USER MOD reduce.3.24.130724 H: found=0, std=0, add=2710, rem=0, adj=65 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER OXIDOREDUCTASE 14-DEC-10 3PZA TITLE FULLY REDUCED (ALL-FERROUS) PYROCOCCUS RUBRERYTHRIN AFTER A 10 SECOND TITLE 2 EXPOSURE TO PEROXIDE. COMPND MOL_ID: 1; COMPND 2 MOLECULE: RUBRERYTHRIN; COMPND 3 CHAIN: A, B SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS FURIOSUS; SOURCE 3 ORGANISM_TAXID: 2261 KEYWDS RUBRERYTHRIN, OXIDOREDUCTASE EXPDTA X-RAY DIFFRACTION AUTHOR B.D.DILLARD,J.M.DEMICK,M.W.ADAMS,W.N.LANZILOTTA REVDAT 3 10-AUG-11 3PZA 1 JRNL VERSN REVDAT 2 29-JUN-11 3PZA 1 REMARK REVDAT 1 22-JUN-11 3PZA 0 JRNL AUTH B.D.DILLARD,J.M.DEMICK,M.W.ADAMS,W.N.LANZILOTTA JRNL TITL A CRYO-CRYSTALLOGRAPHIC TIME COURSE FOR PEROXIDE REDUCTION JRNL TITL 2 BY RUBRERYTHRIN FROM PYROCOCCUS FURIOSUS. JRNL REF J.BIOL.INORG.CHEM. V. 16 949 2011 JRNL REFN ISSN 0949-8257 JRNL PMID 21647777 JRNL DOI 10.1007/S00775-011-0795-6 REMARK 2 REMARK 2 RESOLUTION. 1.85 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.5.0109 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) : 1.85 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 43.71 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.5 REMARK 3 NUMBER OF REFLECTIONS : 38044 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) : 0.177 REMARK 3 R VALUE (WORKING SET) : 0.176 REMARK 3 FREE R VALUE : 0.200 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.100 REMARK 3 FREE R VALUE TEST SET COUNT : 1941 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) : 1.85 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.90 REMARK 3 REFLECTION IN BIN (WORKING SET) : 2607 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 99.39 REMARK 3 BIN R VALUE (WORKING SET) : 0.1900 REMARK 3 BIN FREE R VALUE SET COUNT : 149 REMARK 3 BIN FREE R VALUE : 0.2360 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2726 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 10 REMARK 3 SOLVENT ATOMS : 131 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 26.46 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.20000 REMARK 3 B22 (A**2) : -0.20000 REMARK 3 B33 (A**2) : 0.41000 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): NULL REMARK 3 ESU BASED ON FREE R VALUE (A): 0.107 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.064 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 2.038 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.955 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.949 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2842 ; 0.035 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3776 ; 2.239 ; 1.965 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 342 ; 5.234 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 134 ;43.021 ;24.776 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 516 ;14.707 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 10 ;14.984 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 394 ; 0.176 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 2136 ; 0.012 ; 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): 1706 ; 1.534 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2734 ; 2.634 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 1136 ; 4.714 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 1042 ; 8.063 ; 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 : NULL REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.40 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING REMARK 3 POSITIONS U VALUES : REFINED INDIVIDUALLY REMARK 4 REMARK 4 3PZA COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 16-DEC-10. REMARK 100 THE RCSB ID CODE IS RCSB062996. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 21-NOV-10 REMARK 200 TEMPERATURE (KELVIN) : NULL REMARK 200 PH : 7.0 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 22-BM REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.0 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : 1.0 REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MAR CCD 165 MM REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 38044 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.850 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 2.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.4 REMARK 200 DATA REDUNDANCY : 6.000 REMARK 200 R MERGE (I) : 0.10100 REMARK 200 R SYM (I) : 0.08200 REMARK 200 FOR THE DATA SET : 42.0000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: CNS REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 56.16 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.81 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.025 M HEPES PH 7.0, 8% PEG 2000 MME, REMARK 280 CAPILLARY BATCH, TEMPERATURE 291K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 42 21 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+1/2,X+1/2,Z+1/2 REMARK 290 4555 Y+1/2,-X+1/2,Z+1/2 REMARK 290 5555 -X+1/2,Y+1/2,-Z+1/2 REMARK 290 6555 X+1/2,-Y+1/2,-Z+1/2 REMARK 290 7555 Y,X,-Z REMARK 290 8555 -Y,-X,-Z 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 52.30100 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 52.30100 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 39.79550 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 52.30100 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 52.30100 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 39.79550 REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 52.30100 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 52.30100 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 39.79550 REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 52.30100 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 52.30100 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 39.79550 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 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 9190 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 15280 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -123.0 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 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 21580 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 27360 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -269.0 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 350 BIOMT1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 2 0.000000 -1.000000 0.000000 104.60200 REMARK 350 BIOMT3 2 0.000000 0.000000 1.000000 0.