C ATOM 1786 OE1 GLN B 114 55.979 17.853 51.724 1.00 25.00 O ATOM 1787 NE2 GLN B 114 56.960 16.020 52.474 1.00 23.32 N ATOM 1788 N PRO B 115 56.337 15.363 46.805 1.00 17.32 N ATOM 1789 CA PRO B 115 55.133 14.936 46.100 1.00 18.23 C ATOM 1790 C PRO B 115 53.976 14.566 47.001 1.00 17.77 C ATOM 1791 O PRO B 115 54.142 14.435 48.252 1.00 16.81 O ATOM 1792 CB PRO B 115 55.605 13.713 45.295 1.00 19.93 C ATOM 1793 CG PRO B 115 56.644 13.071 46.233 1.00 17.55 C ATOM 1794 CD PRO B 115 57.383 14.319 46.796 1.00 16.82 C ATOM 1795 N TYR B 116 52.796 14.481 46.376 1.00 17.48 N ATOM 1796 CA TYR B 116 51.554 14.144 47.075 1.00 17.49 C ATOM 1797 C TYR B 116 51.289 15.044 48.267 1.00 18.78 C ATOM 1798 O TYR B 116 50.852 14.551 49.280 1.00 17.50 O ATOM 1799 CB TYR B 116 51.600 12.689 47.532 1.00 19.19 C ATOM 1800 CG TYR B 116 51.985 11.756 46.404 1.00 18.33 C ATOM 1801 CD1 TYR B 116 51.108 11.489 45.360 1.00 24.86 C ATOM 1802 CD2 TYR B 116 53.237 11.182 46.386 1.00 23.01 C ATOM 1803 CE1 TYR B 116 51.483 10.649 44.305 1.00 25.19 C ATOM 1804 CE2 TYR B 116 53.640 10.347 45.341 1.00 27.83 C ATOM 1805 CZ TYR B 116 52.744 10.080 44.314 1.00 26.36 C ATOM 1806 OH TYR B 116 53.131 9.235 43.291 1.00 32.87 O ATOM 1807 N ASN B 117 51.561 16.345 48.131 1.00 18.16 N ATOM 1808 CA ASN B 117 51.407 17.269 49.225 1.00 17.62 C ATOM 1809 C ASN B 117 50.925 18.599 48.627 1.00 17.35 C ATOM 1810 O ASN B 117 51.657 19.306 47.904 1.00 16.33 O ATOM 1811 CB ASN B 117 52.720 17.407 50.097 1.00 18.25 C ATOM 1812 CG ASN B 117 52.501 18.244 51.316 1.00 19.11 C ATOM 1813 OD1 ASN B 117 52.350 19.460 51.225 1.00 19.69 O ATOM 1814 ND2 ASN B 117 52.410 17.592 52.494 1.00 22.40 N ATOM 1815 N GLU B 118 49.665 18.930 48.898 1.00 16.15 N ATOM 1816 CA GLU B 118 49.088 20.109 48.278 1.00 16.64 C ATOM 1817 C GLU B 118 49.831 21.369 48.739 1.00 15.90 C ATOM 1818 O GLU B 118 50.184 22.218 47.909 1.00 15.81 O ATOM 1819 CB GLU B 118 47.613 20.229 48.686 1.00 17.29 C ATOM 1820 CG GLU B 118 46.939 21.482 48.161 1.00 16.65 C ATOM 1821 CD GLU B 118 45.441 21.393 48.338 1.00 22.03 C ATOM 1822 OE1 GLU B 118 44.814 20.499 47.692 1.00 21.65 O ATOM 1823 OE2 GLU B 118 44.913 22.200 49.112 1.00 18.51 O ATOM 1824 N GLY B 119 50.087 21.483 50.050 1.00 14.54 N ATOM 1825 CA GLY B 119 50.754 22.670 50.638 1.00 14.94 C ATOM 1826 C GLY B 119 52.141 22.877 50.022 1.00 15.67 C ATOM 1827 O GLY B 119 52.508 23.996 49.689 1.00 16.57 O ATOM 1828 N ALA B 120 52.889 21.801 49.805 1.00 14.16 N ATOM 1829 CA ALA B 120 54.236 21.935 49.263 1.00 14.68 C ATOM 1830 C ALA B 120 54.135 22.538 47.838 1.00 15.68 C ATOM 1831 O ALA B 120 54.908 23.428 47.464 1.00 15.61 O ATOM 1832 CB ALA B 120 54.924 20.576 49.227 1.00 14.59 C ATOM 1833 N LEU B 121 53.136 22.086 47.086 1.00 15.82 N ATOM 1834 CA LEU B 121 52.979 22.535 45.702 1.00 15.77 C ATOM 1835 C LEU B 121 52.554 24.012 45.710 1.00 16.34 C ATOM 1836 O LEU B 121 53.065 24.805 44.932 1.00 17.17 O ATOM 1837 CB LEU B 121 51.958 21.685 44.976 1.00 15.79 C ATOM 1838 CG LEU B 121 51.690 22.157 43.537 1.00 16.06 C ATOM 1839 CD1 LEU B 121 52.979 22.340 42.603 1.00 15.95 C ATOM 1840 CD2 LEU B 121 50.635 21.260 42.815 1.00 17.40 C ATOM 1841 N LEU B 122 51.611 24.387 46.576 1.00 14.92 N ATOM 1842 CA LEU B 122 51.195 25.805 46.652 1.00 16.41 C ATOM 1843 C LEU B 122 52.392 26.721 47.022 1.00 16.50 C ATOM 1844 O LEU B 122 52.517 27.817 46.518 1.00 17.00 O ATOM 1845 CB LEU B 122 50.128 25.985 47.755 1.00 14.81 C ATOM 1846 CG LEU B 122 48.817 25.212 47.477 1.00 15.67 C ATOM 1847 CD1 LEU B 122 47.784 25.373 48.645 1.00 17.79 C ATOM 1848 CD2 LEU B 122 48.176 25.613 46.143 1.00 19.29 C ATOM 1849 N TYR B 123 53.199 26.310 47.981 1.00 16.73 N ATOM 1850 CA ATYR B 123 54.371 27.114 48.326 0.50 18.09 C ATOM 1851 CA BTYR B 123 54.416 27.075 48.347 0.50 17.46 C ATOM 1852 C TYR B 123 55.283 27.338 47.112 1.00 17.88 C ATOM 1853 O TYR B 123 55.788 28.470 46.904 1.00 17.13 O ATOM 1854 CB ATYR B 123 55.100 26.517 49.525 0.50 18.56 C ATOM 1855 CB BTYR B 123 55.233 26.366 49.446 0.50 17.62 C ATOM 1856 CG ATYR B 123 54.523 26.991 50.838 0.50 22.27 C ATOM 1857 CG BTYR B 123 56.473 27.151 49.871 0.50 18.20 C ATOM 1858 CD1ATYR B 123 55.086 28.065 51.532 0.50 24.40 C ATOM 1859 CD1BTYR B 123 56.388 28.126 50.840 0.50 18.74 C ATOM 1860 CD2ATYR B 123 53.395 26.376 51.387 0.50 26.30 C ATOM 1861 CD2BTYR B 123 57.713 26.959 49.234 0.50 21.82 C ATOM 1862 CE1ATYR B 123 54.539 28.486 52.747 0.50 23.99 C ATOM 1863 CE1BTYR B 123 57.516 28.871 51.219 0.50 21.32 C ATOM 1864 CE2ATYR B 123 52.861 26.790 52.579 0.50 25.42 C ATOM 1865 CE2BTYR B 123 58.848 27.697 49.613 0.50 21.07 C ATOM 1866 CZ ATYR B 123 53.432 27.843 53.250 0.50 24.89 C ATOM 1867 CZ BTYR B 123 58.727 28.641 50.601 0.50 20.47 C ATOM 1868 OH ATYR B 123 52.863 28.245 54.433 0.50 30.17 O ATOM 1869 OH BTYR B 123 59.823 29.388 50.964 0.50 23.52 O ATOM 1870 N SER B 124 55.478 26.298 46.295 1.00 17.54 N ATOM 1871 CA SER B 124 56.334 26.395 45.130 1.00 18.57 C ATOM 1872 C SER B 124 55.713 27.316 44.066 1.00 18.31 C ATOM 1873 O SER B 124 56.404 28.179 43.524 1.00 15.89 O ATOM 1874 CB SER B 124 56.617 24.995 44.557 1.00 19.01 C ATOM 1875 OG SER B 124 57.289 24.192 45.560 1.00 19.54 O ATOM 1876 N ILE B 125 54.409 27.138 43.789 1.00 17.69 N ATOM 1877 CA ILE B 125 53.698 28.033 42.866 1.00 16.43 C ATOM 1878 C ILE B 125 53.772 29.501 43.363 1.00 16.13 C ATOM 1879 O ILE B 125 53.936 30.407 42.556 1.00 17.30 O ATOM 1880 CB ILE B 125 52.210 27.638 42.694 1.00 15.64 C ATOM 1881 CG1 ILE B 125 52.086 26.235 42.051 1.00 14.30 C ATOM 1882 CG2 ILE B 125 51.438 28.721 41.873 1.00 18.08 C ATOM 1883 CD1 ILE B 125 50.642 25.619 42.154 1.00 11.54 C ATOM 1884 N ALA B 126 53.691 29.758 44.678 1.00 15.20 N ATOM 1885 CA ALA B 126 53.828 31.131 45.136 1.00 15.32 C ATOM 1886 C ALA B 126 55.189 31.742 44.788 1.00 16.29 C ATOM 1887 O ALA B 126 55.306 32.983 44.699 1.00 16.60 O ATOM 1888 CB ALA B 126 53.510 31.271 46.687 1.00 15.40 C ATOM 1889 N ASN B 127 56.213 30.892 44.658 1.00 14.53 N ATOM 1890 CA ASN B 127 57.546 31.318 44.216 1.00 16.74 C ATOM 1891 C ASN B 127 57.722 31.501 42.734 1.00 16.02 C ATOM 1892 O ASN B 127 58.442 32.423 42.290 1.00 16.12 O ATOM 1893 CB ASN B 127 58.620 30.368 44.751 1.00 17.29 C ATOM 1894 CG ASN B 127 58.869 30.607 46.230 1.00 22.59 C ATOM 1895 OD1 ASN B 127 58.649 31.718 46.722 1.00 25.38 O ATOM 1896 ND2 ASN B 127 59.277 29.569 46.953 1.00 23.65 N ATOM 1897 N GLN B 128 57.107 30.601 41.955 1.00 15.90 N ATOM 1898 CA GLN B 128 57.298 30.590 40.504 1.00 16.13 C ATOM 1899 C GLN B 128 56.381 29.551 39.893 1.00 15.72 C ATOM 1900 O GLN B 128 55.949 28.652 40.597 1.00 16.12 O ATOM 1901 CB GLN B 128 58.735 30.148 40.156 1.00 16.32 C ATOM 1902 CG GLN B 128 59.074 28.678 40.667 1.00 16.50 C ATOM 1903 CD GLN B 128 60.568 28.433 40.636 1.00 17.34 C ATOM 1904 OE1 GLN B 128 61.188 28.455 41.650 1.00 20.13 O ATOM 1905 NE2 GLN B 128 61.150 28.243 39.441 1.00 16.19 N ATOM 1906 N PRO B 129 56.139 29.626 38.549 1.00 16.28 N ATOM 1907 CA PRO B 129 55.370 28.589 37.882 1.00 16.72 C ATOM 1908 C PRO B 129 56.047 27.209 37.990 1.00 17.90 C ATOM 1909 O PRO B 129 57.285 27.094 37.915 1.00 17.21 O ATOM 1910 CB PRO B 129 55.381 29.036 36.426 1.00 16.13 C ATOM 1911 CG PRO B 129 55.409 30.575 36.503 1.00 16.90 C ATOM 1912 CD PRO B 129 56.388 30.792 37.662 1.00 16.19 C ATOM 1913 N VAL B 130 55.228 26.174 38.117 1.00 16.91 N ATOM 1914 CA VAL B 130 55.757 24.834 38.387 1.00 16.88 C ATOM 1915 C VAL B 130 55.245 23.853 37.293 1.00 17.70 C ATOM 1916 O VAL B 130 54.066 23.932 36.870 1.00 17.73 O ATOM 1917 CB VAL B 130 55.338 24.400 39.818 1.00 16.64 C ATOM 1918 CG1 VAL B 130 55.777 22.930 40.127 1.00 17.47 C ATOM 1919 CG2 VAL B 130 55.862 25.401 40.898 1.00 17.34 C ATOM 1920 N SER B 131 56.120 22.957 36.820 1.00 18.16 N ATOM 1921 CA SER B 131 55.725 21.933 35.861 1.00 16.28 C ATOM 1922 C SER B 131 54.983 20.841 36.662 1.00 17.47 C ATOM 1923 O SER B 131 55.516 20.354 37.667 1.00 16.38 O ATOM 1924 CB SER B 131 56.939 21.255 35.215 1.00 18.87 C ATOM 1925 OG SER B 131 56.499 20.151 34.386 1.00 16.89 O ATOM 1926 N VAL B 132 53.779 20.476 36.231 1.00 16.57 N ATOM 1927 CA VAL B 132 52.962 19.468 36.950 1.00 16.24 C ATOM 1928 C VAL B 132 52.367 18.502 35.922 1.00 16.26 C ATOM 1929 O VAL B 132 52.303 18.804 34.699 1.00 16.70 O ATOM 1930 CB VAL B 132 51.823 20.101 37.868 1.00 17.75 C ATOM 1931 CG1 VAL B 132 52.428 21.073 38.974 1.00 16.10 C ATOM 1932 CG2 VAL B 132 50.808 20.811 36.959 1.00 17.50 C ATOM 1933 N VAL B 133 51.935 17.345 36.416 1.00 17.89 N ATOM 1934 CA VAL B 133 51.370 16.310 35.565 1.00 16.84 C ATOM 1935 C VAL B 133 49.972 15.976 36.094 1.00 18.55 C ATOM 1936 O VAL B 133 49.671 16.198 37.263 1.00 15.91 O ATOM 1937 CB VAL B 133 52.270 15.072 35.531 1.00 17.27 C ATOM 1938 CG1 VAL B 133 53.637 15.465 34.952 1.00 17.04 C ATOM 1939 CG2 VAL B 133 52.415 14.436 36.973 1.00 15.25 C ATOM 1940 N LEU B 134 49.105 15.520 35.211 1.00 18.41 N ATOM 1941 CA LEU B 134 47.743 15.083 35.642 1.00 19.75 C ATOM 1942 C LEU B 134 47.199 14.048 34.660 1.00 19.56 C ATOM 1943 O LEU B 134 47.834 13.787 33.642 1.00 20.03 O ATOM 1944 CB LEU B 134 46.763 16.265 35.721 1.00 20.97 C ATOM 1945 CG LEU B 134 46.793 17.451 34.768 1.00 23.98 C ATOM 1946 CD1 LEU B 134 46.475 17.042 33.383 1.00 23.48 C ATOM 1947 CD2 LEU B 134 45.728 18.464 35.278 1.00 26.42 C ATOM 1948 N GLU B 135 46.013 13.484 34.974 1.00 19.92 N ATOM 1949 CA AGLU B 135 45.289 12.560 34.112 0.50 19.95 C ATOM 1950 CA BGLU B 135 45.348 12.586 34.034 0.50 20.69 C ATOM 1951 C GLU B 135 44.348 13.402 33.237 1.00 20.95 C ATOM 1952 O GLU B 135 43.337 13.925 33.764 1.00 20.46 O ATOM 1953 CB AGLU B 135 44.488 11.605 35.020 0.50 19.60 C ATOM 1954 CB BGLU B 135 44.696 11.353 34.689 0.50 21.24 C ATOM 1955 CG AGLU B 135 44.070 10.288 34.397 0.50 19.83 C ATOM 1956 CG BGLU B 135 44.554 10.204 33.640 0.50 24.21 C ATOM 1957 CD AGLU B 135 43.178 10.481 33.197 0.50 20.26 C ATOM 1958 CD BGLU B 135 43.911 8.935 34.164 0.50 27.75 C ATOM 1959 OE1AGLU B 135 41.940 10.624 33.361 0.50 20.59 O ATOM 1960 OE1BGLU B 135 42.860 9.023 34.816 0.50 30.66 O ATOM 1961 OE2AGLU B 135 43.731 10.493 32.092 0.50 16.28 O ATOM 1962 OE2BGLU B 135 44.432 7.826 33.898 0.50 33.10 O ATOM 1963 N ALA B 136 44.661 13.539 31.955 1.00 19.51 N ATOM 1964 CA ALA B 136 43.907 14.418 31.057 1.00 20.22 C ATOM 1965 C ALA B 136 43.286 13.707 29.827 1.00 19.58 C ATOM 1966 O ALA B 136 42.708 14.369 28.976 1.00 19.00 O ATOM 1967 CB ALA B 136 44.813 15.515 30.590 1.00 20.71 C ATOM 1968 N ALA B 137 43.402 12.383 29.729 1.00 19.06 N ATOM 1969 CA ALA B 137 42.864 11.713 28.559 1.00 19.25 C ATOM 1970 C ALA B 137 41.339 11.635 28.534 1.00 19.79 C ATOM 1971 O ALA B 137 40.776 11.354 27.470 1.00 20.60 O ATOM 1972 CB ALA B 137 43.449 10.342 28.374 1.00 19.23 C ATOM 1973 N GLY B 138 40.669 11.852 29.670 1.00 19.18 N ATOM 1974 CA GLY B 138 39.210 11.645 29.753 1.00 20.56 C ATOM 1975 C GLY B 138 38.377 12.622 28.943 1.00 21.21 C ATOM 1976 O GLY B 138 38.786 13.760 28.683 1.00 20.15 O ATOM 1977 N LYS B 139 37.183 12.189 28.551 1.00 21.62 N ATOM 1978 CA LYS B 139 36.333 12.987 27.662 1.00 22.62 C ATOM 1979 C LYS B 139 35.970 14.330 28.310 1.00 22.90 C ATOM 1980 O LYS B 139 35.939 15.386 27.641 1.00 23.84 O ATOM 1981 CB LYS B 139 35.058 12.183 27.297 1.00 22.49 C ATOM 1982 CG LYS B 139 33.921 13.032 26.704 1.00 24.53 C ATOM 1983 CD LYS B 139 32.672 12.194 26.327 1.00 28.82 C ATOM 1984 CE LYS B 139 31.673 12.078 27.484 1.00 30.69 C ATOM 1985 NZ LYS B 139 30.342 11.559 27.017 1.00 36.19 N ATOM 1986 N ASP B 140 35.697 14.295 29.609 1.00 23.68 N ATOM 1987 CA ASP B 140 35.275 15.492 30.339 1.00 24.66 C ATOM 1988 C ASP B 140 36.410 16.520 30.449 1.00 23.71 C ATOM 1989 O ASP B 140 36.175 17.735 30.358 1.00 22.56 O ATOM 1990 CB ASP B 140 34.697 15.134 31.699 1.00 25.72 C ATOM 1991 CG ASP B 140 33.394 14.335 31.589 1.00 28.72 C ATOM 1992 OD1 ASP B 140 32.788 14.222 30.508 1.00 34.67 O ATOM 1993 OD2 ASP B 140 32.964 13.795 32.599 1.00 34.14 O ATOM 1994 N PHE B 141 37.645 16.035 30.577 1.00 22.53 N ATOM 1995 CA PHE B 141 38.792 16.938 30.484 1.00 21.14 C ATOM 1996 C PHE B 141 38.933 17.501 29.062 1.00 20.45 C ATOM 1997 O PHE B 141 39.174 18.709 28.891 1.00 20.96 O ATOM 1998 CB PHE B 141 40.078 16.212 30.884 1.00 19.85 C ATOM 1999 CG PHE B 141 41.202 17.129 31.181 1.00 19.91 C ATOM 2000 CD1 PHE B 141 41.960 17.680 30.149 1.00 20.87 C ATOM 2001 CD2 PHE B 141 41.499 17.460 32.494 1.00 21.78 C ATOM 2002 CE1 PHE B 141 43.009 18.566 30.420 1.00 20.37 C ATOM 2003 CE2 PHE B 141 42.577 18.323 32.786 1.00 21.37 C ATOM 2004 CZ PHE B 141 43.332 18.852 31.766 1.00 20.09 C ATOM 2005 N GLN B 142 38.790 16.644 28.044 1.00 21.13 N ATOM 2006 CA GLN B 142 38.799 17.099 26.630 1.00 19.91 C ATOM 2007 C GLN B 142 37.741 18.174 26.382 1.00 20.07 C ATOM 2008 O GLN B 142 38.006 19.202 25.744 1.00 18.49 O ATOM 2009 CB GLN B 142 38.551 15.943 25.646 1.00 21.35 C ATOM 2010 CG GLN B 142 39.537 14.771 25.771 1.00 26.36 C ATOM 2011 CD GLN B 142 40.961 15.174 25.472 1.00 31.57 C ATOM 2012 OE1 GLN B 142 41.218 15.868 24.487 1.00 35.65 O ATOM 2013 NE2 GLN B 142 41.904 14.761 26.334 1.00 34.34 N ATOM 2014 N LEU B 143 36.558 17.960 26.938 1.00 18.55 N ATOM 2015 CA LEU B 143 35.453 18.832 26.665 1.00 19.90 C ATOM 2016 C LEU B 143 35.331 19.991 27.663 1.00 19.26 C ATOM 2017 O LEU B 143 34.321 20.746 27.623 1.00 18.09 O ATOM 2018 CB LEU B 143 34.151 18.015 26.625 1.00 19.99 C ATOM 2019 CG LEU B 143 34.076 16.988 25.461 1.00 22.15 C ATOM 2020 CD1 LEU B 143 32.715 16.305 25.461 1.00 23.99 C ATOM 2021 CD2 LEU B 143 34.399 17.572 24.041 1.00 27.07 C ATOM 2022 N TYR B 144 36.331 20.143 28.542 1.00 18.91 N ATOM 2023 CA TYR B 144 36.289 21.188 29.574 1.00 18.24 C ATOM 2024 C TYR B 144 36.178 22.558 28.901 1.00 18.44 C ATOM 2025 O TYR B 144 36.993 22.910 28.039 1.00 16.64 O ATOM 2026 CB TYR B 144 37.543 21.145 30.485 1.00 17.48 C ATOM 2027 CG TYR B 144 37.722 22.305 31.429 1.00 18.11 C ATOM 2028 CD1 TYR B 144 36.993 22.379 32.637 1.00 16.11 C ATOM 2029 CD2 TYR B 144 38.681 23.296 31.173 1.00 16.92 C ATOM 2030 CE1 TYR B 144 37.180 23.425 33.538 1.00 13.42 C ATOM 2031 CE2 TYR B 144 38.859 24.353 32.050 1.00 14.93 C ATOM 2032 CZ TYR B 144 38.123 24.406 33.228 1.00 14.08 C ATOM 2033 OH TYR B 144 38.330 25.434 34.083 1.00 16.76 O ATOM 2034 N ARG B 145 35.192 23.325 29.348 1.00 19.29 N ATOM 2035 CA ARG B 145 34.972 24.667 28.848 1.00 20.95 C ATOM 2036 C ARG B 145 35.171 25.711 29.948 1.00 22.63 C ATOM 2037 O ARG B 145 35.020 26.908 29.683 1.00 25.56 O ATOM 2038 CB ARG B 145 33.543 24.815 28.296 1.00 21.78 C ATOM 2039 CG ARG B 145 33.070 23.698 27.366 1.00 24.22 C ATOM 2040 CD ARG B 145 34.079 23.559 26.256 1.00 24.62 C ATOM 2041 NE ARG B 145 34.000 24.702 25.352 1.00 28.54 N ATOM 2042 CZ ARG B 145 34.935 25.019 24.456 1.00 32.24 C ATOM 2043 NH1 ARG B 145 36.040 24.285 24.344 1.00 30.18 N ATOM 2044 NH2 ARG B 145 34.752 26.065 23.648 1.00 29.97 N ATOM 2045 N GLY B 146 35.457 25.303 31.182 1.00 21.22 N ATOM 2046 CA GLY B 146 35.541 26.298 32.274 1.00 20.66 C ATOM 2047 C GLY B 146 34.921 25.892 33.595 1.00 19.91 C ATOM 2048 O GLY B 146 34.160 24.929 33.667 1.00 19.86 O ATOM 2049 N GLY B 147 35.265 26.610 34.659 1.00 19.79 N ATOM 2050 CA GLY B 147 34.787 26.260 35.983 1.00 19.26 C ATOM 2051 C GLY B 147 35.909 25.541 36.730 1.00 19.82 C ATOM 2052 O GLY B 147 37.000 25.260 36.166 1.00 19.17 O ATOM 2053 N ILE B 148 35.652 25.245 37.995 1.00 19.05 N ATOM 2054 CA ILE B 148 36.622 24.554 38.844 1.00 19.51 C ATOM 2055 C ILE B 148 36.377 23.058 38.643 1.00 19.80 C ATOM 2056 O ILE B 148 35.282 22.536 38.932 1.00 19.96 O ATOM 2057 CB ILE B 148 36.425 24.955 40.322 1.00 20.28 C ATOM 2058 CG1 ILE B 148 36.760 26.440 40.502 1.00 19.43 C ATOM 2059 CG2 ILE B 148 37.334 24.069 41.242 1.00 21.05 C ATOM 2060 CD1 ILE B 148 36.754 26.910 41.955 1.00 20.69 C ATOM 2061 N PHE B 149 37.370 22.367 38.126 1.00 18.44 N ATOM 2062 CA PHE B 149 37.186 20.998 37.677 1.00 18.73 C ATOM 2063 C PHE B 149 37.423 20.019 38.779 1.00 20.08 C ATOM 2064 O PHE B 149 38.490 20.022 39.361 1.00 19.57 O ATOM 2065 CB PHE B 149 38.160 20.739 36.553 1.00 19.65 C ATOM 2066 CG PHE B 149 37.971 19.447 35.886 1.00 19.14 C ATOM 2067 CD1 PHE B 149 37.006 19.319 34.862 1.00 23.46 C ATOM 2068 CD2 PHE B 149 38.780 18.366 36.202 1.00 19.86 C ATOM 2069 CE1 PHE B 149 36.802 18.082 34.190 1.00 23.01 C ATOM 2070 CE2 PHE B 149 38.630 17.139 35.505 1.00 23.63 C ATOM 2071 CZ PHE B 149 37.608 17.001 34.515 1.00 