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O HOH A 202 O HOH B 230 2.13 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 TYR B 88 CE2 TYR B 88 CD2 0.102 REMARK 500 GLU B 100 CG GLU B 100 CD 0.096 REMARK 500 TYR B 156 CE2 TYR B 156 CD2 0.095 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 GLU A 19 OE1 - CD - OE2 ANGL. DEV. = -12.0 DEGREES REMARK 500 GLU A 80 OE1 - CD - OE2 ANGL. DEV. = -13.3 DEGREES REMARK 500 GLU B 19 OE1 - CD - OE2 ANGL. DEV. = -11.8 DEGREES REMARK 500 GLU B 80 OE1 - CD - OE2 ANGL. DEV. = -14.9 DEGREES REMARK 500 LEU B 111 CB - CG - CD2 ANGL. DEV. = -10.4 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 PHE A 38 77.53 -120.00 REMARK 500 GLU A 86 -67.29 -120.16 REMARK 500 ASP A 151 -49.70 79.45 REMARK 500 PHE B 38 72.75 -119.40 REMARK 500 GLU B 86 -60.75 -123.64 REMARK 500 ASP B 151 -41.57 82.56 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 FE2 A 174 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLU A 52 OE2 REMARK 620 2 GLU B 114 OE1 132.1 REMARK 620 3 PEO B 1 O2 89.8 74.7 REMARK 620 4 GLU A 19 OE2 85.5 137.3 88.3 REMARK 620 5 GLU A 19 OE1 143.7 80.8 84.8 58.5 REMARK 620 6 HIS A 55 ND1 91.8 96.1 168.7 102.9 100.4 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 FE2 B 174 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLU B 52 OE1 REMARK 620 2 GLU A 114 OE1 130.0 REMARK 620 3 PEO A 172 O1 82.8 82.9 REMARK 620 4 GLU B 19 OE1 83.4 142.4 85.7 REMARK 620 5 GLU B 19 OE2 143.4 83.8 89.4 60.3 REMARK 620 6 HIS B 55 ND1 92.5 93.7 170.1 102.4 99.5 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 FE2 A 173 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLU A 114 OE2 REMARK 620 2 GLU B 52 OE2 122.7 REMARK 620 3 GLU A 80 OE1 146.9 87.6 REMARK 620 4 GLU A 80 OE2 88.2 145.5 59.2 REMARK 620 5 PEO A 172 O2 85.5 80.4 87.2 88.1 REMARK 620 6 HIS A 117 ND1 89.6 95.2 101.5 100.3 170.2 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 FE2 B 173 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLU B 114 OE2 REMARK 620 2 GLU B 80 OE2 146.0 REMARK 620 3 GLU A 52 OE1 120.8 91.0 REMARK 620 4 GLU B 80 OE1 87.6 58.6 147.6 REMARK 620 5 PEO B 1 O1 84.8 89.1 80.6 87.4 REMARK 620 6 HIS B 117 ND1 89.5 100.3 95.0 101.0 169.7 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 FE2 A 1 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS A 157 SG REMARK 620 2 CYS A 145 SG 97.7 REMARK 620 3 CYS A 142 SG 116.1 111.2 REMARK 620 4 CYS A 160 SG 110.8 122.3 99.8 REMARK 620 N 1 2 3 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 FE2 B 172 FE REMARK 620 N RES CSSEQI ATOM REMARK 620 1 CYS B 160 SG REMARK 620 2 CYS B 142 SG 102.6 REMARK 620 3 CYS B 145 SG 118.9 113.4 REMARK 620 4 CYS B 157 SG 110.1 116.4 96.3 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 PEO A 172 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FE2 A 1 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FE2 A 173 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FE2 A 174 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PEO B 1 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FE2 B 172 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FE2 B 173 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FE2 B 174 DBREF 3PZA A 2 171 UNP Q9UWP7 Q9UWP7_PYRFU 2 171 DBREF 3PZA B 2 171 UNP Q9UWP7 Q9UWP7_PYRFU 2 171 SEQRES 1 A 170 VAL VAL LYS ARG THR MET THR LYS LYS PHE LEU GLU GLU SEQRES 2 A 170 ALA PHE ALA GLY GLU SER MET ALA HIS MET ARG TYR LEU SEQRES 3 A 170 ILE PHE ALA GLU LYS ALA GLU GLN GLU GLY PHE PRO ASN SEQRES 4 A 170 ILE ALA LYS LEU PHE ARG ALA ILE ALA TYR ALA GLU PHE SEQRES 5 A 170 VAL HIS ALA LYS ASN HIS PHE ILE ALA LEU GLY LYS LEU SEQRES 6 A 170 GLY LYS THR PRO GLU ASN LEU GLN MET GLY ILE GLU GLY SEQRES 7 A 170 GLU THR PHE GLU VAL GLU GLU MET TYR PRO VAL TYR ASN SEQRES 8 A 170 LYS ALA ALA GLU PHE GLN GLY GLU LYS GLU ALA VAL ARG SEQRES 9 A 170 THR THR HIS TYR ALA LEU GLU ALA GLU LYS ILE HIS ALA SEQRES 10 A 170 GLU LEU TYR ARG LYS ALA LYS GLU LYS ALA GLU LYS GLY SEQRES 11 A 170 GLU ASP ILE GLU ILE LYS LYS VAL TYR ILE CYS PRO ILE SEQRES 12 A 170 CYS GLY TYR THR ALA VAL ASP GLU ALA PRO GLU TYR CYS SEQRES 13 A 170 PRO VAL CYS GLY ALA PRO LYS GLU LYS PHE VAL VAL PHE SEQRES 14 A 170 GLU SEQRES 1 B 170 VAL VAL LYS ARG THR MET THR LYS LYS PHE LEU GLU GLU SEQRES 2 B 170 ALA PHE ALA GLY GLU SER MET ALA HIS MET ARG TYR LEU SEQRES 3 B 170 ILE PHE ALA GLU LYS ALA GLU GLN GLU GLY PHE PRO ASN SEQRES 4 B 170 ILE ALA LYS LEU PHE ARG ALA ILE ALA TYR ALA GLU PHE SEQRES 5 B 170 VAL HIS ALA LYS ASN HIS PHE ILE ALA LEU GLY LYS LEU SEQRES 6 B 170 GLY LYS THR PRO GLU ASN LEU GLN MET GLY ILE GLU GLY SEQRES 7 B 170 GLU THR PHE GLU VAL GLU GLU MET TYR PRO VAL TYR ASN SEQRES 8 B 170 LYS ALA ALA GLU PHE GLN GLY GLU LYS GLU ALA VAL ARG SEQRES 9 B 170 THR THR HIS TYR ALA LEU GLU ALA GLU LYS ILE HIS ALA SEQRES 10 B 170 GLU LEU TYR ARG LYS ALA LYS GLU LYS ALA GLU LYS GLY SEQRES 11 B 170 GLU ASP ILE GLU ILE LYS LYS VAL TYR ILE CYS PRO ILE SEQRES 12 B 170 CYS GLY TYR THR ALA VAL ASP GLU ALA PRO GLU TYR CYS SEQRES 13 B 170 PRO VAL CYS GLY ALA PRO LYS GLU LYS PHE VAL VAL PHE SEQRES 14 B 170 GLU HET PEO A 172 2 HET FE2 A 1 1 HET FE2 A 173 1 HET FE2 A 174 1 HET PEO B 1 2 HET FE2 B 172 1 HET FE2 B 173 1 HET FE2 B 174 1 HETNAM PEO HYDROGEN PEROXIDE HETNAM FE2 FE (II) ION FORMUL 3 PEO 2(H2 O2) FORMUL 4 FE2 6(FE 2+) FORMUL 11 HOH *131(H2 O) HELIX 1 1 ARG A 5 GLY A 37 1 33 HELIX 2 2 PHE A 38 LEU A 63 1 26 HELIX 3 3 LYS A 68 GLU A 86 1 19 HELIX 4 4 GLU A 86 GLN A 98 1 13 HELIX 5 5 GLU A 100 GLU A 129 1 30 HELIX 6 6 PRO A 163 PHE A 167 5 5 HELIX 7 7 ARG B 5 GLY B 37 1 33 HELIX 8 8 PHE B 38 LEU B 63 1 26 HELIX 9 9 LYS B 68 GLU B 86 1 19 HELIX 10 10 GLU B 86 GLN B 98 1 13 HELIX 11 11 GLU B 100 LYS B 130 1 31 HELIX 12 12 PRO B 163 PHE B 167 5 5 SHEET 1 A 3 THR A 148 VAL A 150 0 SHEET 2 A 3 VAL A 139 ILE A 141 -1 N TYR A 140 O ALA A 149 SHEET 3 A 3 VAL A 168 PHE A 170 -1 O VAL A 168 N ILE A 141 SHEET 1 B 3 THR B 148 VAL B 150 0 SHEET 2 B 3 VAL B 139 ILE B 141 -1 N TYR B 140 O ALA B 149 SHEET 3 B 3 VAL B 168 PHE B 170 -1 O VAL B 168 N ILE B 141 LINK OE2 GLU A 52 FE FE2 A 174 1555 1555 1.86 LINK OE1 GLU B 52 FE FE2 B 174 1555 1555 1.89 LINK OE2 GLU A 114 FE FE2 A 173 1555 