23.94 C ATOM 2072 N VAL B 150 36.461 19.156 39.056 1.00 20.21 N ATOM 2073 CA VAL B 150 36.632 18.183 40.149 1.00 22.38 C ATOM 2074 C VAL B 150 36.702 16.760 39.613 1.00 23.16 C ATOM 2075 O VAL B 150 36.914 15.792 40.362 1.00 23.51 O ATOM 2076 CB VAL B 150 35.495 18.261 41.197 1.00 23.06 C ATOM 2077 CG1 VAL B 150 35.403 19.655 41.770 1.00 24.73 C ATOM 2078 CG2 VAL B 150 34.141 17.811 40.583 1.00 23.65 C ATOM 2079 N GLY B 151 36.515 16.655 38.311 1.00 23.18 N ATOM 2080 CA GLY B 151 36.503 15.374 37.619 1.00 24.10 C ATOM 2081 C GLY B 151 35.265 15.320 36.752 1.00 24.94 C ATOM 2082 O GLY B 151 34.559 16.321 36.613 1.00 25.56 O ATOM 2083 N PRO B 152 34.974 14.142 36.191 1.00 25.97 N ATOM 2084 CA PRO B 152 35.721 12.919 36.503 1.00 26.00 C ATOM 2085 C PRO B 152 37.029 12.890 35.758 1.00 26.52 C ATOM 2086 O PRO B 152 37.174 13.583 34.752 1.00 26.47 O ATOM 2087 CB PRO B 152 34.824 11.812 35.958 1.00 26.37 C ATOM 2088 CG PRO B 152 34.122 12.452 34.837 1.00 26.45 C ATOM 2089 CD PRO B 152 33.827 13.866 35.306 1.00 25.92 C ATOM 2090 N CYS B 153 37.967 12.107 36.263 1.00 26.27 N ATOM 2091 CA CYS B 153 39.269 11.917 35.630 1.00 28.09 C ATOM 2092 C CYS B 153 39.920 10.913 36.545 1.00 28.87 C ATOM 2093 O CYS B 153 39.499 10.803 37.685 1.00 30.66 O ATOM 2094 CB CYS B 153 40.079 13.238 35.587 1.00 28.32 C ATOM 2095 SG CYS B 153 40.316 13.982 37.235 1.00 27.73 S ATOM 2096 N GLY B 154 40.936 10.190 36.069 1.00 29.34 N ATOM 2097 CA GLY B 154 41.625 9.206 36.910 1.00 29.75 C ATOM 2098 C GLY B 154 42.852 9.749 37.614 1.00 29.70 C ATOM 2099 O GLY B 154 43.024 10.956 37.726 1.00 30.01 O ATOM 2100 N ASN B 155 43.716 8.843 38.051 1.00 30.32 N ATOM 2101 CA AASN B 155 44.889 9.278 38.830 0.50 30.14 C ATOM 2102 CA BASN B 155 44.874 9.102 38.910 0.50 30.48 C ATOM 2103 C ASN B 155 46.199 8.861 38.204 1.00 29.21 C ATOM 2104 O ASN B 155 47.268 9.186 38.722 1.00 30.46 O ATOM 2105 CB AASN B 155 44.829 8.744 40.267 0.50 30.91 C ATOM 2106 CB BASN B 155 44.802 8.149 40.123 0.50 30.94 C ATOM 2107 CG AASN B 155 44.121 9.687 41.224 0.50 30.77 C ATOM 2108 CG BASN B 155 44.495 6.696 39.730 0.50 32.89 C ATOM 2109 OD1AASN B 155 44.138 10.908 41.059 0.50 31.69 O ATOM 2110 OD1BASN B 155 44.314 6.377 38.542 0.50 36.21 O ATOM 2111 ND2AASN B 155 43.492 9.119 42.231 0.50 29.69 N ATOM 2112 ND2BASN B 155 44.424 5.806 40.735 0.50 33.53 N ATOM 2113 N LYS B 156 46.128 8.169 37.076 1.00 27.95 N ATOM 2114 CA ALYS B 156 47.316 7.725 36.351 0.50 25.79 C ATOM 2115 CA BLYS B 156 47.345 7.751 36.356 0.50 25.43 C ATOM 2116 C LYS B 156 47.701 8.803 35.317 1.00 24.68 C ATOM 2117 O LYS B 156 47.081 8.931 34.276 1.00 23.54 O ATOM 2118 CB ALYS B 156 47.048 6.352 35.730 0.50 26.45 C ATOM 2119 CB BLYS B 156 47.248 6.326 35.785 0.50 25.81 C ATOM 2120 CG ALYS B 156 45.625 6.203 35.157 0.50 26.57 C ATOM 2121 CG BLYS B 156 47.586 6.203 34.286 0.50 24.37 C ATOM 2122 CD ALYS B 156 44.620 5.643 36.160 0.50 27.16 C ATOM 2123 CD BLYS B 156 46.338 6.532 33.442 0.50 22.72 C ATOM 2124 CE ALYS B 156 43.234 6.219 35.929 0.50 24.09 C ATOM 2125 CE BLYS B 156 46.698 7.018 32.063 0.50 18.50 C ATOM 2126 NZ ALYS B 156 42.886 6.351 34.458 0.50 24.62 N ATOM 2127 NZ BLYS B 156 48.002 6.445 31.576 0.50 18.20 N ATOM 2128 N VAL B 157 48.711 9.588 35.645 1.00 22.57 N ATOM 2129 CA VAL B 157 48.990 10.802 34.913 1.00 21.81 C ATOM 2130 C VAL B 157 49.496 10.528 33.517 1.00 21.00 C ATOM 2131 O VAL B 157 50.172 9.532 33.258 1.00 21.58 O ATOM 2132 CB VAL B 157 49.949 11.742 35.682 1.00 21.37 C ATOM 2133 CG1 VAL B 157 49.330 12.022 37.060 1.00 20.64 C ATOM 2134 CG2 VAL B 157 51.314 11.092 35.903 1.00 21.17 C ATOM 2135 N ASP B 158 49.192 11.447 32.633 1.00 20.45 N ATOM 2136 CA ASP B 158 49.497 11.203 31.229 1.00 19.36 C ATOM 2137 C ASP B 158 49.696 12.490 30.488 1.00 18.32 C ATOM 2138 O ASP B 158 49.868 12.490 29.271 1.00 21.13 O ATOM 2139 CB ASP B 158 48.362 10.365 30.630 1.00 20.67 C ATOM 2140 CG ASP B 158 46.985 11.013 30.853 1.00 23.47 C ATOM 2141 OD1 ASP B 158 46.933 12.245 31.123 1.00 21.15 O ATOM 2142 OD2 ASP B 158 45.970 10.291 30.755 1.00 27.12 O ATOM 2143 N HIS B 159 49.697 13.610 31.197 1.00 15.84 N ATOM 2144 CA HIS B 159 49.817 14.877 30.553 1.00 17.02 C ATOM 2145 C HIS B 159 50.589 15.805 31.448 1.00 16.90 C ATOM 2146 O HIS B 159 50.437 15.750 32.679 1.00 18.75 O ATOM 2147 CB HIS B 159 48.393 15.428 30.237 1.00 16.16 C ATOM 2148 CG HIS B 159 48.370 16.703 29.435 1.00 14.81 C ATOM 2149 ND1 HIS B 159 49.328 17.040 28.500 1.00 18.38 N ATOM 2150 CD2 HIS B 159 47.447 17.699 29.397 1.00 15.04 C ATOM 2151 CE1 HIS B 159 49.023 18.206 27.953 1.00 16.78 C ATOM 2152 NE2 HIS B 159 47.873 18.620 28.472 1.00 16.72 N ATOM 2153 N ALA B 160 51.459 16.605 30.848 1.00 15.35 N ATOM 2154 CA ALA B 160 52.282 17.556 31.553 1.00 16.87 C ATOM 2155 C ALA B 160 51.835 18.961 31.187 1.00 16.37 C ATOM 2156 O ALA B 160 51.717 19.306 30.012 1.00 17.07 O ATOM 2157 CB ALA B 160 53.770 17.375 31.205 1.00 17.40 C ATOM 2158 N VAL B 161 51.639 19.779 32.202 1.00 15.51 N ATOM 2159 CA VAL B 161 51.166 21.147 32.028 1.00 14.91 C ATOM 2160 C VAL B 161 51.918 22.006 33.075 1.00 16.42 C ATOM 2161 O VAL B 161 52.918 21.541 33.644 1.00 17.58 O ATOM 2162 CB VAL B 161 49.619 21.170 32.230 1.00 14.41 C ATOM 2163 CG1 VAL B 161 48.900 20.439 31.100 1.00 16.12 C ATOM 2164 CG2 VAL B 161 49.228 20.553 33.625 1.00 14.99 C ATOM 2165 N ALA B 162 51.446 23.217 33.373 1.00 15.38 N ATOM 2166 CA ALA B 162 52.206 24.066 34.261 1.00 17.10 C ATOM 2167 C ALA B 162 51.224 24.797 35.172 1.00 16.55 C ATOM 2168 O ALA B 162 50.202 25.329 34.713 1.00 18.03 O ATOM 2169 CB ALA B 162 53.020 25.073 33.479 1.00 17.76 C ATOM 2170 N ALA B 163 51.508 24.779 36.450 1.00 16.53 N ATOM 2171 CA ALA B 163 50.677 25.487 37.384 1.00 15.28 C ATOM 2172 C ALA B 163 51.229 26.916 37.471 1.00 15.96 C ATOM 2173 O ALA B 163 52.431 27.110 37.789 1.00 17.77 O ATOM 2174 CB ALA B 163 50.757 24.800 38.705 1.00 15.86 C ATOM 2175 N VAL B 164 50.396 27.899 37.160 1.00 15.13 N ATOM 2176 CA VAL B 164 50.869 29.305 37.142 1.00 15.80 C ATOM 2177 C VAL B 164 50.142 30.125 38.203 1.00 15.87 C ATOM 2178 O VAL B 164 50.274 31.334 38.248 1.00 17.38 O ATOM 2179 CB VAL B 164 50.740 29.947 35.708 1.00 14.79 C ATOM 2180 CG1 VAL B 164 51.613 29.193 34.729 1.00 15.59 C ATOM 2181 CG2 VAL B 164 49.280 29.944 35.193 1.00 15.81 C ATOM 2182 N GLY B 165 49.352 29.467 39.043 1.00 15.95 N ATOM 2183 CA GLY B 165 48.709 30.172 40.116 1.00 16.23 C ATOM 2184 C GLY B 165 47.756 29.298 40.905 1.00 16.22 C ATOM 2185 O GLY B 165 47.698 28.077 40.719 1.00 13.50 O ATOM 2186 N TYR B 166 47.036 29.915 41.834 1.00 15.82 N ATOM 2187 CA TYR B 166 46.060 29.169 42.641 1.00 16.21 C ATOM 2188 C TYR B 166 45.139 30.157 43.348 1.00 17.44 C ATOM 2189 O TYR B 166 45.393 31.365 43.336 1.00 17.84 O ATOM 2190 CB TYR B 166 46.760 28.246 43.661 1.00 16.26 C ATOM 2191 CG TYR B 166 47.552 28.986 44.696 1.00 14.06 C ATOM 2192 CD1 TYR B 166 46.894 29.645 45.785 1.00 19.40 C ATOM 2193 CD2 TYR B 166 48.946 29.051 44.607 1.00 14.76 C ATOM 2194 CE1 TYR B 166 47.610 30.348 46.717 1.00 18.67 C ATOM 2195 CE2 TYR B 166 49.691 29.748 45.575 1.00 19.91 C ATOM 2196 CZ TYR B 166 49.003 30.391 46.615 1.00 19.26 C ATOM 2197 OH TYR B 166 49.676 31.103 47.591 1.00 22.22 O ATOM 2198 N GLY B 167 44.092 29.636 43.978 1.00 17.98 N ATOM 2199 CA GLY B 167 43.223 30.400 44.847 1.00 18.44 C ATOM 2200 C GLY B 167 42.744 29.501 45.985 1.00 20.00 C ATOM 2201 O GLY B 167 43.239 28.370 46.144 1.00 20.01 O ATOM 2202 N PRO B 168 41.787 29.972 46.801 1.00 18.83 N ATOM 2203 CA PRO B 168 41.327 29.183 47.956 1.00 19.88 C ATOM 2204 C PRO B 168 40.890 27.760 47.592 1.00 20.04 C ATOM 2205 O PRO B 168 41.131 26.838 48.373 1.00 20.60 O ATOM 2206 CB PRO B 168 40.103 29.985 48.469 1.00 18.72 C ATOM 2207 CG PRO B 168 40.470 31.363 48.180 1.00 19.62 C ATOM 2208 CD PRO B 168 41.238 31.337 46.851 1.00 20.42 C ATOM 2209 N ASN B 169 40.275 27.556 46.434 1.00 18.78 N ATOM 2210 CA ASN B 169 39.852 26.185 46.116 1.00 20.03 C ATOM 2211 C ASN B 169 40.227 25.637 44.729 1.00 18.77 C ATOM 2212 O ASN B 169 39.595 24.713 44.233 1.00 17.07 O ATOM 2213 CB ASN B 169 38.375 26.013 46.365 1.00 23.22 C ATOM 2214 CG ASN B 169 37.643 27.181 45.946 1.00 29.97 C ATOM 2215 OD1 ASN B 169 