1555 1.91 LINK OE2 GLU B 114 FE FE2 B 173 1555 1555 1.93 LINK OE1 GLU A 114 FE FE2 B 174 1555 1555 1.93 LINK OE2 GLU B 52 FE FE2 A 173 1555 1555 1.95 LINK OE1 GLU B 114 FE FE2 A 174 1555 1555 1.97 LINK OE1 GLU A 80 FE FE2 A 173 1555 1555 1.98 LINK OE2 GLU B 80 FE FE2 B 173 1555 1555 2.00 LINK O2 PEO B 1 FE FE2 A 174 1555 1555 2.01 LINK OE2 GLU A 19 FE FE2 A 174 1555 1555 2.01 LINK OE1 GLU A 52 FE FE2 B 173 1555 1555 2.01 LINK O1 PEO A 172 FE FE2 B 174 1555 1555 2.04 LINK OE2 GLU A 80 FE FE2 A 173 1555 1555 2.07 LINK OE1 GLU B 19 FE FE2 B 174 1555 1555 2.07 LINK O2 PEO A 172 FE FE2 A 173 1555 1555 2.09 LINK OE1 GLU B 80 FE FE2 B 173 1555 1555 2.09 LINK OE2 GLU B 19 FE FE2 B 174 1555 1555 2.10 LINK ND1 HIS B 55 FE FE2 B 174 1555 1555 2.12 LINK ND1 HIS A 117 FE FE2 A 173 1555 1555 2.13 LINK O1 PEO B 1 FE FE2 B 173 1555 1555 2.13 LINK ND1 HIS B 117 FE FE2 B 173 1555 1555 2.13 LINK OE1 GLU A 19 FE FE2 A 174 1555 1555 2.14 LINK ND1 HIS A 55 FE FE2 A 174 1555 1555 2.14 LINK SG CYS A 157 FE FE2 A 1 1555 1555 2.29 LINK SG CYS A 145 FE FE2 A 1 1555 1555 2.29 LINK SG CYS B 160 FE FE2 B 172 1555 1555 2.30 LINK SG CYS A 142 FE FE2 A 1 1555 1555 2.31 LINK SG CYS B 142 FE FE2 B 172 1555 1555 2.33 LINK SG CYS A 160 FE FE2 A 1 1555 1555 2.33 LINK SG CYS B 145 FE FE2 B 172 1555 1555 2.34 LINK SG CYS B 157 FE FE2 B 172 1555 1555 2.34 SITE *** AC1 7 GLU A 80 GLU A 83 GLU A 114 FE2 A 173 SITE *** AC1 7 GLU B 19 GLU B 52 FE2 B 174 SITE *** AC2 4 CYS A 142 CYS A 145 CYS A 157 CYS A 160 SITE *** AC3 5 GLU A 80 GLU A 114 HIS A 117 PEO A 172 SITE *** AC3 5 GLU B 52 SITE *** AC4 5 GLU A 19 GLU A 52 HIS A 55 PEO B 1 SITE *** AC4 5 GLU B 114 SITE *** AC5 7 GLU A 19 GLU A 52 FE2 A 174 GLU B 80 SITE *** AC5 7 GLU B 83 GLU B 114 FE2 B 173 SITE *** AC6 4 CYS B 142 CYS B 145 CYS B 157 CYS B 160 SITE *** AC7 5 GLU A 52 PEO B 1 GLU B 80 GLU B 114 SITE *** AC7 5 HIS B 117 SITE *** AC8 5 GLU A 114 PEO A 172 GLU B 19 GLU B 52 SITE *** AC8 5 HIS B 55 CRYST1 104.602 104.602 79.591 90.00 90.00 90.00 P 42 21 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 0.009560 0.000000 0.000000 0.00000 SCALE2 0.000000 0.009560 0.000000 0.00000 SCALE3 0.000000 0.000000 0.012564 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 55 HIS HD1 : A 55 HIS ND1 : A 174 FE2FE :(H bumps) USER MOD NoAdj-H: A 117 HIS HD1 : A 117 HIS ND1 : A 173 FE2FE :(H bumps) USER MOD NoAdj-H: B 55 HIS HD1 : B 55 HIS ND1 : B 174 FE2FE :(H bumps) USER MOD NoAdj-H: B 117 HIS HD1 : B 117 HIS ND1 : B 173 FE2FE :(H bumps) USER MOD Set 1.1: B 92 ASN : amide:sc= 1.11 X(o=2.2,f=1.9) USER MOD Set 1.2: B 107 THR OG1 : rot -72:sc= 1.07 USER MOD Set 2.1: B 74 GLN : amide:sc= 2.17 K(o=3.2,f=-5) USER MOD Set 2.2: B 125 LYS NZ :NH3+ -165:sc= 1.06 (180deg=0) USER MOD Set 3.1: A 23 HIS : no HD1:sc= 0.0125 K(o=-0.37,f=-8.2!) USER MOD Set 3.2: A 24 MET CE :methyl 176:sc= -0.138 (180deg=-0.173) USER MOD Set 3.3: B 23 HIS : no HE2:sc= -0.157! C(o=-0.37!,f=-6!) USER MOD Set 3.4: B 24 MET CE :methyl 178:sc= -0.0836 (180deg=-0.0309) USER MOD Set 4.1: A 98 GLN : amide:sc= 1.93 K(o=3,f=1.1) USER MOD Set 4.2: B 8 THR OG1 : rot 72:sc= 1.07 USER MOD Set 5.1: A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 140 TYR OH : rot 180:sc= -1.18 USER MOD Set 6.1: A 74 GLN : amide:sc= 1.92 K(o=2.6,f=-3.2) USER MOD Set 6.2: A 125 LYS NZ :NH3+ -148:sc= 0.704 (180deg=-0.167) USER MOD Set 7.1: A 92 ASN : amide:sc= 1.4 K(o=2.6,f=2.1) USER MOD Set 7.2: A 107 THR OG1 : rot -74:sc= 1.21 USER MOD Set 8.1: A 88 TYR OH : rot -164:sc= 1.65 USER MOD Set 8.2: A 106 THR OG1 : rot 124:sc= 0.402 USER MOD Set 8.3: B 59 HIS : no HD1:sc= 1.12 K(o=3.2,f=-4.5!) USER MOD Set 9.1: A 59 HIS : no HD1:sc= 0.814 K(o=3,f=-4.1!) USER MOD Set 9.2: B 88 TYR OH : rot -159:sc= 1.86 USER MOD Set 9.3: B 106 THR OG1 : rot 124:sc= 0.303 USER MOD Set10.1: A 40 ASN : amide:sc= 0.38 K(o=1.7,f=-0.29) USER MOD Set10.2: A 43 LYS NZ :NH3+ 129:sc= 1.31 (180deg=0.000643) USER MOD Set11.1: A 8 THR OG1 : rot 71:sc= 1.22 USER MOD Set11.2: B 98 GLN : amide:sc= 2.01 K(o=3.2,f=2.2) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot -157:sc= 1.31 USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 LYS NZ :NH3+ -140:sc= -0.694 (180deg=-1.8) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 83:sc= 0.517 USER MOD Single : A 21 MET CE :methyl -163:sc= -0.0116 (180deg=-0.306) USER MOD Single : A 26 TYR OH : rot 23:sc= 2.12 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 GLN : amide:sc= -0.0476 K(o=-0.048,f=-1) USER MOD Single : A 50 TYR OH : rot 30:sc= 0.252 USER MOD Single : A 57 LYS NZ :NH3+ 153:sc= 0.996 (180deg=0.582) USER MOD Single : A 58 ASN : amide:sc= 2.08 K(o=2.1,f=-0.28) USER MOD Single : A 65 LYS NZ :NH3+ -143:sc= -1.03! (180deg=-4.69!) USER MOD Single : A 68 LYS NZ :NH3+ 152:sc= 0.932 (180deg=0.502) USER MOD Single : A 69 THR OG1 : rot 85:sc= 2.28 USER MOD Single : A 72 ASN : amide:sc= 1.83 K(o=1.8,f=-3.5!) USER MOD Single : A 75 MET CE :methyl -178:sc= -3.53! (180deg=-3.63!) USER MOD Single : A 81 THR OG1 : rot 83:sc= 1.06 USER MOD Single : A 87 MET CE :methyl -138:sc= 0 (180deg=-0.0306) USER MOD Single : A 91 TYR OH : rot 180:sc= 0.413 USER MOD Single : A 93 LYS NZ :NH3+ 179:sc= 0.907 (180deg=0.905) USER MOD Single : A 101 LYS NZ :NH3+ 147:sc= -0.116 (180deg=-0.652) USER MOD Single : A 108 HIS : no HD1:sc= -3.46! K(o=-3.5!,f=1.1) USER MOD Single : A 109 TYR OH : rot 180:sc= -0.372 USER MOD Single : A 115 LYS NZ :NH3+ 174:sc= 0.0407 (180deg=0.0359) USER MOD Single : A 121 TYR OH : rot 10:sc= 0.323 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ -151:sc= 0 (180deg=-0.157) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ -167:sc= -0.187 (180deg=-0.491) USER MOD Single : A 147 TYR OH : rot 180:sc= -0.0206 USER MOD Single : A 148 THR OG1 : rot 51:sc= 0.462 USER MOD Single : A 156 TYR OH : rot 180:sc= 0 USER MOD Single : A 164 LYS NZ :NH3+ 166:sc= 0.0936 (180deg=0.0529) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 THR OG1 : rot 180:sc= 0 USER MOD Single : B 7 MET CE :methyl -174:sc= 0 (180deg=-0.0446) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 20 SER OG : rot 83:sc= 0.669 USER MOD Single : B 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 26 TYR OH : rot 20:sc= 1.84 USER MOD Single : B 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 35 GLN : amide:sc= 1.04 X(o=1,f=0.61) USER MOD Single : B 40 ASN : amide:sc= 1.02 K(o=1,f=-1.3!) USER MOD Single : B 43 LYS NZ :NH3+ -179:sc= 0.759 (180deg=0.758) USER MOD Single : B 50 TYR OH : rot 30:sc= 0.145 USER MOD Single : B 57 LYS NZ :NH3+ -114:sc= 1.6 (180deg=-0.66) USER MOD Single : B 58 ASN : amide:sc= 1.25 K(o=1.2,f=-0.59) USER MOD Single : B 65 LYS NZ :NH3+ -170:sc= -0.12 (180deg=-0.154) USER MOD Single : B 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 69 THR OG1 : rot 97:sc= 1.89 USER MOD Single : B 72 ASN : amide:sc= 1.87 K(o=1.9,f=-4.2!) USER MOD Single : B 75 MET CE :methyl -167:sc= -2.05 (180deg=-2.68!) USER MOD Single : B 81 THR OG1 : rot 85:sc= 0.703 USER MOD Single : B 87 MET CE :methyl -124:sc= -0.0756 (180deg=-0.331) USER MOD Single : B 91 TYR OH : rot 180:sc= 0 USER MOD Single : B 93 LYS NZ :NH3+ 155:sc= 0 (180deg=-0.0428) USER MOD Single : B 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 108 HIS : no HD1:sc= 0 X(o=0,f=-0.0012) USER MOD Single : B 109 TYR OH : rot -179:sc= 1.29 USER MOD Single : B 115 LYS NZ :NH3+ 153:sc= 0.163 (180deg=0.0297) USER MOD Single : B 121 TYR OH : rot 16:sc= 0.577 USER MOD Single : B 123 LYS NZ :NH3+ 149:sc= 0 (180deg=-0.0117) USER MOD Single : B 127 LYS NZ :NH3+ 140:sc= 1.12 (180deg=-0.944!) USER MOD Single : B 130 LYS NZ :NH3+ 173:sc= 0.54 (180deg=0.51) USER MOD Single : B 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 138 LYS NZ :NH3+ 136:sc= 0.0499 (180deg=0) USER MOD Single : B 140 TYR OH : rot 180:sc= -0.269 USER MOD Single : B 147 TYR OH : rot 180:sc= 0.277 USER MOD Single : B 148 THR OG1 : rot 38:sc= 0.445 USER MOD Single : B 156 TYR OH : rot 180:sc= 0 USER MOD Single : B 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 2 -13.200 39.142 -32.510 1.00 28.25 N ATOM 2 CA VAL A 2 -12.113 39.928 -31.851 1.00 30.16 C ATOM 3 C VAL A 2 -12.701 41.201 -31.170 1.00 27.85 C ATOM 4 O VAL A 2 -13.504 41.944 -31.761 1.00 28.54 O ATOM 5 CB VAL A 2 -11.028 40.400 -32.860 1.00 30.68 C ATOM 6 CG1 VAL A 2 -9.900 41.121 -32.086 1.00 28.74 C ATOM 7 CG2 VAL A 2 -10.457 39.184 -33.709 1.00 36.05 C ATOM 0 HA VAL A 2 -11.707 39.335 -31.199 1.00 30.16 H new ATOM 0 HB VAL A 2 -11.429 41.018 -33.491 1.00 30.68 H new ATOM 0 HG11 VAL A 2 -9.219 41.419 -32.709 1.00 28.74 H new ATOM 0 HG12 VAL A 2 -10.267 41.888 -31.618 1.00 28.74 H new ATOM 0 HG13 VAL A 2 -9.506 40.510 -31.444 1.00 28.74 H new ATOM 0 HG21 VAL A 2 -9.784 39.509 -34.328 1.00 36.05 H new ATOM 0 HG22 VAL A 2 -10.059 38.531 -33.112 1.00 36.05 H new ATOM 0 HG23 VAL A 2 -11.179 38.769 -34.206 1.00 36.05 H new ATOM 8 N VAL A 3 -12.266 41.498 -29.948 1.00 26.89 N ATOM 9 CA VAL A 3 -12.790 42.683 -29.268 1.00 25.39 C ATOM 10 C VAL A 3 -12.271 43.929 -29.920 1.00 26.04 C ATOM 11 O VAL A 3 -11.032 44.026 -30.170 1.00 25.69 O ATOM 12 CB VAL A 3 -12.359 42.667 -27.797 1.00 27.07 C ATOM 13 CG1 VAL A 3 -12.757 43.978 -27.161 1.00 28.28 C ATOM 14 CG2 VAL A 3 -13.005 41.416 -27.148 1.00 27.27 C ATOM 0 H VAL A 3 -11.686 41.043 -29.505 1.00 26.89 H new ATOM 0 HA VAL A 3 -13.758 42.672 -29.327 1.00 25.39 H new ATOM 0 HB VAL A 3 -11.399 42.596 -27.677 1.00 27.07 H new ATOM 0 HG11 VAL A 3 -12.489 43.980 -26.229 1.00 28.28 H new ATOM 0 HG12 VAL A 3 -12.319 44.709 -27.624 1.00 28.28 H new ATOM 0 HG13 VAL A 3 -13.719 44.088 -27.221 1.00 28.28 H new ATOM 0 HG21 VAL A 3 -12.754 41.371 -26.212 1.00 27.27 H new ATOM 0 HG22 VAL A 3 -13.970 41.475 -27.221 1.00 27.27 H new ATOM 0 HG23 VAL A 3 -12.695 40.618 -27.604 1.00 27.27 H new ATOM 15 N LYS A 4 -13.139 44.914 -30.188 1.00 23.02 N ATOM 16 CA LYS A 4 -12.674 46.128 -30.824 1.00 23.82 C ATOM 17 C LYS A 4 -12.846 47.447 -30.075 1.00 23.20 C ATOM 18 O LYS A 4 -12.159 48.406 -30.391 1.00 25.93 O ATOM 19 CB LYS A 4 -13.276 46.210 -32.240 1.00 27.14 C ATOM 20 CG LYS A 4 -12.545 45.319 -33.305 1.00 33.18 C ATOM 21 CD LYS A 4 -13.561 44.558 -34.151 1.00 44.89 C ATOM 22 CE LYS A 4 -12.861 44.016 -35.442 1.00 49.10 C ATOM 23 NZ LYS A 4 -13.805 43.830 -36.668 1.00 52.24 N ATOM 0 H LYS A 4 -13.980 44.891 -30.010 1.00 23.02 H new ATOM 0 HA LYS A 4 -11.708 46.036 -30.837 1.00 23.82 H new ATOM 0 HB2 LYS A 4 -14.209 45.947 -32.199 1.00 27.14 H new ATOM 0 HB3 LYS A 4 -13.254 47.133 -32.536 1.00 27.14 H new ATOM 0 HG2 LYS A 4 -11.992 45.875 -33.876 1.00 33.18 H new ATOM 0 HG3 LYS A 4 -11.953 44.693 -32.860 1.00 33.18 H new ATOM 0 HD2 LYS A 4 -13.935 43.823 -33.641 1.00 44.89 H new ATOM 0 HD3 LYS A 4 -14.298 45.141 -34.391 1.00 44.89 H new ATOM 0 HE2 LYS A 4 -12.148 44.626 -35.688 1.00 49.10 H new ATOM 0 HE3 LYS A 4 -12.447 43.163 -35.236 1.00 49.10 H new ATOM 0 HZ1 LYS A 4 -13.337 43.521 -37.359 1.00 52.24 H new ATOM 0 HZ2 LYS A 4 -14.448 43.250 -36.462 1.00 52.24 H new ATOM 0 HZ3 LYS A 4 -14.170 44.613 -36.884 1.00 52.24 H new ATOM 24 N ARG A 5 -13.708 47.511 -29.073 1.00 20.68 N ATOM 25 CA ARG A 5 -14.008 48.793 -28.445 1.00 19.96 C ATOM 26 C ARG A 5 -12.829 49.071 -27.526 1.00 21.33 C ATOM 27 O ARG A 5 -12.382 48.157 -26.813 1.00 22.08 O ATOM 28 CB ARG A 5 -15.250 48.691 -27.577 1.00 21.98 C ATOM 29 CG ARG A 5 -16.571 48.366 -28.382 1.00 26.74 C ATOM 30 CD ARG A 5 -17.059 49.519 -29.218 1.00 31.48 C ATOM 31 NE ARG A 5 -17.274 50.706 -28.443 1.00 37.85 N ATOM 32 CZ ARG A 5 -18.432 51.114 -27.886 1.00 42.46 C ATOM 33 NH1 ARG A 5 -18.430 52.282 -27.226 1.00 41.25 N ATOM 34 NH2 ARG A 5 -19.573 50.405 -27.982 1.00 37.32 N ATOM 0 H ARG A 5 -14.127 46.836 -28.743 1.00 20.68 H new ATOM 0 HA ARG A 5 -14.155 49.479 -29.115 1.00 19.96 H new ATOM 0 HB2 ARG A 5 -15.111 48.001 -26.909 1.00 21.98 H new ATOM 0 HB3 ARG A 5 -15.370 49.527 -27.100 1.00 21.98 H new ATOM 0 HG2 ARG A 5 -16.411 47.602 -28.958 1.00 26.74 H new ATOM 0 HG3 ARG A 5 -17.268 48.110 -27.758 1.00 26.74 H new ATOM 0 HD2 ARG A 5 -16.412 49.705 -29.916 1.00 31.48 H new ATOM 0 HD3 ARG A 5 -17.887 49.269 -29.657 1.00 31.48 H new ATOM 0 HE ARG A 5 -16.590 51.213 -28.320 1.00 37.85 H new ATOM 0 HH11 ARG A 5 -17.706 52.743 -27.169 1.00 41.25 H new ATOM 0 HH12 ARG A 5 -19.153 52.570 -26.860 1.00 41.25 H new ATOM 0 HH21 ARG A 5 -19.582 49.660 -28.412 1.00 37.32 H new ATOM 0 HH22 ARG A 5 -20.293 50.697 -27.613 1.00 37.32 H new ATOM 35 N THR A 6 -12.377 50.329 -27.519 1.00 20.55 N ATOM 36 CA THR A 6 -11.181 50.767 -26.806 1.00 20.92 C ATOM 37 C THR A 6 -11.147 50.409 -25.323 1.00 19.79 C ATOM 38 O THR A 6 -10.123 49.863 -24.850 1.00 18.96 O ATOM 39 CB THR A 6 -10.973 52.294 -26.987 1.00 24.32 C ATOM 40 OG1 THR A 6 -10.939 52.547 -28.410 1.00 25.55 O ATOM 41 CG2 THR A 6 -9.655 52.731 -26.431 1.00 23.41 C ATOM 0 H THR A 6 -12.771 50.966 -27.942 1.00 20.55 H new ATOM 0 HA THR A 6 -10.451 50.272 -27.210 1.00 20.92 H new ATOM 0 HB THR A 6 -11.683 52.771 -26.530 1.00 24.32 H new ATOM 0 HG1 THR A 6 -10.531 53.267 -28.557 1.00 25.55 H new ATOM 0 HG21 THR A 6 -9.551 53.687 -26.557 1.00 23.41 H new ATOM 0 HG22 THR A 6 -9.619 52.524 -25.484 1.00 23.41 H new ATOM 0 HG23 THR A 6 -8.939 52.265 -26.891 1.00 23.41 H new ATOM 42 N MET A 7 -12.200 50.766 -24.564 1.00 18.35 N ATOM 43 CA MET A 7 -12.129 50.504 -23.093 1.00 19.49 C ATOM 44 C MET A 7 -12.101 48.997 -22.816 1.00 16.99 C ATOM 45 O MET A 7 -11.341 48.501 -21.938 1.00 17.14 O ATOM 46 CB MET A 7 -13.352 51.140 -22.395 1.00 19.62 C ATOM 47 CG MET A 7 -13.364 52.654 -22.542 1.00 19.77 C ATOM 48 SD MET A 7 -11.874 53.480 -21.945 1.00 22.39 S ATOM 49 CE MET A 7 -12.008 53.333 -20.217 1.00 22.56 C ATOM 0 H MET A 7 -12.922 51.137 -24.848 1.00 18.35 H new ATOM 0 HA MET A 7 -11.314 50.898 -22.745 1.00 19.49 H new ATOM 0 HB2 MET A 7 -14.167 50.772 -22.772 1.00 19.62 H new ATOM 0 HB3 MET A 7 -13.344 50.907 -21.454 1.00 19.62 H new ATOM 0 HG2 MET A 7 -13.489 52.875 -23.478 1.00 19.77 H new ATOM 0 HG3 MET A 7 -14.130 53.007 -22.062 1.00 19.77 H new ATOM 0 HE1 MET A 7 -11.242 53.753 -19.796 1.00 22.56 H new ATOM 0 HE2 MET A 7 -12.821 53.769 -19.917 1.00 22.56 H new ATOM 0 HE3 MET A 7 -12.036 52.395 -19.973 1.00 22.56 H new ATOM 50 N THR A 8 -12.933 48.223 -23.557 1.00 17.36 N ATOM 51 CA THR A 8 -12.962 46.772 -23.307 1.00 18.99 C ATOM 52 C THR A 8 -11.626 46.169 -23.652 1.00 16.90 C ATOM 53 O THR A 8 -11.142 45.264 -22.910 1.00 17.71 O ATOM 54 CB THR A 8 -14.133 46.051 -24.096 1.00 19.60 C ATOM 55 OG1 THR A 8 -15.355 46.551 -23.551 1.00 22.72 O ATOM 56 CG2 THR A 8 -14.110 44.546 -23.853 1.00 20.52 C ATOM 0 H THR A 8 -13.459 48.507 -24.175 1.00 17.36 H new ATOM 0 HA THR A 8 -13.139 46.635 -22.363 1.00 18.99 H new ATOM 0 HB THR A 8 -14.040 46.218 -25.047 1.00 19.60 H new ATOM 0 HG1 THR A 8 -15.460 47.351 -23.785 1.00 22.72 H new ATOM 0 HG21 THR A 8 -14.834 44.128 -24.345 1.00 20.52 H new ATOM 0 HG22 THR A 8 -13.263 44.182 -24.154 1.00 20.52 H new ATOM 0 HG23 THR A 8 -14.219 44.369 -22.905 1.00 20.52 H new ATOM 57 N LYS A 9 -11.057 46.579 -24.774 1.00 19.21 N ATOM 58 CA LYS A 9 -9.705 46.133 -25.118 1.00 18.98 C ATOM 59 C LYS A 9 -8.683 46.433 -24.006 1.00 18.80 C ATOM 60 O LYS A 9 -7.842 45.614 -23.639 1.00 19.11 O ATOM 61 CB LYS A 9 -9.277 46.712 -26.495 1.00 22.05 C ATOM 62 CG LYS A 9 -7.774 46.504 -26.792 1.00 28.36 C ATOM 63 CD LYS A 9 -7.222 47.543 -27.839 1.00 36.63 C ATOM 64 CE LYS A 9 -8.224 47.784 -28.959 1.00 41.44 C ATOM 65 NZ LYS A 9 -8.532 46.426 -29.481 1.00 46.03 N ATOM 0 H LYS A 9 -11.424 47.107 -25.345 1.00 19.21 H new ATOM 0 HA LYS A 9 -9.723 45.166 -25.197 1.00 18.98 H new ATOM 0 HB2 LYS A 9 -9.802 46.292 -27.195 1.00 22.05 H new ATOM 0 HB3 LYS A 9 -9.479 47.660 -26.519 1.00 22.05 H new ATOM 0 HG2 LYS A 9 -7.270 46.581 -25.967 1.00 28.36 H new ATOM 0 HG3 LYS A 9 -7.634 45.605 -27.127 1.00 28.36 H new ATOM 0 HD2 LYS A 9 -7.025 48.381 -27.393 1.00 36.63 H new ATOM 0 HD3 LYS A 9 -6.388 47.217 -28.213 1.00 36.63 H new ATOM 0 HE2 LYS A 9 -9.023 48.225 -28.630 1.00 41.44 H new ATOM 0 HE3 LYS A 9 -7.851 48.352 -29.651 1.00 41.44 H new ATOM 0 HZ1 LYS A 9 -8.591 46.455 -30.369 1.00 46.03 H new ATOM 0 HZ2 LYS A 9 -7.884 45.863 -29.245 1.00 46.03 H new ATOM 0 HZ3 LYS A 9 -9.306 46.146 -29.142 1.00 46.03 H new ATOM 66 N LYS A 10 -8.701 47.652 -23.518 1.00 17.35 N ATOM 67 CA LYS A 10 -7.801 48.005 -22.436 1.00 17.74 C ATOM 68 C LYS A 10 -8.026 47.134 -21.228 1.00 17.48 C ATOM 69 O LYS A 10 -7.053 46.762 -20.592 1.00 17.68 O ATOM 70 CB LYS A 10 -8.024 49.498 -22.063 1.00 18.85 C ATOM 71 CG LYS A 10 -7.176 50.006 -20.886 1.00 24.70 C ATOM 72 CD LYS A 10 -5.710 50.278 -21.260 1.00 37.48 C ATOM 73 CE LYS A 10 -4.935 50.686 -19.978 1.00 42.70 C ATOM 74 NZ LYS A 10 -3.555 50.305 -20.128 1.00 44.95 N ATOM 0 H LYS A 10 -9.216 48.285 -23.790 1.00 17.35 H new ATOM 0 HA LYS A 10 -6.888 47.866 -22.732 1.00 17.74 H new ATOM 0 HB2 LYS A 10 -7.833 50.044 -22.842 1.00 18.85 H new ATOM 0 HB3 LYS A 10 -8.961 49.628 -21.849 1.00 18.85 H new ATOM 0 HG2 LYS A 10 -7.571 50.822 -20.540 1.00 24.70 H new ATOM 0 HG3 LYS A 10 -7.204 49.352 -20.170 1.00 24.70 H new ATOM 0 HD2 LYS A 10 -5.312 49.487 -21.656 1.00 37.48 H new ATOM 0 HD3 LYS A 10 -5.658 50.984 -21.923 1.00 37.48 H new ATOM 0 HE2 LYS A 10 -5.005 51.643 -19.833 1.00 42.70 H new ATOM 0 HE3 LYS A 10 -5.320 50.252 -19.201 1.00 42.70 H new ATOM 0 HZ1 LYS A 10 -3.102 50.535 -19.397 1.00 44.95 H new ATOM 0 HZ2 LYS A 10 -3.501 49.424 -20.245 1.00 44.95 H new ATOM 0 HZ3 LYS A 10 -3.207 50.720 -20.835 1.00 44.95 H new ATOM 75 N PHE A 11 -9.300 46.876 -20.831 1.00 16.99 N ATOM 76 CA PHE A 11 -9.539 46.099 -19.608 1.00 17.32 C ATOM 77 C PHE A 11 -9.078 44.682 -19.864 1.00 16.55 C ATOM 78 O PHE A 11 -8.556 44.059 -18.976 1.00 18.71 O ATOM 79 CB PHE A 11 -11.044 46.103 -19.316 1.00 16.22 C ATOM 80 CG PHE A 11 -11.560 47.463 -18.890 1.00 18.16 C ATOM 81 CD1 PHE A 11 -12.914 47.694 -18.879 1.00 21.39 C ATOM 82 CD2 PHE A 11 -10.679 48.473 -18.469 1.00 19.81 C ATOM 83 CE1 PHE A 11 -13.433 48.915 -18.394 1.00 18.52 C ATOM 84 CE2 PHE A 11 -11.121 49.723 -18.004 1.00 20.94 C ATOM 85 CZ PHE A 11 -12.492 49.973 -17.976 1.00 19.21 C ATOM 0 H PHE A 11 -10.007 47.136 -21.246 1.00 16.99 H new ATOM 0 HA PHE A 11 -9.061 46.476 -18.853 1.00 17.32 H new ATOM 0 HB2 PHE A 11 -11.523 45.814 -20.109 1.00 16.22 H new ATOM 0 HB3 PHE A 11 -11.235 45.457 -18.618 1.00 16.22 H new ATOM 0 HD1 PHE A 11 -13.495 47.040 -19.194 1.00 21.39 H new ATOM 0 HD2 PHE A 11 -9.764 48.307 -18.499 1.00 19.81 H new ATOM 0 HE1 PHE A 11 -14.351 49.050 -18.339 1.00 18.52 H new ATOM 0 HE2 PHE A 11 -10.513 50.368 -17.722 1.00 20.94 H new ATOM 0 HZ PHE A 11 -12.812 50.800 -17.696 1.00 19.21 H new ATOM 86 N LEU A 12 -9.326 44.134 -21.071 1.00 16.45 N ATOM 87 CA LEU A 12 -8.793 42.788 -21.361 1.00 16.73 C ATOM 88 C LEU A 12 -7.221 42.744 -21.297 1.00 17.69 C ATOM 89 O LEU A 12 -6.631 41.726 -20.824 1.00 16.86 O ATOM 90 CB LEU A 12 -9.281 42.237 -22.735 1.00 19.46 C ATOM 91 CG LEU A 12 -10.687 41.603 -22.844 1.00 23.88 C ATOM 92 CD1 LEU A 12 -10.955 40.879 -24.122 1.00 27.33 C ATOM 93 