37.920 27.720 44.845 1.00 33.93 O ATOM 2216 ND2 ASN B 169 36.767 27.702 46.838 1.00 35.96 N ATOM 2217 N TYR B 170 41.318 26.138 44.164 1.00 16.86 N ATOM 2218 CA TYR B 170 41.761 25.630 42.861 1.00 16.52 C ATOM 2219 C TYR B 170 43.245 25.895 42.636 1.00 15.75 C ATOM 2220 O TYR B 170 43.822 26.771 43.248 1.00 14.80 O ATOM 2221 CB TYR B 170 40.986 26.263 41.704 1.00 18.09 C ATOM 2222 CG TYR B 170 41.191 27.763 41.620 1.00 17.09 C ATOM 2223 CD1 TYR B 170 42.252 28.297 40.877 1.00 15.23 C ATOM 2224 CD2 TYR B 170 40.328 28.640 42.305 1.00 17.72 C ATOM 2225 CE1 TYR B 170 42.469 29.710 40.816 1.00 11.95 C ATOM 2226 CE2 TYR B 170 40.518 30.032 42.239 1.00 17.53 C ATOM 2227 CZ TYR B 170 41.576 30.550 41.473 1.00 18.43 C ATOM 2228 OH TYR B 170 41.787 31.914 41.407 1.00 19.11 O ATOM 2229 N ILE B 171 43.825 25.151 41.692 1.00 14.77 N ATOM 2230 CA ILE B 171 45.132 25.480 41.171 1.00 15.12 C ATOM 2231 C ILE B 171 44.929 25.849 39.686 1.00 15.46 C ATOM 2232 O ILE B 171 44.156 25.212 38.996 1.00 15.60 O ATOM 2233 CB ILE B 171 46.091 24.306 41.418 1.00 15.94 C ATOM 2234 CG1 ILE B 171 46.320 24.166 42.960 1.00 17.83 C ATOM 2235 CG2 ILE B 171 47.435 24.503 40.671 1.00 15.63 C ATOM 2236 CD1 ILE B 171 46.950 22.816 43.319 1.00 19.50 C ATOM 2237 N LEU B 172 45.566 26.925 39.256 1.00 16.58 N ATOM 2238 CA LEU B 172 45.424 27.470 37.918 1.00 17.56 C ATOM 2239 C LEU B 172 46.516 26.873 37.022 1.00 17.83 C ATOM 2240 O LEU B 172 47.725 26.944 37.387 1.00 17.52 O ATOM 2241 CB LEU B 172 45.594 28.990 38.040 1.00 18.85 C ATOM 2242 CG LEU B 172 45.600 29.715 36.693 1.00 14.93 C ATOM 2243 CD1 LEU B 172 44.199 29.660 35.932 1.00 19.31 C ATOM 2244 CD2 LEU B 172 45.998 31.195 36.832 1.00 17.68 C ATOM 2245 N ILE B 173 46.105 26.307 35.873 1.00 16.57 N ATOM 2246 CA ILE B 173 46.969 25.475 35.075 1.00 16.33 C ATOM 2247 C ILE B 173 46.930 26.005 33.623 1.00 15.47 C ATOM 2248 O ILE B 173 45.833 26.146 33.017 1.00 13.72 O ATOM 2249 CB ILE B 173 46.420 24.053 35.011 1.00 16.59 C ATOM 2250 CG1 ILE B 173 46.373 23.326 36.343 1.00 21.07 C ATOM 2251 CG2 ILE B 173 47.221 23.192 34.020 1.00 18.94 C ATOM 2252 CD1 ILE B 173 47.695 23.174 36.962 1.00 22.82 C ATOM 2253 N LYS B 174 48.106 26.253 33.067 1.00 15.44 N ATOM 2254 CA LYS B 174 48.217 26.586 31.649 1.00 16.54 C ATOM 2255 C LYS B 174 48.354 25.289 30.877 1.00 17.30 C ATOM 2256 O LYS B 174 49.296 24.549 31.107 1.00 15.92 O ATOM 2257 CB LYS B 174 49.479 27.460 31.440 1.00 17.77 C ATOM 2258 CG LYS B 174 49.674 27.950 29.995 1.00 16.17 C ATOM 2259 CD LYS B 174 50.987 28.784 29.847 1.00 19.53 C ATOM 2260 CE LYS B 174 50.995 29.588 28.566 1.00 20.54 C ATOM 2261 NZ LYS B 174 52.340 30.247 28.215 1.00 17.54 N ATOM 2262 N ASN B 175 47.415 25.028 29.969 1.00 18.31 N ATOM 2263 CA ASN B 175 47.468 23.906 29.040 1.00 18.41 C ATOM 2264 C ASN B 175 48.073 24.372 27.694 1.00 18.48 C ATOM 2265 O ASN B 175 48.256 25.592 27.424 1.00 17.90 O ATOM 2266 CB ASN B 175 46.034 23.308 28.876 1.00 16.67 C ATOM 2267 CG ASN B 175 46.008 21.846 28.329 1.00 15.88 C ATOM 2268 OD1 ASN B 175 47.028 21.217 28.121 1.00 15.30 O ATOM 2269 ND2 ASN B 175 44.806 21.309 28.148 1.00 15.59 N ATOM 2270 N SER B 176 48.391 23.400 26.848 1.00 18.09 N ATOM 2271 CA SER B 176 49.038 23.648 25.585 1.00 17.51 C ATOM 2272 C SER B 176 48.148 23.187 24.431 1.00 18.43 C ATOM 2273 O SER B 176 48.645 22.673 23.411 1.00 18.67 O ATOM 2274 CB SER B 176 50.396 22.902 25.606 1.00 16.07 C ATOM 2275 OG SER B 176 50.193 21.515 25.890 1.00 16.63 O ATOM 2276 N TRP B 177 46.833 23.379 24.567 1.00 19.25 N ATOM 2277 CA TRP B 177 45.890 22.953 23.537 1.00 19.22 C ATOM 2278 C TRP B 177 45.197 24.160 22.780 1.00 20.47 C ATOM 2279 O TRP B 177 44.116 24.017 22.173 1.00 20.30 O ATOM 2280 CB TRP B 177 44.833 21.984 24.115 1.00 18.97 C ATOM 2281 CG TRP B 177 45.341 20.667 24.676 1.00 17.36 C ATOM 2282 CD1 TRP B 177 46.610 20.143 24.574 1.00 16.49 C ATOM 2283 CD2 TRP B 177 44.580 19.726 25.475 1.00 18.48 C ATOM 2284 NE1 TRP B 177 46.674 18.930 25.262 1.00 15.53 N ATOM 2285 CE2 TRP B 177 45.451 18.657 25.816 1.00 17.25 C ATOM 2286 CE3 TRP B 177 43.249 19.695 25.944 1.00 13.96 C ATOM 2287 CZ2 TRP B 177 45.034 17.567 26.575 1.00 17.74 C ATOM 2288 CZ3 TRP B 177 42.829 18.603 26.685 1.00 15.82 C ATOM 2289 CH2 TRP B 177 43.719 17.551 27.006 1.00 16.05 C ATOM 2290 N GLY B 178 45.848 25.324 22.813 1.00 19.54 N ATOM 2291 CA GLY B 178 45.287 26.520 22.227 1.00 19.23 C ATOM 2292 C GLY B 178 44.293 27.183 23.168 1.00 18.88 C ATOM 2293 O GLY B 178 43.851 26.570 24.147 1.00 16.53 O ATOM 2294 N THR B 179 43.898 28.405 22.814 1.00 17.71 N ATOM 2295 CA THR B 179 42.959 29.209 23.562 1.00 17.29 C ATOM 2296 C THR B 179 41.502 28.827 23.419 1.00 16.60 C ATOM 2297 O THR B 179 40.664 29.333 24.186 1.00 19.07 O ATOM 2298 CB THR B 179 43.119 30.698 23.205 1.00 16.16 C ATOM 2299 OG1 THR B 179 42.904 30.847 21.799 1.00 18.84 O ATOM 2300 CG2 THR B 179 44.568 31.115 23.554 1.00 15.96 C ATOM 2301 N GLY B 180 41.184 27.910 22.507 1.00 16.97 N ATOM 2302 CA GLY B 180 39.780 27.513 22.263 1.00 15.40 C ATOM 2303 C GLY B 180 39.329 26.479 23.282 1.00 16.47 C ATOM 2304 O GLY B 180 38.137 26.156 23.352 1.00 16.13 O ATOM 2305 N TRP B 181 40.299 25.934 24.028 1.00 16.26 N ATOM 2306 CA TRP B 181 40.049 24.990 25.111 1.00 16.12 C ATOM 2307 C TRP B 181 39.945 25.679 26.483 1.00 16.53 C ATOM 2308 O TRP B 181 40.781 26.496 26.850 1.00 16.02 O ATOM 2309 CB TRP B 181 41.182 23.959 25.172 1.00 15.72 C ATOM 2310 CG TRP B 181 40.940 22.842 26.205 1.00 14.13 C ATOM 2311 CD1 TRP B 181 40.192 21.705 26.015 1.00 15.13 C ATOM 2312 CD2 TRP B 181 41.427 22.772 27.554 1.00 14.69 C ATOM 2313 NE1 TRP B 181 40.184 20.950 27.147 1.00 17.91 N ATOM 2314 CE2 TRP B 181 40.951 21.560 28.110 1.00 15.64 C ATOM 2315 CE3 TRP B 181 42.242 23.595 28.328 1.00 13.46 C ATOM 2316 CZ2 TRP B 181 41.257 21.156 29.451 1.00 16.34 C ATOM 2317 CZ3 TRP B 181 42.556 23.204 29.664 1.00 17.44 C ATOM 2318 CH2 TRP B 181 42.061 21.982 30.193 1.00 12.99 C ATOM 2319 N GLY B 182 38.964 25.265 27.268 1.00 16.55 N ATOM 2320 CA GLY B 182 38.889 25.641 28.681 1.00 16.97 C ATOM 2321 C GLY B 182 38.757 27.151 28.842 1.00 17.48 C ATOM 2322 O GLY B 182 38.023 27.783 28.097 1.00 17.34 O ATOM 2323 N GLU B 183 39.462 27.724 29.815 1.00 17.28 N ATOM 2324 CA GLU B 183 39.279 29.146 30.096 1.00 17.50 C ATOM 2325 C GLU B 183 40.321 29.924 29.319 1.00 16.96 C ATOM 2326 O GLU B 183 41.382 30.223 29.831 1.00 17.03 O ATOM 2327 CB GLU B 183 39.334 29.395 31.606 1.00 15.91 C ATOM 2328 CG GLU B 183 38.173 28.686 32.337 1.00 17.80 C ATOM 2329 CD GLU B 183 38.125 28.889 33.870 1.00 19.59 C ATOM 2330 OE1 GLU B 183 39.162 29.189 34.488 1.00 18.01 O ATOM 2331 OE2 GLU B 183 37.031 28.744 34.458 1.00 18.23 O ATOM 2332 N ASN B 184 40.048 30.176 28.027 1.00 16.38 N ATOM 2333 CA ASN B 184 41.075 30.739 27.178 1.00 15.12 C ATOM 2334 C ASN B 184 42.381 29.938 27.268 1.00 14.77 C ATOM 2335 O ASN B 184 43.460 30.526 27.279 1.00 15.65 O ATOM 2336 CB ASN B 184 41.334 32.222 27.541 1.00 16.02 C ATOM 2337 CG ASN B 184 40.099 33.148 27.251 1.00 19.63 C ATOM 2338 OD1 ASN B 184 40.082 33.858 26.251 1.00 25.42 O ATOM 2339 ND2 ASN B 184 39.110 33.147 28.139 1.00 18.98 N ATOM 2340 N GLY B 185 42.290 28.605 27.323 1.00 13.35 N ATOM 2341 CA GLY B 185 43.514 27.772 27.304 1.00 13.93 C ATOM 2342 C GLY B 185 43.938 27.265 28.683 1.00 15.13 C ATOM 2343 O GLY B 185 44.863 26.428 28.771 1.00 17.56 O ATOM 2344 N TYR B 186 43.278 27.781 29.710 1.00 15.71 N ATOM 2345 CA TYR B 186 43.586 27.447 31.117 1.00 16.02 C ATOM 2346 C TYR B 186 42.533 26.532 31.742 1.00 15.94 C ATOM 2347 O TYR B 186 41.384 26.480 31.290 1.00 14.75 O ATOM 2348 CB TYR B 186 43.733 28.710 31.976 1.00 17.90 C ATOM 2349 CG TYR B 186 44.993 29.469 31.658 1.00 18.99 C ATOM 2350 CD1 TYR B 186 45.052 30.326 30.582 1.00 15.45 C ATOM 2351 CD2 TYR B 186 46.127 29.342 32.473 1.00 16.77 C ATOM 2352 CE1 TYR B 186 46.250 31.051 30.292 1.00 14.03 C ATOM 2353 CE2 TYR B 186 47.294 30.050 32.190 1.00 17.51 C ATOM 2354 CZ TYR B 186 47.342 30.856 31.048 1.00 17.53 C ATOM 2355 OH TYR B 186 48.485 31.570 30.732 1.00 21.25 O ATOM 2356 N ILE B 187 42.897 25.885 32.844 1.00 16.06 N ATOM 2357 CA ILE B 187 41.931 25.105 33.628 1.00 16.21 C ATOM 2358 C ILE B 