CD2 LEU A 12 -11.032 40.721 -21.688 1.00 29.01 C ATOM 0 H LEU A 12 -9.776 44.503 -21.704 1.00 16.45 H new ATOM 0 HA LEU A 12 -9.145 42.214 -20.663 1.00 16.73 H new ATOM 0 HB2 LEU A 12 -9.241 42.967 -23.372 1.00 19.46 H new ATOM 0 HB3 LEU A 12 -8.638 41.571 -23.026 1.00 19.46 H new ATOM 0 HG LEU A 12 -11.269 42.379 -22.830 1.00 23.88 H new ATOM 0 HD11 LEU A 12 -11.854 40.515 -24.106 1.00 27.33 H new ATOM 0 HD12 LEU A 12 -10.869 41.494 -24.867 1.00 27.33 H new ATOM 0 HD13 LEU A 12 -10.316 40.157 -24.225 1.00 27.33 H new ATOM 0 HD21 LEU A 12 -11.921 40.355 -21.814 1.00 29.01 H new ATOM 0 HD22 LEU A 12 -10.390 39.996 -21.631 1.00 29.01 H new ATOM 0 HD23 LEU A 12 -11.009 41.238 -20.868 1.00 29.01 H new ATOM 94 N AGLU A 13 -6.562 43.767 -21.766 0.50 18.84 N ATOM 95 N BGLU A 13 -6.504 43.720 -21.802 0.50 15.37 N ATOM 96 CA AGLU A 13 -5.123 43.813 -21.663 0.50 23.22 C ATOM 97 CA BGLU A 13 -5.090 43.542 -21.630 0.50 15.75 C ATOM 98 C AGLU A 13 -4.662 43.787 -20.166 0.50 23.82 C ATOM 99 C BGLU A 13 -4.651 43.728 -20.136 0.50 12.21 C ATOM 100 O AGLU A 13 -3.757 43.102 -19.791 0.50 29.42 O ATOM 101 O BGLU A 13 -3.706 43.158 -19.731 0.50 8.20 O ATOM 102 CB AGLU A 13 -4.572 45.009 -22.442 0.50 22.43 C ATOM 103 CB BGLU A 13 -4.216 44.350 -22.659 0.50 20.42 C ATOM 104 CG AGLU A 13 -4.782 44.894 -23.956 0.50 34.29 C ATOM 105 CG BGLU A 13 -2.915 43.327 -23.304 0.50 17.41 C ATOM 106 CD AGLU A 13 -4.685 46.219 -24.784 0.50 41.89 C ATOM 107 CD BGLU A 13 -2.692 43.286 -24.774 0.50 31.64 C ATOM 108 OE1AGLU A 13 -4.463 47.319 -24.225 0.50 43.81 O ATOM 109 OE1BGLU A 13 -1.719 42.525 -25.202 0.50 37.39 O ATOM 110 OE2AGLU A 13 -4.834 46.147 -26.037 0.50 46.45 O ATOM 111 OE2BGLU A 13 -3.417 43.973 -25.534 0.50 28.61 O ATOM 0 H AGLU A 13 -6.922 44.448 -22.148 0.50 15.37 H new ATOM 0 H BGLU A 13 -6.779 44.426 -22.208 0.50 15.37 H new ATOM 0 HA AGLU A 13 -4.751 43.016 -22.071 0.50 15.75 H new ATOM 0 HA BGLU A 13 -4.907 42.615 -21.849 0.50 15.75 H new ATOM 0 HB2AGLU A 13 -4.999 45.819 -22.123 0.50 20.42 H new ATOM 0 HB2BGLU A 13 -4.774 44.670 -23.385 0.50 20.42 H new ATOM 0 HB3AGLU A 13 -3.624 45.097 -22.259 0.50 20.42 H new ATOM 0 HB3BGLU A 13 -3.837 45.131 -22.227 0.50 20.42 H new ATOM 0 HG2AGLU A 13 -4.127 44.270 -24.306 0.50 17.41 H new ATOM 0 HG2BGLU A 13 -2.086 43.612 -22.890 0.50 17.41 H new ATOM 0 HG3AGLU A 13 -5.656 44.504 -24.111 0.50 17.41 H new ATOM 0 HG3BGLU A 13 -3.082 42.419 -23.008 0.50 17.41 H new ATOM 112 N GLU A 14 -5.383 44.502 -19.353 1.00 17.73 N ATOM 113 CA GLU A 14 -5.102 44.662 -17.876 1.00 17.27 C ATOM 114 C GLU A 14 -5.388 43.330 -17.239 1.00 15.29 C ATOM 115 O GLU A 14 -4.596 42.816 -16.426 1.00 17.81 O ATOM 116 CB GLU A 14 -6.000 45.766 -17.188 1.00 18.33 C ATOM 117 CG GLU A 14 -5.576 47.176 -17.695 1.00 26.62 C ATOM 118 CD GLU A 14 -6.144 48.334 -16.906 1.00 41.78 C ATOM 119 OE1 GLU A 14 -7.123 48.950 -17.406 1.00 47.89 O ATOM 120 OE2 GLU A 14 -5.616 48.638 -15.794 1.00 46.56 O ATOM 0 H AGLU A 14 -6.078 44.936 -19.613 0.50 17.73 H new ATOM 0 H BGLU A 14 -6.057 44.958 -19.632 0.50 17.73 H new ATOM 0 HA GLU A 14 -4.182 44.948 -17.761 1.00 17.27 H new ATOM 0 HB2 GLU A 14 -6.935 45.607 -17.390 1.00 18.33 H new ATOM 0 HB3 GLU A 14 -5.906 45.717 -16.224 1.00 18.33 H new ATOM 0 HG2 GLU A 14 -4.608 47.234 -17.678 1.00 26.62 H new ATOM 0 HG3 GLU A 14 -5.849 47.268 -18.621 1.00 26.62 H new ATOM 121 N ALA A 15 -6.508 42.706 -17.626 1.00 16.54 N ATOM 122 CA ALA A 15 -6.836 41.378 -17.053 1.00 15.95 C ATOM 123 C ALA A 15 -5.776 40.322 -17.520 1.00 16.42 C ATOM 124 O ALA A 15 -5.379 39.426 -16.762 1.00 16.93 O ATOM 125 CB ALA A 15 -8.264 40.921 -17.524 1.00 16.50 C ATOM 0 H ALA A 15 -7.074 43.014 -18.195 1.00 16.54 H new ATOM 0 HA ALA A 15 -6.825 41.446 -16.085 1.00 15.95 H new ATOM 0 HB1 ALA A 15 -8.468 40.052 -17.144 1.00 16.50 H new ATOM 0 HB2 ALA A 15 -8.925 41.566 -17.227 1.00 16.50 H new ATOM 0 HB3 ALA A 15 -8.282 40.862 -18.492 1.00 16.50 H new ATOM 126 N PHE A 16 -5.343 40.421 -18.784 1.00 16.42 N ATOM 127 CA PHE A 16 -4.273 39.526 -19.276 1.00 16.23 C ATOM 128 C PHE A 16 -3.008 39.693 -18.383 1.00 15.96 C ATOM 129 O PHE A 16 -2.406 38.660 -17.953 1.00 17.10 O ATOM 130 CB PHE A 16 -3.956 39.772 -20.775 1.00 16.37 C ATOM 131 CG PHE A 16 -2.807 38.899 -21.254 1.00 17.09 C ATOM 132 CD1 PHE A 16 -3.064 37.525 -21.562 1.00 17.74 C ATOM 133 CD2 PHE A 16 -1.522 39.423 -21.364 1.00 19.48 C ATOM 134 CE1 PHE A 16 -1.987 36.637 -21.971 1.00 19.12 C ATOM 135 CE2 PHE A 16 -0.447 38.551 -21.756 1.00 21.97 C ATOM 136 CZ PHE A 16 -0.691 37.155 -22.062 1.00 17.41 C ATOM 0 H PHE A 16 -5.644 40.983 -19.362 1.00 16.42 H new ATOM 0 HA PHE A 16 -4.582 38.609 -19.213 1.00 16.23 H new ATOM 0 HB2 PHE A 16 -4.746 39.590 -21.308 1.00 16.37 H new ATOM 0 HB3 PHE A 16 -3.732 40.706 -20.910 1.00 16.37 H new ATOM 0 HD1 PHE A 16 -3.931 37.196 -21.500 1.00 17.74 H new ATOM 0 HD2 PHE A 16 -1.361 40.322 -21.187 1.00 19.48 H new ATOM 0 HE1 PHE A 16 -2.157 35.744 -22.168 1.00 19.12 H new ATOM 0 HE2 PHE A 16 0.418 38.888 -21.814 1.00 21.97 H new ATOM 0 HZ PHE A 16 0.013 36.605 -22.318 1.00 17.41 H new ATOM 137 N ALA A 17 -2.594 40.969 -18.132 1.00 15.82 N ATOM 138 CA ALA A 17 -1.445 41.211 -17.265 1.00 16.33 C ATOM 139 C ALA A 17 -1.679 40.638 -15.839 1.00 18.21 C ATOM 140 O ALA A 17 -0.830 40.027 -15.232 1.00 16.59 O ATOM 141 CB ALA A 17 -1.147 42.685 -17.181 1.00 16.27 C ATOM 0 H ALA A 17 -2.965 41.676 -18.452 1.00 15.82 H new ATOM 0 HA ALA A 17 -0.684 40.754 -17.655 1.00 16.33 H new ATOM 0 HB1 ALA A 17 -0.382 42.828 -16.602 1.00 16.27 H new ATOM 0 HB2 ALA A 17 -0.950 43.026 -18.067 1.00 16.27 H new ATOM 0 HB3 ALA A 17 -1.917 43.151 -16.820 1.00 16.27 H new ATOM 142 N GLY A 18 -2.903 40.825 -15.336 1.00 16.86 N ATOM 143 CA GLY A 18 -3.251 40.378 -13.931 1.00 18.19 C ATOM 144 C GLY A 18 -3.234 38.868 -13.830 1.00 15.92 C ATOM 145 O GLY A 18 -2.697 38.357 -12.846 1.00 17.57 O ATOM 0 H GLY A 18 -3.549 41.198 -15.764 1.00 16.86 H new ATOM 0 HA2 GLY A 18 -2.618 40.756 -13.300 1.00 18.19 H new ATOM 0 HA3 GLY A 18 -4.128 40.713 -13.688 1.00 18.19 H new ATOM 146 N GLU A 19 -3.809 38.168 -14.853 1.00 14.87 N ATOM 147 CA GLU A 19 -3.785 36.697 -14.839 1.00 17.13 C ATOM 148 C GLU A 19 -2.369 36.154 -15.029 1.00 16.10 C ATOM 149 O GLU A 19 -1.976 35.212 -14.351 1.00 16.27 O ATOM 150 CB GLU A 19 -4.574 36.169 -16.049 1.00 17.44 C ATOM 151 CG GLU A 19 -6.139 