187 42.212 25.389 35.100 1.00 16.63 C ATOM 2359 O ILE B 187 43.376 25.516 35.496 1.00 16.61 O ATOM 2360 CB ILE B 187 41.980 23.545 33.342 1.00 15.24 C ATOM 2361 CG1 ILE B 187 41.017 22.794 34.278 1.00 14.24 C ATOM 2362 CG2 ILE B 187 43.362 22.974 33.546 1.00 14.42 C ATOM 2363 CD1 ILE B 187 40.565 21.432 33.808 1.00 11.75 C ATOM 2364 N ARG B 188 41.140 25.566 35.867 1.00 16.48 N ATOM 2365 CA ARG B 188 41.216 25.589 37.302 1.00 16.29 C ATOM 2366 C ARG B 188 40.794 24.224 37.842 1.00 16.98 C ATOM 2367 O ARG B 188 39.674 23.766 37.630 1.00 16.45 O ATOM 2368 CB ARG B 188 40.366 26.753 37.867 1.00 14.87 C ATOM 2369 CG ARG B 188 40.977 28.149 37.478 1.00 13.65 C ATOM 2370 CD ARG B 188 40.100 29.306 38.002 1.00 15.61 C ATOM 2371 NE ARG B 188 38.775 29.238 37.372 1.00 16.54 N ATOM 2372 CZ ARG B 188 37.614 29.475 37.974 1.00 15.87 C ATOM 2373 NH1 ARG B 188 37.552 29.865 39.273 1.00 15.67 N ATOM 2374 NH2 ARG B 188 36.491 29.322 37.272 1.00 13.88 N ATOM 2375 N ILE B 189 41.755 23.534 38.454 1.00 18.06 N ATOM 2376 CA ILE B 189 41.530 22.224 39.063 1.00 17.06 C ATOM 2377 C ILE B 189 41.267 22.401 40.568 1.00 18.23 C ATOM 2378 O ILE B 189 42.023 23.072 41.274 1.00 18.59 O ATOM 2379 CB ILE B 189 42.781 21.276 38.887 1.00 17.89 C ATOM 2380 CG1 ILE B 189 43.233 21.171 37.415 1.00 18.26 C ATOM 2381 CG2 ILE B 189 42.531 19.891 39.574 1.00 17.90 C ATOM 2382 CD1 ILE B 189 42.428 20.200 36.599 1.00 20.60 C ATOM 2383 N LYS B 190 40.205 21.763 41.056 1.00 17.39 N ATOM 2384 CA LYS B 190 39.812 21.862 42.459 1.00 19.46 C ATOM 2385 C LYS B 190 40.980 21.439 43.362 1.00 19.71 C ATOM 2386 O LYS B 190 41.691 20.490 43.045 1.00 19.11 O ATOM 2387 CB LYS B 190 38.622 20.961 42.741 1.00 19.78 C ATOM 2388 CG LYS B 190 38.123 21.002 44.174 1.00 23.33 C ATOM 2389 CD LYS B 190 37.100 22.058 44.335 1.00 29.69 C ATOM 2390 CE LYS B 190 36.576 22.085 45.810 1.00 28.42 C ATOM 2391 NZ LYS B 190 35.449 21.188 46.036 1.00 33.28 N ATOM 2392 N ARG B 191 41.176 22.154 44.461 1.00 19.96 N ATOM 2393 CA ARG B 191 42.128 21.718 45.481 1.00 19.88 C ATOM 2394 C ARG B 191 41.387 21.625 46.805 1.00 21.38 C ATOM 2395 O ARG B 191 40.236 22.062 46.915 1.00 19.72 O ATOM 2396 CB ARG B 191 43.319 22.679 45.580 1.00 19.62 C ATOM 2397 CG ARG B 191 43.031 23.987 46.312 1.00 19.48 C ATOM 2398 CD ARG B 191 44.374 24.737 46.444 1.00 19.40 C ATOM 2399 NE ARG B 191 44.288 26.010 47.162 1.00 18.30 N ATOM 2400 CZ ARG B 191 44.349 26.160 48.486 1.00 19.82 C ATOM 2401 NH1 ARG B 191 44.456 25.125 49.297 1.00 21.93 N ATOM 2402 NH2 ARG B 191 44.305 27.382 48.990 1.00 21.28 N ATOM 2403 N GLY B 192 42.076 21.115 47.821 1.00 22.67 N ATOM 2404 CA GLY B 192 41.522 21.066 49.165 1.00 24.81 C ATOM 2405 C GLY B 192 40.596 19.873 49.330 1.00 26.18 C ATOM 2406 O GLY B 192 39.773 19.867 50.208 1.00 26.81 O ATOM 2407 N THR B 193 40.734 18.856 48.485 1.00 27.30 N ATOM 2408 CA THR B 193 39.854 17.665 48.586 1.00 28.82 C ATOM 2409 C THR B 193 40.305 16.664 49.704 1.00 30.02 C ATOM 2410 O THR B 193 39.535 15.801 50.135 1.00 29.64 O ATOM 2411 CB THR B 193 39.702 16.969 47.214 1.00 28.30 C ATOM 2412 OG1 THR B 193 40.937 16.336 46.856 1.00 28.08 O ATOM 2413 CG2 THR B 193 39.346 18.021 46.137 1.00 28.58 C ATOM 2414 N GLY B 194 41.549 16.797 50.172 1.00 31.32 N ATOM 2415 CA GLY B 194 42.116 15.859 51.150 1.00 32.09 C ATOM 2416 C GLY B 194 42.732 14.630 50.489 1.00 32.95 C ATOM 2417 O GLY B 194 43.318 13.761 51.156 1.00 32.51 O ATOM 2418 N ASN B 195 42.583 14.530 49.171 1.00 32.44 N ATOM 2419 CA ASN B 195 43.160 13.416 48.447 1.00 32.71 C ATOM 2420 C ASN B 195 44.584 13.789 48.086 1.00 30.99 C ATOM 2421 O ASN B 195 44.805 14.764 47.359 1.00 31.50 O ATOM 2422 CB ASN B 195 42.378 13.136 47.161 1.00 33.83 C ATOM 2423 CG ASN B 195 43.038 12.080 46.283 1.00 38.86 C ATOM 2424 OD1 ASN B 195 43.993 11.372 46.688 1.00 41.76 O ATOM 2425 ND2 ASN B 195 42.521 11.956 45.051 1.00 44.61 N ATOM 2426 N SER B 196 45.517 12.978 48.556 1.00 28.89 N ATOM 2427 CA SER B 196 46.946 13.260 48.453 1.00 27.37 C ATOM 2428 C SER B 196 47.482 13.118 47.064 1.00 25.34 C ATOM 2429 O SER B 196 48.558 13.628 46.789 1.00 22.26 O ATOM 2430 CB SER B 196 47.728 12.287 49.313 1.00 29.52 C ATOM 2431 OG SER B 196 47.824 12.815 50.620 1.00 33.06 O ATOM 2432 N TYR B 197 46.789 12.378 46.202 1.00 23.80 N ATOM 2433 CA TYR B 197 47.216 12.334 44.796 1.00 23.04 C ATOM 2434 C TYR B 197 46.937 13.669 44.074 1.00 20.86 C ATOM 2435 O TYR B 197 47.480 13.931 42.986 1.00 20.31 O ATOM 2436 CB TYR B 197 46.472 11.253 44.042 1.00 25.25 C ATOM 2437 CG TYR B 197 46.924 9.842 44.329 1.00 30.58 C ATOM 2438 CD1 TYR B 197 48.057 9.326 43.718 1.00 36.60 C ATOM 2439 CD2 TYR B 197 46.194 9.027 45.193 1.00 35.78 C ATOM 2440 CE1 TYR B 197 48.482 8.032 43.971 1.00 41.56 C ATOM 2441 CE2 TYR B 197 46.596 7.718 45.453 1.00 40.24 C ATOM 2442 CZ TYR B 197 47.752 7.233 44.841 1.00 43.24 C ATOM 2443 OH TYR B 197 48.177 5.944 45.082 1.00 48.05 O ATOM 2444 N GLY B 198 46.027 14.439 44.661 1.00 18.24 N ATOM 2445 CA GLY B 198 45.383 15.601 44.052 1.00 19.43 C ATOM 2446 C GLY B 198 44.330 15.216 43.030 1.00 18.04 C ATOM 2447 O GLY B 198 44.260 14.058 42.609 1.00 18.04 O ATOM 2448 N VAL B 199 43.480 16.169 42.664 1.00 18.45 N ATOM 2449 CA VAL B 199 42.494 15.937 41.618 1.00 19.10 C ATOM 2450 C VAL B 199 43.200 15.590 40.266 1.00 20.33 C ATOM 2451 O VAL B 199 44.178 16.242 39.874 1.00 19.77 O ATOM 2452 CB VAL B 199 41.476 17.145 41.525 1.00 18.96 C ATOM 2453 CG1 VAL B 199 40.518 16.977 40.341 1.00 16.82 C ATOM 2454 CG2 VAL B 199 40.650 17.276 42.800 1.00 19.16 C ATOM 2455 N CYS B 200 42.691 14.578 39.563 1.00 20.61 N ATOM 2456 CA CYS B 200 43.353 14.017 38.386 1.00 20.69 C ATOM 2457 C CYS B 200 44.860 13.690 38.562 1.00 20.04 C ATOM 2458 O CYS B 200 45.599 13.717 37.581 1.00 19.90 O ATOM 2459 CB CYS B 200 43.172 14.907 37.145 1.00 21.39 C ATOM 2460 SG CYS B 200 41.519 15.591 36.956 1.00 26.07 S ATOM 2461 N GLY B 201 45.284 13.411 39.788 1.00 19.19 N ATOM 2462 CA GLY B 201 46.689 13.054 40.099 1.00 19.02 C ATOM 2463 C GLY B 201 47.661 14.231 40.100 1.00 18.97 C ATOM 2464 O GLY B 201 48.889 14.039 39.945 1.00 19.27 O ATOM 2465 N LEU B 202 47.120 15.435 40.316 1.00 17.72 N ATOM 2466 CA LEU B 202 47.863 16.667 40.093 1.00 17.40 C ATOM 2467 C LEU B 202 49.130 16.768 40.956 1.00 15.80 C ATOM 2468 O LEU B 202 50.068 17.561 40.645 1.00 17.80 O ATOM 2469 CB LEU B 202 46.959 17.860 40.388 1.00 17.88 C ATOM 2470 CG LEU B 202 47.516 19.277 40.186 1.00 19.43 C ATOM 2471 CD1 LEU B 202 48.106 19.415 38.799 1.00 20.02 C ATOM 2472 CD2 LEU B 202 46.412 20.327 40.381 1.00 20.94 C ATOM 2473 N TYR B 203 49.177 16.029 42.060 1.00 17.10 N ATOM 2474 CA TYR B 203 50.337 16.177 42.960 1.00 16.31 C ATOM 2475 C TYR B 203 51.397 15.094 42.704 1.00 15.78 C ATOM 2476 O TYR B 203 52.342 14.933 43.468 1.00 14.36 O ATOM 2477 CB TYR B 203 49.916 16.207 44.432 1.00 16.55 C ATOM 2478 CG TYR B 203 48.822 17.226 44.695 1.00 17.63 C ATOM 2479 CD1 TYR B 203 48.684 18.367 43.884 1.00 17.42 C ATOM 2480 CD2 TYR B 203 47.930 17.042 45.748 1.00 16.07 C ATOM 2481 CE1 TYR B 203 47.664 19.296 44.110 1.00 20.57 C ATOM 2482 CE2 TYR B 203 46.910 17.971 46.007 1.00 16.24 C ATOM 2483 CZ TYR B 203 46.792 19.078 45.227 1.00 17.39 C ATOM 2484 OH TYR B 203 45.750 19.922 45.493 1.00 18.25 O ATOM 2485 N THR B 204 51.262 14.396 41.583 1.00 16.07 N ATOM 2486 CA THR B 204 52.097 13.227 41.387 1.00 16.88 C ATOM 2487 C THR B 204 53.567 13.607 41.205 1.00 16.36 C ATOM 2488 O THR B 204 54.452 12.950 41.753 1.00 16.30 O ATOM 2489 CB THR B 204 51.584 12.358 40.253 1.00 17.15 C ATOM 2490 OG1 THR B 204 50.289 11.855 40.670 1.00 16.22 O ATOM 2491 CG2 THR B 204 52.552 11.146 40.036 1.00 16.29 C ATOM 2492 N SER B 205 53.854 14.613 40.398 1.00 15.86 N ATOM 2493 CA SER B 205 55.268 14.783 39.976 1.00 17.45 C ATOM 2494 C SER B 205 55.496 16.193 39.494 1.00 18.10 C ATOM 2495 O SER B 205 55.169 16.508 38.347 1.00 18.37 O ATOM 2496 CB SER B 205 55.561 13.805 38.818 1.00 18.20 C ATOM 2497 OG SER B 205 56.980 13.734 38.571 1.00 20.52 O ATOM 2498 N SER B 206 56.045 17.042 40.341 1.00 16.42 N ATOM 2499 CA SER B 206 56.135 18.471 40.045 1.00 17.31 C ATOM 2500 C SER B 206 57.561 18.972 40.198 1.00 16.27 C ATOM 2501 O SER B 206 58.193 18.707 41.214 1.00 15.95 O ATOM 2502 CB SER B 206 55.239 19.264 41.038 1.00 18.61 C ATOM 2503 OG SER B 206 53.879 18.786 40.993 1.00 18.75 O ATOM 2504 N PHE B 207 57.993 19.818 39.267 1.00 15.99 N ATOM 2505 CA PHE B 207 59.406 20.224 39.098 1.00 15.93 C ATOM 2506 C PHE B 207 59.463 21.692 38.714 1.00 15.75 C ATOM 2507 O PHE B 207 58.532 22.203 38.090 1.00 13.95 O ATOM 2508 CB PHE B 207 60.039 19.459 37.938 1.00 15.53 C ATOM 2509 CG PHE B 207 60.338 18.031 38.307 1.00 16.45 C ATOM 2510 CD1 PHE B 207 59.343 17.048 38.167 1.00 14.52 C ATOM 2511 CD2 PHE B 207 61.607 17.692 38.790 1.00 13.65 C ATOM 2512 CE1 PHE B 207 59.645 15.653 38.553 1.00 14.12 C ATOM 2513 CE2 PHE B 207 61.915 16.377 39.109 1.00 18.12 C ATOM 2514 CZ PHE B 207 60.921 15.372 39.016 1.00 14.16 C ATOM 2515 N TYR B 208 60.542 22.345 39.089 1.00 15.59 N ATOM 2516 CA TYR B 208 60.715 23.729 38.743 1.00 14.81 C ATOM 2517 C TYR B 208 62.213 23.944 38.542 1.00 16.10 C ATOM 2518 O TYR B 208 63.050 23.214 39.156 1.00 14.87 O ATOM 2519 CB TYR B 208 60.163 24.650 39.844 1.00 13.77 C ATOM 2520 CG TYR B 208 60.739 24.429 41.214 1.00 19.61 C ATOM 2521 CD1 TYR B 208 61.883 25.104 41.635 1.00 20.06 C ATOM 2522 CD2 TYR B 208 60.125 23.535 42.114 1.00 18.57 C ATOM 2523 CE1 TYR B 208 62.379 24.916 42.929 1.00 19.76 C ATOM 2524 CE2 TYR B 208 60.629 23.339 43.424 1.00 21.05 C ATOM 2525 CZ TYR B 208 61.790 24.009 43.790 1.00 20.43 C ATOM 2526 OH TYR B 208 62.307 23.835 45.066 1.00 24.67 O ATOM 2527 N PRO B 209 62.551 24.882 37.657 1.00 16.82 N ATOM 2528 CA PRO B 209 63.978 25.260 37.386 1.00 16.19 C ATOM 2529 C PRO B 209 64.548 26.104 38.497 1.00 17.14 C ATOM 2530 O PRO B 209 63.870 27.015 38.933 1.00 17.81 O ATOM 2531 CB PRO B 209 63.871 26.112 36.154 1.00 16.17 C ATOM 2532 CG PRO B 209 62.501 26.770 36.263 1.00 16.56 C ATOM 2533 CD PRO B 209 61.609 25.677 36.833 1.00 16.09 C ATOM 2534 N VAL B 210 65.810 25.875 38.860 1.00 15.32 N ATOM 2535 CA VAL B 210 66.497 26.736 39.843 1.00 18.33 C ATOM 2536 C VAL B 210 67.240 27.737 38.975 1.00 17.97 C ATOM 2537 O VAL B 210 67.854 27.338 38.001 1.00 19.01 O ATOM 2538 CB VAL B 210 67.536 25.959 40.589 1.00 16.82 C ATOM 2539 CG1 VAL B 210 68.338 26.867 41.590 1.00 15.62 C ATOM 2540 CG2 VAL B 210 66.885 24.782 41.319 1.00 21.01 C ATOM 2541 N LYS B 211 67.186 29.008 39.333 1.00 19.79 N ATOM 2542 CA LYS B 211 67.872 30.012 38.547 1.00 22.84 C ATOM 2543 C LYS B 211 68.182 31.190 39.449 1.00 23.67 C ATOM 2544 O LYS B 211 67.291 31.761 40.053 1.00 24.08 O ATOM 2545 CB LYS B 211 66.970 30.422 37.390 1.00 22.86 C ATOM 2546 CG LYS B 211 67.413 31.656 36.629 1.00 24.13 C ATOM 2547 CD LYS B 211 68.664 31.342 35.868 1.00 28.67 C ATOM 2548 CE LYS B 211 69.103 32.574 35.063 1.00 30.21 C ATOM 2549 NZ LYS B 211 70.320 32.191 34.303 1.00 26.46 N ATOM 2550 N ASN B 212 69.446 31.555 39.599 1.00 24.34 N ATOM 2551 CA ASN B 212 69.639 32.722 40.433 1.00 27.08 C ATOM 2552 C ASN B 212 69.432 34.025 39.663 1.00 26.96 C ATOM 2553 O ASN B 212 69.359 35.066 40.292 1.00 27.37 O ATOM 2554 CB ASN B 212 70.974 32.709 41.139 1.00 27.86 C ATOM 2555 CG ASN B 212 72.101 32.411 40.236 1.00 31.86 C ATOM 2556 OD1 ASN B 212 72.242 33.073 39.204 1.00 39.48 O ATOM 2557 ND2 ASN B 212 72.933 31.425 40.592 1.00 36.85 N ATOM 2558 OXT ASN B 212 69.294 34.042 38.429 1.00 27.70 O TER 2559 ASN B 212 HETATM 2560 ZN ZN A 111 38.966 -3.739 21.212 1.00 35.25 ZN HETATM 2561 C FMT A 112 33.570 22.752 16.173 1.00 54.87 C HETATM 2562 O1 FMT A 112 32.905 21.777 16.531 1.00 55.69 O HETATM 2563 O2 FMT A 112 33.088 23.842 15.870 1.00 54.12 O HETATM 2564 C FMT A 113 39.470 -5.036 23.559 1.00 35.63 C HETATM 2565 O1 FMT A 113 38.702 -4.138 23.951 1.00 34.20 O HETATM 2566 O2 FMT A 113 39.859 -5.189 22.381 1.00 37.05 O HETATM 2567 C FMT A 114 47.063 21.374 14.682 1.00 46.31 C HETATM 2568 O1 FMT A 114 46.299 20.865 13.841 1.00 45.41 O HETATM 2569 O2 FMT A 114 46.689 21.864 15.765 1.00 46.37 O HETATM 2570 C ACY B 213 50.993 14.818 25.423 1.00 22.51 C HETATM 2571 O ACY B 213 51.699 15.544 24.653 1.00 21.55 O HETATM 2572 OXT ACY B 213 50.191 13.989 24.868 1.00 25.71 O HETATM 2573 CH3 ACY B 213 51.079 14.890 26.983 1.00 17.57 C HETATM 2574 C FMT B 214 59.931 26.837 44.457 1.00 34.10 C HETATM 2575 O1 FMT B 214 59.803 26.521 45.672 1.00 34.40 O HETATM 2576 O2 FMT B 214 60.610 27.806 44.054 1.00 33.96 O HETATM 2577 C FMT B 215 71.709 24.752 23.596 1.00 47.96 C HETATM 2578 O1 FMT B 215 71.686 23.524 23.792 1.00 47.86 O HETATM 2579 O2 FMT B 215 72.650 25.323 23.029 1.00 48.20 O HETATM 2580 C FMT B 216 73.662 18.357 23.179 1.00 73.81 C HETATM 2581 O1 FMT B 216 72.573 18.903 23.387 1.00 73.46 O HETATM 2582 O2 FMT B 216 74.631 18.891 22.630 1.00 73.65 O HETATM 2583 C FMT B 217 57.588 39.502 39.351 1.00 59.56 C HETATM 2584 O1 FMT B 217 57.879 38.998 40.446 1.00 59.51 O HETATM 2585 O2 FMT B 217 58.401 39.896 38.512 1.00 59.17 O HETATM 2586 C FMT B 218 64.318 12.890 13.596 1.00 56.54 C HETATM 2587 O1 FMT B 218 63.587 11.957 13.948 1.00 57.25 O HETATM 2588 O2 FMT B 218 65.534 12.811 13.413 1.00 55.98 O HETATM 2589 C FMT B 219 33.813 24.197 43.364 1.00 56.40 C HETATM 2590 O1 FMT B 219 33.712 23.104 42.793 1.00 56.44 O HETATM 2591 O2 FMT B 219 34.375 24.378 44.449 1.00 56.54 O HETATM 2592 C FMT B 220 63.334 41.507 38.980 1.00 49.57 C HETATM 2593 O1 FMT B 220 63.199 41.597 40.199 1.00 48.23 O HETATM 2594 O2 FMT B 220 62.717 42.191 38.151 1.00 50.85 O HETATM 2595 O HOH A 115 37.888 3.279 -0.402 1.00 26.11 O HETATM 2596 O HOH A 116 26.647 4.340 19.175 1.00 47.08 O HETATM 2597 O HOH A 117 45.146 -1.731 22.580 1.00 32.73 O HETATM 2598 O HOH A 118 46.594 1.263 12.856 1.00 53.12 O HETATM 2599 O HOH A 119 40.877 3.641 -0.690 1.00 44.54 O HETATM 2600 O HOH A 120 46.623 9.180 13.967 1.00 52.89 O HETATM 2601 O HOH A 121 48.742 12.469 17.767 1.00 34.55 O HETATM 2602 O HOH A 122 47.654 10.571 25.263 1.00 24.72 O HETATM 2603 O HOH A 123 47.475 8.201 27.310 1.00 22.88 O HETATM 2604 O HOH A 124 31.364 10.985 10.847 1.00 32.94 O HETATM 2605 O HOH A 125 34.421 12.629 11.520 1.00 37.81 O HETATM 2606 O HOH A 126 52.060 7.477 29.308 1.00 40.65 O HETATM 2607 O HOH A 127 29.759 -2.347 -0.327 1.00 41.65 O HETATM 2608 O HOH A 128 30.209 7.343 9.872 1.00 29.68 O HETATM 2609 O HOH A 129 41.506 19.523 15.180 1.00 29.33 O HETATM 2610 O HOH A 130 40.609 19.743 7.116 1.00 54.74 O HETATM 2611 O HOH A 131 31.752 -0.511 -0.023 0.50 21.81 O HETATM 2612 O HOH A 132 28.404 -5.950 12.462 1.00 53.96 O HETATM 2613 O HOH A 133 50.264 8.027 27.387 1.00 27.46 O HETATM 2614 O HOH A 134 28.261 12.450 13.532 1.00 54.60 O HETATM 2615 O HOH A 135 31.165 5.030 21.220 1.00 44.93 O HETATM 2616 O HOH A 136 47.676 0.420 23.683 1.00 50.05 O HETATM 2617 O HOH A 137 57.493 3.284 31.601 1.00 43.38 O HETATM 2618 O HOH A 138 53.411 4.783 22.631 1.00 37.25 O HETATM 2619 O HOH A 139 42.939 23.157 18.521 1.00 38.07 O HETATM 2620 O HOH A 140 36.532 -7.126 13.426 1.00 36.07 O HETATM 2621 O HOH A 141 38.237 -3.902 26.493 1.00 50.80 O HETATM 2622 O HOH A 142 35.522 -4.188 27.764 1.00 50.06 O HETATM 2623 O HOH A 143 46.392 0.438 15.709 1.00 44.07 O HETATM 2624 O HOH A 144 49.623 5.888 19.382 1.00 32.72 O HETATM 2625 O HOH A 145 49.632 8.365 18.631 1.00 47.07 O HETATM 2626 O HOH A 146 54.358 9.403 34.563 1.00 37.38 O HETATM 2627 O HOH A 147 55.171 11.591 35.987 1.00 32.50 O HETATM 2628 O HOH A 148 43.837 22.451 16.586 1.00 41.65 O HETATM 2629 O HOH A 149 48.190 13.953 13.258 1.00 49.58 O HETATM 2630 O HOH A 150 51.676 21.576 14.969 1.00 45.55 O HETATM 2631 O HOH A 151 48.043 1.897 17.714 1.00 41.45 O HETATM 2632 O HOH A 152 38.140 4.491 27.629 1.00 33.15 O HETATM 2633 O HOH A 153 55.476 1.889 33.671 1.00 59.34 O HETATM 2634 O HOH A 154 30.284 8.358 3.873 1.00 50.06 O HETATM 2635 O HOH A 155 29.033 9.524 8.847 1.00 46.68 O HETATM 2636 O HOH A 156 44.172 17.436 7.874 1.00 64.09 O HETATM 2637 O HOH A 157 49.249 3.662 31.313 1.00 35.10 O HETATM 2638 O HOH A 158 52.971 2.696 33.514 1.00 43.49 O HETATM 2639 O HOH A 159 55.208 9.633 37.987 1.00 53.02 O HETATM 2640 O HOH A 160 29.380 -2.429 19.123 1.00 41.95 O HETATM 2641 O HOH A 161 57.674 0.391 32.490 1.00 73.26 O HETATM 2642 O HOH A 162 47.611 9.182 15.975 1.00 39.02 O HETATM 2643 O HOH A 163 41.102 1.123 -0.271 1.00 