36.438 -15.884 1.00 19.13 C ATOM 152 CD GLU A 19 -6.806 35.557 -14.796 1.00 23.24 C ATOM 153 OE1 GLU A 19 -7.885 35.783 -14.271 1.00 19.19 O ATOM 154 OE2 GLU A 19 -6.255 34.574 -14.286 1.00 20.68 O ATOM 0 H GLU A 19 -4.200 38.522 -15.532 1.00 14.87 H new ATOM 0 HA GLU A 19 -4.153 36.418 -13.986 1.00 17.13 H new ATOM 0 HB2 GLU A 19 -4.254 36.597 -16.858 1.00 17.44 H new ATOM 0 HB3 GLU A 19 -4.416 35.217 -16.150 1.00 17.44 H new ATOM 0 HG2 GLU A 19 -6.278 37.372 -15.664 1.00 19.13 H new ATOM 0 HG3 GLU A 19 -6.579 36.279 -16.734 1.00 19.13 H new ATOM 155 N SER A 20 -1.596 36.808 -15.928 1.00 15.79 N ATOM 156 CA SER A 20 -0.194 36.384 -16.102 1.00 15.26 C ATOM 157 C SER A 20 0.552 36.490 -14.762 1.00 14.52 C ATOM 158 O SER A 20 1.378 35.546 -14.385 1.00 15.68 O ATOM 159 CB SER A 20 0.463 37.292 -17.128 1.00 14.17 C ATOM 160 OG SER A 20 -0.116 37.023 -18.440 1.00 17.33 O ATOM 0 H SER A 20 -1.852 37.465 -16.421 1.00 15.79 H new ATOM 0 HA SER A 20 -0.162 35.463 -16.405 1.00 15.26 H new ATOM 0 HB2 SER A 20 0.329 38.222 -16.887 1.00 14.17 H new ATOM 0 HB3 SER A 20 1.421 37.139 -17.147 1.00 14.17 H new ATOM 0 HG SER A 20 -0.838 37.444 -18.519 1.00 17.33 H new ATOM 161 N MET A 21 0.366 37.606 -14.059 1.00 14.76 N ATOM 162 CA MET A 21 1.134 37.807 -12.797 1.00 16.13 C ATOM 163 C MET A 21 0.641 36.867 -11.688 1.00 18.37 C ATOM 164 O MET A 21 1.448 36.347 -10.941 1.00 17.26 O ATOM 165 CB MET A 21 1.065 39.265 -12.246 1.00 15.30 C ATOM 166 CG MET A 21 1.966 40.159 -13.198 1.00 20.18 C ATOM 167 SD MET A 21 2.028 41.841 -12.516 1.00 25.26 S ATOM 168 CE MET A 21 0.430 42.363 -12.980 1.00 23.65 C ATOM 0 H MET A 21 -0.173 38.242 -14.271 1.00 14.76 H new ATOM 0 HA MET A 21 2.053 37.611 -13.036 1.00 16.13 H new ATOM 0 HB2 MET A 21 0.150 39.586 -12.237 1.00 15.30 H new ATOM 0 HB3 MET A 21 1.388 39.303 -11.332 1.00 15.30 H new ATOM 0 HG2 MET A 21 2.860 39.788 -13.263 1.00 20.18 H new ATOM 0 HG3 MET A 21 1.599 40.172 -14.096 1.00 20.18 H new ATOM 0 HE1 MET A 21 0.379 43.330 -12.932 1.00 23.65 H new ATOM 0 HE2 MET A 21 0.246 42.074 -13.888 1.00 23.65 H new ATOM 0 HE3 MET A 21 -0.225 41.975 -12.379 1.00 23.65 H new ATOM 169 N ALA A 22 -0.668 36.560 -11.682 1.00 18.34 N ATOM 170 CA ALA A 22 -1.178 35.618 -10.658 1.00 16.63 C ATOM 171 C ALA A 22 -0.600 34.206 -10.937 1.00 17.46 C ATOM 172 O ALA A 22 -0.147 33.519 -10.042 1.00 17.92 O ATOM 173 CB ALA A 22 -2.763 35.581 -10.736 1.00 17.98 C ATOM 0 H ALA A 22 -1.254 36.867 -12.232 1.00 18.34 H new ATOM 0 HA ALA A 22 -0.907 35.905 -9.772 1.00 16.63 H new ATOM 0 HB1 ALA A 22 -3.106 34.966 -10.069 1.00 17.98 H new ATOM 0 HB2 ALA A 22 -3.116 36.469 -10.569 1.00 17.98 H new ATOM 0 HB3 ALA A 22 -3.037 35.285 -11.618 1.00 17.98 H new ATOM 174 N HIS A 23 -0.630 33.778 -12.184 1.00 15.50 N ATOM 175 CA HIS A 23 -0.017 32.469 -12.643 1.00 16.99 C ATOM 176 C HIS A 23 1.406 32.435 -12.158 1.00 16.39 C ATOM 177 O HIS A 23 1.837 31.454 -11.550 1.00 16.32 O ATOM 178 CB HIS A 23 -0.124 32.391 -14.140 1.00 16.92 C ATOM 179 CG HIS A 23 0.677 31.280 -14.727 1.00 16.89 C ATOM 180 ND1 HIS A 23 0.123 30.054 -14.942 1.00 18.76 N ATOM 181 CD2 HIS A 23 1.957 31.220 -15.202 1.00 16.29 C ATOM 182 CE1 HIS A 23 1.050 29.240 -15.481 1.00 22.55 C ATOM 183 NE2 HIS A 23 2.163 29.942 -15.679 1.00 22.30 N ATOM 0 H HIS A 23 -1.004 34.221 -12.820 1.00 15.50 H new ATOM 0 HA HIS A 23 -0.478 31.697 -12.280 1.00 16.99 H new ATOM 0 HB2 HIS A 23 -1.055 32.276 -14.387 1.00 16.92 H new ATOM 0 HB3 HIS A 23 0.170 33.232 -14.524 1.00 16.92 H new ATOM 0 HD2 HIS A 23 2.576 31.914 -15.203 1.00 16.29 H new ATOM 0 HE1 HIS A 23 0.932 28.339 -15.681 1.00 22.55 H new ATOM 0 HE2 HIS A 23 2.886 29.650 -16.042 1.00 22.30 H new ATOM 184 N MET A 24 2.138 33.527 -12.413 1.00 14.03 N ATOM 185 CA MET A 24 3.598 33.533 -12.085 1.00 14.27 C ATOM 186 C MET A 24 3.753 33.491 -10.557 1.00 14.90 C ATOM 187 O MET A 24 4.553 32.706 -10.017 1.00 14.89 O ATOM 188 CB MET A 24 4.255 34.804 -12.669 1.00 13.19 C ATOM 189 CG MET A 24 5.749 34.883 -12.369 1.00 17.49 C ATOM 190 SD MET A 24 6.634 33.497 -13.171 1.00 18.83 S ATOM 191 CE MET A 24 6.533 33.947 -14.945 1.00 19.40 C ATOM 0 H MET A 24 1.836 34.253 -12.761 1.00 14.03 H new ATOM 0 HA MET A 24 4.037 32.760 -12.473 1.00 14.27 H new ATOM 0 HB2 MET A 24 4.120 34.822 -13.629 1.00 13.19 H new ATOM 0 HB3 MET A 24 3.814 35.588 -12.306 1.00 13.19 H new ATOM 0 HG2 MET A 24 6.104 35.728 -12.686 1.00 17.49 H new ATOM 0 HG3 MET A 24 5.894 34.856 -11.410 1.00 17.49 H new ATOM 0 HE1 MET A 24 7.032 33.303 -15.471 1.00 19.40 H new ATOM 0 HE2 MET A 24 5.605 33.945 -15.227 1.00 19.40 H new ATOM 0 HE3 MET A 24 6.908 34.832 -15.076 1.00 19.40 H new ATOM 192 N ARG A 25 2.981 34.300 -9.830 1.00 15.92 N ATOM 193 CA ARG A 25 3.114 34.226 -8.393 1.00 16.34 C ATOM 194 C ARG A 25 2.868 32.795 -7.874 1.00 15.96 C ATOM 195 O ARG A 25 3.525 32.282 -6.960 1.00 17.94 O ATOM 196 CB ARG A 25 2.093 35.207 -7.750 1.00 18.28 C ATOM 197 CG ARG A 25 2.624 36.673 -7.768 1.00 21.47 C ATOM 198 CD ARG A 25 1.810 37.706 -6.884 1.00 28.36 C ATOM 199 NE ARG A 25 0.440 37.648 -7.255 1.00 36.38 N ATOM 200 CZ ARG A 25 -0.146 38.469 -8.130 1.00 31.95 C ATOM 201 NH1 ARG A 25 -1.419 38.268 -8.407 1.00 34.80 N ATOM 202 NH2 ARG A 25 0.510 39.499 -8.652 1.00 30.27 N ATOM 0 H ARG A 25 2.408 34.865 -10.134 1.00 15.92 H new ATOM 0 HA ARG A 25 4.020 34.471 -8.149 1.00 16.34 H new ATOM 0 HB2 ARG A 25 1.251 35.160 -8.229 1.00 18.28 H new ATOM 0 HB3 ARG A 25 1.914 34.937 -6.836 1.00 18.28 H new ATOM 0 HG2 ARG A 25 3.546 36.670 -7.467 1.00 21.47 H new ATOM 0 HG3 ARG A 25 2.626 36.988 -8.685 1.00 21.47 H new ATOM 0 HD2 ARG A 25 1.912 37.496 -5.943 1.00 28.36 H new ATOM 0 HD3 ARG A 25 2.155 38.603 -7.013 1.00 28.36 H new ATOM 0 HE ARG A 25 -0.047 37.040 -6.890 1.00 36.38 H new ATOM 0 HH11 ARG A 25 -1.845 37.624 -8.028 1.00 34.80 H new ATOM 0 HH12 ARG A 25 -1.823 38.781 -8.967 1.00 34.80 H new ATOM 0 HH21 ARG A 25 1.327 39.647 -8.428 1.00 30.27 H new ATOM 0 HH22 ARG A 25 0.118 40.018 -9.214 1.00 30.27 H new ATOM 203 N TYR A 26 1.824 32.171 -8.390 1.00 16.09 N ATOM 204 CA TYR A 26 1.449 30.859 -7.915 1.00 16.31 C ATOM 205 C TYR A 26 2.534 29.833 -8.217 1.00 17.49 C ATOM 206 O TYR A 26 2.745 28.948 -7.410 1.00 18.56 O ATOM 207 CB TYR A 26 0.077 30.367 -8.473 1.00 16.22 C ATOM 208 CG TYR A 26 -1.060 31.270 -7.994 1.00 20.08 C ATOM 209 CD1 TYR A 26 -2.286 31.341 -8.688 