54.35 O HETATM 2644 O HOH A 164 58.469 3.910 29.713 1.00 57.21 O HETATM 2645 O HOH A 165 25.142 -2.675 0.171 1.00 51.74 O HETATM 2646 O HOH A 166 52.822 7.742 37.282 1.00 53.46 O HETATM 2647 O HOH A 167 51.040 21.289 12.289 1.00 43.73 O HETATM 2648 O HOH A 168 51.705 11.554 19.065 1.00 46.69 O HETATM 2649 O HOH A 169 30.766 11.384 22.560 1.00 54.47 O HETATM 2650 O HOH A 170 20.603 0.249 17.532 1.00 54.84 O HETATM 2651 O HOH A 171 27.412 10.689 15.268 1.00 57.32 O HETATM 2652 O HOH A 172 51.233 4.917 33.603 1.00 52.02 O HETATM 2653 O HOH A 173 53.552 8.356 20.752 1.00 47.11 O HETATM 2654 O HOH A 174 43.256 19.539 6.764 1.00 71.33 O HETATM 2655 O HOH A 175 41.940 9.137 4.436 1.00 47.66 O HETATM 2656 O HOH A 176 36.014 -0.260 0.036 0.50 17.74 O HETATM 2657 O HOH A 177 31.952 18.582 20.918 1.00 44.77 O HETATM 2658 O HOH A 178 38.999 4.534 29.898 1.00 51.54 O HETATM 2659 O HOH A 179 36.447 9.898 7.682 1.00 35.21 O HETATM 2660 O HOH A 180 41.449 21.668 8.414 1.00 58.34 O HETATM 2661 O HOH A 181 42.132 15.052 7.715 1.00 57.18 O HETATM 2662 O HOH A 182 28.392 -3.693 -2.314 1.00 50.17 O HETATM 2663 O HOH A 183 44.728 8.200 8.611 1.00 58.10 O HETATM 2664 O HOH A 184 37.299 -8.082 19.056 1.00 47.47 O HETATM 2665 O HOH A 185 18.271 -5.516 8.376 1.00 50.93 O HETATM 2666 O HOH A 186 33.332 -9.742 9.143 1.00 51.55 O HETATM 2667 O HOH A 187 24.056 0.292 1.351 1.00 65.51 O HETATM 2668 O HOH A 188 23.653 11.804 12.284 1.00 61.73 O HETATM 2669 O HOH A 189 35.248 4.245 27.267 1.00 41.53 O HETATM 2670 O HOH B 221 44.376 30.174 48.913 1.00 23.11 O HETATM 2671 O HOH B 222 45.946 37.225 47.698 1.00 30.59 O HETATM 2672 O HOH B 223 44.264 32.770 40.776 1.00 34.80 O HETATM 2673 O HOH B 224 52.025 37.245 31.837 1.00 18.40 O HETATM 2674 O HOH B 225 56.110 40.960 31.190 1.00 26.98 O HETATM 2675 O HOH B 226 55.399 31.195 32.659 1.00 15.98 O HETATM 2676 O HOH B 227 54.681 31.096 29.972 1.00 19.47 O HETATM 2677 O HOH B 228 59.378 28.710 37.124 1.00 15.13 O HETATM 2678 O HOH B 229 61.156 35.139 30.328 1.00 16.56 O HETATM 2679 O HOH B 230 67.176 42.020 31.960 1.00 19.16 O HETATM 2680 O HOH B 231 61.544 40.672 26.772 1.00 43.82 O HETATM 2681 O HOH B 232 59.725 26.075 19.542 1.00 22.42 O HETATM 2682 O HOH B 233 63.212 14.146 22.748 1.00 21.71 O HETATM 2683 O HOH B 234 69.819 14.870 26.039 1.00 31.08 O HETATM 2684 O HOH B 235 58.477 15.637 35.187 1.00 23.75 O HETATM 2685 O HOH B 236 56.592 17.510 36.079 1.00 14.39 O HETATM 2686 O HOH B 237 66.094 23.789 34.747 1.00 13.74 O HETATM 2687 O HOH B 238 70.820 16.947 29.659 1.00 26.99 O HETATM 2688 O HOH B 239 68.168 32.066 20.834 1.00 22.49 O HETATM 2689 O HOH B 240 71.158 32.453 31.494 1.00 22.10 O HETATM 2690 O HOH B 241 56.412 16.185 43.142 1.00 19.09 O HETATM 2691 O HOH B 242 58.716 20.775 48.402 1.00 19.09 O HETATM 2692 O HOH B 243 61.502 21.710 46.588 1.00 30.65 O HETATM 2693 O HOH B 244 49.124 19.873 52.207 1.00 31.15 O HETATM 2694 O HOH B 245 52.412 16.914 39.493 1.00 14.85 O HETATM 2695 O HOH B 246 34.158 19.002 37.428 1.00 24.75 O HETATM 2696 O HOH B 247 51.516 21.471 28.286 1.00 16.16 O HETATM 2697 O HOH B 248 45.153 25.054 26.088 1.00 17.87 O HETATM 2698 O HOH B 249 38.194 32.427 30.533 1.00 21.55 O HETATM 2699 O HOH B 250 43.734 18.842 43.830 1.00 19.12 O HETATM 2700 O HOH B 251 53.721 17.385 43.552 1.00 17.54 O HETATM 2701 O HOH B 252 66.755 39.279 40.279 1.00 23.66 O HETATM 2702 O HOH B 253 46.059 7.899 29.609 1.00 28.50 O HETATM 2703 O HOH B 254 42.142 25.634 21.076 1.00 25.64 O HETATM 2704 O HOH B 255 45.270 29.137 20.392 1.00 30.86 O HETATM 2705 O HOH B 256 47.749 32.316 22.286 1.00 26.97 O HETATM 2706 O HOH B 257 50.352 26.993 26.547 1.00 16.68 O HETATM 2707 O HOH B 258 52.479 25.497 27.294 1.00 19.03 O HETATM 2708 O HOH B 259 51.853 24.014 29.583 1.00 15.47 O HETATM 2709 O HOH B 260 55.140 26.175 26.591 1.00 16.22 O HETATM 2710 O HOH B 261 54.563 28.726 27.239 1.00 19.64 O HETATM 2711 O HOH B 262 56.460 29.281 24.368 1.00 27.93 O HETATM 2712 O HOH B 263 48.804 33.190 28.714 1.00 24.16 O HETATM 2713 O HOH B 264 48.835 35.698 29.922 1.00 35.57 O HETATM 2714 O HOH B 265 37.001 21.930 25.609 1.00 20.07 O HETATM 2715 O HOH B 266 33.406 22.688 31.286 1.00 25.08 O HETATM 2716 O HOH B 267 56.519 30.378 48.854 1.00 32.99 O HETATM 2717 O HOH B 268 46.650 37.264 50.079 1.00 42.32 O HETATM 2718 O HOH B 269 44.940 37.036 35.170 1.00 33.73 O HETATM 2719 O HOH B 270 44.607 36.580 32.085 1.00 44.58 O HETATM 2720 O HOH B 271 59.210 41.700 29.182 1.00 31.24 O HETATM 2721 O HOH B 272 47.073 33.449 25.901 1.00 19.62 O HETATM 2722 O HOH B 273 44.780 32.935 27.372 1.00 22.51 O HETATM 2723 O HOH B 274 45.100 34.311 29.692 1.00 24.42 O HETATM 2724 O HOH B 275 67.196 35.005 27.642 1.00 24.44 O HETATM 2725 O HOH B 276 68.348 41.422 34.601 1.00 18.49 O HETATM 2726 O HOH B 277 61.265 34.331 20.817 1.00 23.36 O HETATM 2727 O HOH B 278 59.205 12.040 17.385 1.00 33.58 O HETATM 2728 O HOH B 279 57.238 28.721 17.265 1.00 31.12 O HETATM 2729 O HOH B 280 73.248 20.876 16.716 1.00 37.71 O HETATM 2730 O HOH B 281 63.960 25.329 46.240 1.00 30.13 O HETATM 2731 O HOH B 282 68.751 21.616 44.892 1.00 28.03 O HETATM 2732 O HOH B 283 63.426 14.318 41.166 1.00 21.70 O HETATM 2733 O HOH B 284 53.075 17.951 46.078 1.00 12.93 O HETATM 2734 O HOH B 285 48.075 17.050 50.212 1.00 31.75 O HETATM 2735 O HOH B 286 40.990 12.936 32.384 1.00 19.95 O HETATM 2736 O HOH B 287 38.439 13.553 32.446 1.00 33.66 O HETATM 2737 O HOH B 288 42.912 18.017 46.415 1.00 29.71 O HETATM 2738 O HOH B 289 57.485 13.086 35.898 1.00 27.83 O HETATM 2739 O HOH B 290 72.302 31.631 36.519 1.00 35.91 O HETATM 2740 O HOH B 291 68.681 35.023 42.833 1.00 32.44 O HETATM 2741 O HOH B 292 50.382 7.387 31.616 1.00 35.12 O HETATM 2742 O HOH B 293 50.998 10.494 28.010 1.00 36.91 O HETATM 2743 O HOH B 294 59.303 10.692 36.203 1.00 29.25 O HETATM 2744 O HOH B 295 61.080 11.333 38.502 1.00 23.81 O HETATM 2745 O HOH B 296 47.034 30.169 50.862 1.00 41.24 O HETATM 2746 O HOH B 297 49.635 37.108 44.500 1.00 28.50 O HETATM 2747 O HOH B 298 43.536 33.765 38.351 1.00 30.86 O HETATM 2748 O HOH B 299 50.166 36.629 41.796 1.00 26.18 O HETATM 2749 O HOH B 300 55.312 31.924 19.851 1.00 42.05 O HETATM 2750 O HOH B 301 51.369 28.218 19.416 1.00 35.21 O HETATM 2751 O HOH B 302 58.207 13.436 15.278 1.00 28.35 O HETATM 2752 O HOH B 303 66.946 41.739 37.070 1.00 21.48 O HETATM 2753 O HOH B 304 61.174 35.744 22.793 1.00 36.55 O HETATM 2754 O HOH B 305 64.978 11.906 21.136 1.00 38.37 O HETATM 2755 O HOH B 306 65.648 15.789 37.630 1.00 24.35 O HETATM 2756 O HOH B 307 75.432 24.706 26.042 1.00 40.55 O HETATM 2757 O HOH B 308 76.033 28.930 24.571 1.00 58.15 O HETATM 2758 O HOH B 309 69.324 14.999 16.552 1.00 39.36 O HETATM 2759 O HOH B 310 69.278 25.341 11.698 1.00 44.49 O HETATM 2760 O HOH B 311 69.322 34.962 33.138 1.00 25.05 O HETATM 2761 O HOH B 312 73.753 28.395 34.683 1.00 42.47 O HETATM 2762 O HOH B 313 66.480 17.138 39.968 0.50 26.55 O HETATM 2763 O HOH B 314 57.875 11.745 40.428 1.00 34.90 O HETATM 2764 O HOH B 315 57.566 23.392 48.463 1.00 28.35 O HETATM 2765 O HOH B 316 55.743 13.074 50.292 1.00 28.14 O HETATM 2766 O HOH B 317 43.851 18.432 49.375 1.00 39.06 O HETATM 2767 O HOH B 318 61.470 33.061 43.187 1.00 53.68 O HETATM 2768 O HOH B 319 65.836 29.701 41.611 1.00 22.47 O HETATM 2769 O HOH B 320 35.495 11.912 31.312 1.00 32.60 O HETATM 2770 O HOH B 321 35.711 30.994 30.593 1.00 33.61 O HETATM 2771 O HOH B 322 34.103 21.871 35.477 1.00 47.50 O HETATM 2772 O HOH B 323 38.257 13.020 40.569 1.00 25.86 O HETATM 2773 O HOH B 324 40.664 12.935 40.785 1.00 25.71 O HETATM 2774 O HOH B 325 49.557 9.409 40.419 1.00 32.58 O HETATM 2775 O HOH B 326 38.153 23.123 48.154 1.00 44.70 O HETATM 2776 O HOH B 327 39.826 31.863 22.083 1.00 51.72 O HETATM 2777 O HOH B 328 38.100 29.878 25.403 1.00 31.66 O HETATM 2778 O HOH B 329 63.928 28.102 42.322 1.00 31.64 O HETATM 2779 O HOH B 330 39.967 14.883 22.387 1.00 46.94 O HETATM 2780 O HOH B 331 52.716 36.246 41.855 1.00 31.19 O HETATM 2781 O HOH B 332 45.734 31.804 20.155 1.00 45.03 O HETATM 2782 O HOH B 333 47.969 35.931 27.007 1.00 42.91 O HETATM 2783 O HOH B 334 47.902 28.922 20.851 1.00 32.47 O HETATM 2784 O HOH B 335 41.645 29.981 18.906 1.00 55.85 O HETATM 2785 O HOH B 336 42.853 26.204 18.722 1.00 53.03 O HETATM 2786 O HOH B 337 52.155 18.374 15.635 1.00 45.40 O HETATM 2787 O HOH B 338 68.127 30.280 43.144 1.00 38.40 O HETATM 2788 O HOH B 339 71.567 30.741 42.442 1.00 47.50 O HETATM 2789 O HOH B 340 71.933 26.405 42.448 1.00 43.57 O HETATM 2790 O HOH B 341 55.291 36.867 25.290 1.00 34.91 O HETATM 2791 O HOH B 342 62.599 24.852 13.978 1.00 32.30 O HETATM 2792 O HOH B 343 71.683 15.101 32.344 1.00 31.36 O HETATM 2793 O HOH B 344 76.788 22.777 32.419 1.00 38.86 O HETATM 2794 O HOH B 345 66.310 14.640 17.300 1.00 24.53 O HETATM 2795 O HOH B 346 70.927 16.183 21.311 1.00 38.56 O HETATM 2796 O HOH B 347 30.450 12.879 30.825 1.00 56.80 O HETATM 2797 O HOH B 348 43.554 6.945 29.941 1.00 34.14 O HETATM 2798 O HOH B 349 37.178 10.591 32.811 1.00 38.64 O HETATM 2799 O HOH B 350 55.755 6.012 22.564 1.00 42.72 O HETATM 2800 O HOH B 351 59.109 7.520 35.300 1.00 52.13 O HETATM 2801 O HOH B 352 53.945 14.788 15.021 1.00 55.10 O HETATM 2802 O HOH B 353 53.556 35.007 44.731 1.00 42.64 O HETATM 2803 O HOH B 354 54.442 36.944 22.934 1.00 49.50 O HETATM 2804 O HOH B 355 57.676 37.443 24.968 1.00 45.18 O HETATM 2805 O HOH B 356 53.277 38.233 26.117 1.00 46.00 O HETATM 2806 O HOH B 357 58.741 34.831 20.195 1.00 43.81 O HETATM 2807 O HOH B 358 51.495 40.486 30.451 1.00 62.01 O HETATM 2808 O HOH B 359 71.256 15.786 27.528 1.00 38.37 O HETATM 2809 O HOH B 360 65.484 8.564 23.851 1.00 38.91 O HETATM 2810 O HOH B 361 69.300 20.953 42.175 1.00 36.46 O HETATM 2811 O HOH B 362 62.820 31.498 44.731 1.00 43.58 O HETATM 2812 O HOH B 363 73.716 31.688 31.773 1.00 40.72 O HETATM 2813 O HOH B 364 33.913 18.809 31.098 1.00 33.68 O HETATM 2814 O HOH B 365 33.896 20.257 33.452 1.00 46.33 O HETATM 2815 O HOH B 366 42.806 30.351 50.973 1.00 47.62 O HETATM 2816 O HOH B 367 64.584 26.195 12.889 1.00 36.40 O HETATM 2817 O HOH B 368 60.587 26.115 10.843 1.00 60.24 O HETATM 2818 O HOH B 369 48.753 14.964 51.033 1.00 55.63 O HETATM 2819 O HOH B 370 56.920 23.398 51.540 1.00 34.15 O HETATM 2820 O HOH B 371 35.558 29.270 28.859 1.00 29.92 O HETATM 2821 O HOH B 372 45.713 16.233 49.685 1.00 52.57 O HETATM 2822 O HOH B 373 50.394 30.732 54.354 1.00 53.46 O HETATM 2823 O HOH B 374 38.311 29.985 44.811 1.00 36.82 O HETATM 2824 O HOH B 375 38.343 34.536 22.384 1.00 40.76 O HETATM 2825 O HOH B 376 67.537 28.496 44.910 1.00 44.52 O HETATM 2826 O HOH B 377 70.051 27.434 45.800 1.00 51.62 O HETATM 2827 O HOH B 378 43.056 34.476 24.914 1.00 54.00 O HETATM 2828 O HOH B 379 57.901 20.361 51.459 1.00 30.72 O HETATM 2829 O HOH B 380 59.693 24.982 47.383 1.00 45.73 O HETATM 2830 O HOH B 381 74.955 25.821 20.993 1.00 53.30 O HETATM 2831 O HOH B 382 71.168 20.767 23.699 1.00 45.52 O HETATM 2832 O HOH B 383 76.217 22.785 24.261 1.00 40.25 O HETATM 2833 O HOH B 384 65.938 37.810 42.344 1.00 36.61 O HETATM 2834 O HOH B 385 68.472 32.673 44.257 1.00 47.77 O HETATM 2835 O HOH B 386 59.218 34.726 43.422 1.00 23.94 O HETATM 2836 O HOH B 387 72.141 32.621 19.573 1.00 31.07 O HETATM 2837 O HOH B 388 66.328 18.354 10.628 1.00 50.94 O HETATM 2838 O HOH B 389 52.089 7.648 34.763 1.00 42.80 O HETATM 2839 O HOH B 390 64.457 13.659 11.180 1.00 55.46 O HETATM 2840 O HOH B 391 64.721 16.093 9.533 1.00 62.12 O HETATM 2841 O HOH B 392 49.067 38.624 41.394 1.00 46.45 O HETATM 2842 O HOH B 393 57.268 35.185 45.196 1.00 41.47 O HETATM 2843 O HOH B 394 46.388 22.639 51.524 1.00 41.23 O HETATM 2844 O HOH B 395 36.660 9.414 28.955 1.00 36.70 O HETATM 2845 O HOH B 396 60.989 30.966 49.297 1.00 55.77 O HETATM 2846 O HOH B 397 51.051 41.734 32.654 1.00 53.98 O HETATM 2847 O HOH B 398 35.872 28.219 26.223 1.00 37.35 O HETATM 2848 O HOH B 399 59.042 37.290 42.948 1.00 53.88 O HETATM 2849 O HOH B 400 60.461 40.800 37.424 1.00 48.11 O HETATM 2850 O HOH B 401 55.409 13.288 14.317 1.00 43.60 O HETATM 2851 O HOH B 402 73.812 19.544 18.920 1.00 51.10 O HETATM 2852 O HOH B 403 70.762 23.709 43.975 1.00 35.00 O HETATM 2853 O HOH B 404 70.701 23.053 41.871 1.00 35.18 O HETATM 2854 O HOH B 405 57.991 26.420 11.977 1.00 47.54 O HETATM 2855 O HOH B 406 50.379 8.308 38.092 1.00 47.72 O HETATM 2856 O HOH B 407 70.737 28.647 42.791 1.00 41.18 O HETATM 2857 O HOH B 408 42.234 11.904 42.678 1.00 45.11 O HETATM 2858 O HOH B 409 59.755 5.584 30.671 1.00 39.05 O HETATM 2859 O HOH B 410 43.177 39.041 36.097 1.00 45.09 O HETATM 2860 O HOH B 411 45.352 27.279 18.475 1.00 38.71 O HETATM 2861 O HOH B 412 61.133 32.431 13.635 1.00 50.59 O HETATM 2862 O HOH B 413 61.125 21.546 48.766 1.00 45.39 O HETATM 2863 O HOH B 414 51.525 37.277 27.916 1.00 44.43 O HETATM 2864 O HOH B 415 62.328 23.525 49.539 1.00 44.90 O HETATM 2865 O HOH B 416 40.043 31.639 52.019 1.00 52.94 O HETATM 2866 O HOH B 417 46.776 34.340 23.826 1.00 50.62 O HETATM 2867 O HOH B 418 38.770 8.316 30.161 1.00 49.33 O HETATM 2868 O HOH B 419 40.548 13.139 44.526 1.00 51.74 O HETATM 2869 O HOH B 420 49.162 15.878 53.055 1.00 58.28 O HETATM 2870 O HOH B 421 62.698 44.392 41.469 1.00 35.21 O HETATM 2871 O HOH B 422 52.668 40.200 28.352 1.00 71.77 O HETATM 2872 O HOH B 423 55.966 11.211 42.435 1.00 40.06 O HETATM 2873 O HOH B 424 60.059 21.515 52.580 1.00 51.32 O HETATM 2874 O HOH B 425 49.108 28.997 18.435 1.00 39.61 O HETATM 2875 O HOH B 426 52.163 43.382 40.480 1.00 72.50 O HETATM 2876 O HOH B 427 49.546 42.294 39.522 1.00 56.73 O HETATM 2877 O HOH B 428 69.728 20.002 39.726 0.50 31.83 O HETATM 2878 O HOH B 429 77.724 19.132 30.909 1.00 48.72 O HETATM 2879 O HOH B 430 74.873 26.659 37.351 1.00 43.93 O HETATM 2880 O HOH B 431 41.047 27.565 50.876 1.00 48.91 O HETATM 2881 O HOH B 432 57.569 43.674 35.139 1.00 50.63 O HETATM 2882 O HOH B 433 63.499 37.652 20.384 1.00 55.34 O HETATM 2883 O HOH B 434 76.502 24.760 28.514 1.00 60.61 O HETATM 2884 O HOH B 435 53.226 21.115 53.260 1.00 49.09 O HETATM 2885 O HOH B 436 76.225 24.389 34.275 1.00 56.55 O HETATM 2886 O HOH B 437 37.662 35.630 47.779 1.00 50.13 O HETATM 2887 O HOH B 438 32.383 16.879 34.936 1.00 53.97 O HETATM 2888 O HOH B 439 64.278 19.781 4.937 1.00 57.76 O HETATM 2889 O HOH B 440 60.408 15.609 9.655 1.00 50.28 O HETATM 2890 O HOH B 441 62.804 40.281 42.088 1.00 54.69 O HETATM 2891 O HOH B 442 52.801 26.396 19.352 1.00 49.28 O HETATM 2892 O HOH B 443 75.588 14.439 31.129 1.00 45.36 O CONECT 158 2560 CONECT 543 2560 CONECT 567 2560 CONECT 1025 1350 CONECT 1292 1634 CONECT 1350 1025 CONECT 1634 1292 CONECT 2095 2460 CONECT 2460 2095 CONECT 2560 158 543 567 2566 CONECT 2561 2562 2563 CONECT 2562 2561 CONECT 2563 2561 CONECT 2564 2565 2566 CONECT 2565 2564 CONECT 2566 2560 2564 CONECT 2567 2568 2569 CONECT 2568 2567 CONECT 2569 2567 CONECT 2570 2571 2572 2573 CONECT 2571 2570 CONECT 2572 2570 CONECT 2573 2570 CONECT 2574 2575 2576 CONECT 2575 2574 CONECT 2576 2574 CONECT 2577 2578 2579 CONECT 2578 2577 CONECT 2579 2577 CONECT 2580 2581 2582 CONECT 2581 2580 CONECT 2582 2580 CONECT 2583 2584 2585 CONECT 2584 2583 CONECT 2585 2583 CONECT 2586 2587 2588 CONECT 2587 2586 CONECT 2588 2586 CONECT 2589 2590 2591 CONECT 2590 2589 CONECT 2591 2589 CONECT 2592 2593 2594 CONECT 2593 2592 CONECT 2594 2592 MASTER 422 0 12 11 17 0 18 6 2890 2 44 26 END
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Related entries of code: 3e1z
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
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RCSB PDB
PDBbind
109aa, >2NQD_1|Chain... at 100%
2oul
RCSB PDB
PDBbind
110aa, >2OUL_2|Chain... *
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
2x1w
RCSB PDB
PDBbind
110-mer
2x1x
RCSB PDB
PDBbind
110-mer
3e2h
RCSB PDB
PDBbind
110-mer
3e3q
RCSB PDB
PDBbind
110-mer
Entry Information
PDB ID
3e1z
Complex Type
Protein-Protein
PDBbind Subset
general set
Protein Name
a classic family C1 cysteine protease, papain
Ligand Name
110-mer
EC.Number
E.C.3.4.22.2
Resolution
1.86(Å)
Affinity (Kd/Ki/IC50)
Ki=0.036nM
Release Year
2009
Protein/NA Sequence
Check fasta file
Primary Reference
(2009) Febs J. Vol. 276: pp. 793-806
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):
P00784
Q966X9
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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