1.00 19.38 C ATOM 210 CD2 TYR A 26 -0.876 32.135 -6.854 1.00 20.70 C ATOM 211 CE1 TYR A 26 -3.309 32.303 -8.292 1.00 18.51 C ATOM 212 CE2 TYR A 26 -1.912 33.038 -6.456 1.00 20.01 C ATOM 213 CZ TYR A 26 -3.112 33.077 -7.172 1.00 21.39 C ATOM 214 OH TYR A 26 -4.156 33.936 -6.817 1.00 23.05 O ATOM 0 H TYR A 26 1.323 32.489 -9.012 1.00 16.09 H new ATOM 0 HA TYR A 26 1.348 30.947 -6.954 1.00 16.31 H new ATOM 0 HB2 TYR A 26 0.102 30.358 -9.443 1.00 16.22 H new ATOM 0 HB3 TYR A 26 -0.086 29.455 -8.185 1.00 16.22 H new ATOM 0 HD1 TYR A 26 -2.444 30.769 -9.404 1.00 19.38 H new ATOM 0 HD2 TYR A 26 -0.079 32.105 -6.375 1.00 20.70 H new ATOM 0 HE1 TYR A 26 -4.088 32.392 -8.793 1.00 18.51 H new ATOM 0 HE2 TYR A 26 -1.787 33.597 -5.723 1.00 20.01 H new ATOM 0 HH TYR A 26 -4.876 33.653 -7.145 1.00 23.05 H new ATOM 215 N LEU A 27 3.207 29.939 -9.362 1.00 17.65 N ATOM 216 CA LEU A 27 4.337 28.995 -9.629 1.00 17.95 C ATOM 217 C LEU A 27 5.481 29.260 -8.608 1.00 17.63 C ATOM 218 O LEU A 27 6.133 28.287 -8.143 1.00 19.27 O ATOM 219 CB LEU A 27 4.866 29.138 -11.051 1.00 17.88 C ATOM 220 CG LEU A 27 3.914 28.688 -12.151 1.00 18.96 C ATOM 221 CD1 LEU A 27 4.663 28.868 -13.544 1.00 18.15 C ATOM 222 CD2 LEU A 27 3.415 27.244 -12.027 1.00 22.36 C ATOM 0 H LEU A 27 3.049 30.515 -9.980 1.00 17.65 H new ATOM 0 HA LEU A 27 4.006 28.089 -9.529 1.00 17.95 H new ATOM 0 HB2 LEU A 27 5.094 30.068 -11.203 1.00 17.88 H new ATOM 0 HB3 LEU A 27 5.688 28.628 -11.127 1.00 17.88 H new ATOM 0 HG LEU A 27 3.119 29.239 -12.077 1.00 18.96 H new ATOM 0 HD11 LEU A 27 4.078 28.588 -14.265 1.00 18.15 H new ATOM 0 HD12 LEU A 27 4.901 29.800 -13.665 1.00 18.15 H new ATOM 0 HD13 LEU A 27 5.467 28.326 -13.552 1.00 18.15 H new ATOM 0 HD21 LEU A 27 2.818 27.043 -12.764 1.00 22.36 H new ATOM 0 HD22 LEU A 27 4.171 26.637 -12.050 1.00 22.36 H new ATOM 0 HD23 LEU A 27 2.940 27.137 -11.188 1.00 22.36 H new ATOM 223 N ILE A 28 5.747 30.509 -8.312 1.00 16.00 N ATOM 224 CA ILE A 28 6.839 30.851 -7.404 1.00 17.77 C ATOM 225 C ILE A 28 6.402 30.258 -6.005 1.00 18.14 C ATOM 226 O ILE A 28 7.228 29.683 -5.234 1.00 19.26 O ATOM 227 CB ILE A 28 7.079 32.357 -7.355 1.00 16.46 C ATOM 228 CG1 ILE A 28 7.631 32.863 -8.704 1.00 16.86 C ATOM 229 CG2 ILE A 28 8.023 32.858 -6.119 1.00 17.32 C ATOM 230 CD1 ILE A 28 7.573 34.393 -8.765 1.00 16.85 C ATOM 0 H ILE A 28 5.312 31.183 -8.622 1.00 16.00 H new ATOM 0 HA ILE A 28 7.688 30.481 -7.693 1.00 17.77 H new ATOM 0 HB ILE A 28 6.209 32.751 -7.187 1.00 16.46 H new ATOM 0 HG12 ILE A 28 8.546 32.563 -8.818 1.00 16.86 H new ATOM 0 HG13 ILE A 28 7.116 32.485 -9.433 1.00 16.86 H new ATOM 0 HG21 ILE A 28 8.125 33.822 -6.160 1.00 17.32 H new ATOM 0 HG22 ILE A 28 7.610 32.613 -5.276 1.00 17.32 H new ATOM 0 HG23 ILE A 28 8.895 32.438 -6.186 1.00 17.32 H new ATOM 0 HD11 ILE A 28 7.923 34.697 -9.617 1.00 16.85 H new ATOM 0 HD12 ILE A 28 6.653 34.686 -8.670 1.00 16.85 H new ATOM 0 HD13 ILE A 28 8.106 34.766 -8.046 1.00 16.85 H new ATOM 231 N PHE A 29 5.137 30.516 -5.645 1.00 19.21 N ATOM 232 CA PHE A 29 4.587 30.029 -4.306 1.00 18.58 C ATOM 233 C PHE A 29 4.562 28.480 -4.221 1.00 19.51 C ATOM 234 O PHE A 29 4.830 27.928 -3.120 1.00 21.18 O ATOM 235 CB PHE A 29 3.189 30.558 -4.049 1.00 18.07 C ATOM 236 CG PHE A 29 3.082 32.039 -3.875 1.00 17.30 C ATOM 237 CD1 PHE A 29 1.832 32.638 -4.017 1.00 16.59 C ATOM 238 CD2 PHE A 29 4.235 32.849 -3.618 1.00 17.78 C ATOM 239 CE1 PHE A 29 1.719 34.045 -3.829 1.00 16.96 C ATOM 240 CE2 PHE A 29 4.115 34.203 -3.444 1.00 19.65 C ATOM 241 CZ PHE A 29 2.864 34.802 -3.542 1.00 20.71 C ATOM 0 H PHE A 29 4.576 30.955 -6.126 1.00 19.21 H new ATOM 0 HA PHE A 29 5.188 30.373 -3.627 1.00 18.58 H new ATOM 0 HB2 PHE A 29 2.619 30.293 -4.788 1.00 18.07 H new ATOM 0 HB3 PHE A 29 2.839 30.129 -3.253 1.00 18.07 H new ATOM 0 HD1 PHE A 29 1.084 32.128 -4.231 1.00 16.59 H new ATOM 0 HD2 PHE A 29 5.074 32.452 -3.569 1.00 17.78 H new ATOM 0 HE1 PHE A 29 0.889 34.460 -3.896 1.00 16.96 H new ATOM 0 HE2 PHE A 29 4.867 34.719 -3.261 1.00 19.65 H new ATOM 0 HZ PHE A 29 2.785 35.720 -3.415 1.00 20.71 H new ATOM 242 N ALA A 30 4.342 27.794 -5.349 1.00 19.18 N ATOM 243 CA ALA A 30 4.292 26.306 -5.376 1.00 19.60 C ATOM 244 C ALA A 30 5.658 25.776 -5.037 1.00 22.41 C ATOM 245 O ALA A 30 5.805 24.900 -4.162 1.00 21.93 O ATOM 246 CB ALA A 30 3.877 25.784 -6.717 1.00 21.03 C ATOM 0 H ALA A 30 4.218 28.164 -6.115 1.00 19.18 H new ATOM 0 HA ALA A 30 3.632 26.010 -4.729 1.00 19.60 H new ATOM 0 HB1 ALA A 30 3.856 24.814 -6.695 1.00 21.03 H new ATOM 0 HB2 ALA A 30 2.994 26.121 -6.937 1.00 21.03 H new ATOM 0 HB3 ALA A 30 4.511 26.078 -7.389 1.00 21.03 H new ATOM 247 N GLU A 31 6.680 26.381 -5.651 1.00 23.24 N ATOM 248 CA GLU A 31 8.086 26.005 -5.321 1.00 24.20 C ATOM 249 C GLU A 31 8.477 26.249 -3.843 1.00 25.29 C ATOM 250 O GLU A 31 9.038 25.360 -3.232 1.00 25.47 O ATOM 251 CB GLU A 31 9.013 26.736 -6.304 1.00 25.52 C ATOM 252 CG GLU A 31 10.385 26.269 -6.322 1.00 30.16 C ATOM 253 CD GLU A 31 11.122 27.006 -7.454 1.00 35.71 C ATOM 254 OE1 GLU A 31 11.168 28.264 -7.443 1.00 27.98 O ATOM 255 OE2 GLU A 31 11.650 26.311 -8.319 1.00 40.66 O ATOM 0 H GLU A 31 6.598 26.996 -6.247 1.00 23.24 H new ATOM 0 HA GLU A 31 8.179 25.045 -5.423 1.00 24.20 H new ATOM 0 HB2 GLU A 31 8.645 26.650 -7.198 1.00 25.52 H new ATOM 0 HB3 GLU A 31 9.011 27.681 -6.086 1.00 25.52 H new ATOM 0 HG2 GLU A 31 10.814 26.442 -5.469 1.00 30.16 H new ATOM 0 HG3 GLU A 31 10.415 25.310 -6.465 1.00 30.16 H new ATOM 256 N LYS A 32 8.128 27.412 -3.258 1.00 23.76 N ATOM 257 CA LYS A 32 8.306 27.663 -1.839 1.00 24.17 C ATOM 258 C LYS A 32 7.500 26.704 -0.941 1.00 24.19 C ATOM 259 O LYS A 32 8.013 26.200 0.065 1.00 24.25 O ATOM 260 CB LYS A 32 7.933 29.125 -1.543 1.00 24.50 C ATOM 261 CG LYS A 32 8.216 29.506 -0.106 1.00 27.01 C ATOM 262 CD LYS A 32 9.754 29.556 0.069 1.00 34.96 C ATOM 263 CE LYS A 32 10.167 30.363 1.269 1.00 37.42 C ATOM 264 NZ LYS A 32 11.667 30.605 1.278 1.00 40.03 N ATOM 0 H LYS A 32 7.781 28.072 -3.687 1.00 23.76 H new ATOM 0 HA LYS A 32 9.238 27.499 -1.627 1.00 24.17 H new ATOM 0 HB2 LYS A 32 8.430 29.710 -2.135 1.00 24.50 H new ATOM 0 HB3 LYS A 32 6.992 29.262 -1.733 1.00 24.50 H new ATOM 0 HG2 LYS A 32 7.821 30.367 0.103 1.00 27.01 H new ATOM 0 HG3 LYS A 32 7.824 28.859 0.502 1.00 27.01 H new ATOM 0 HD2 LYS A 32 10.097 28.653 0.156 1.00 34.96 H new ATOM 0 HD3 LYS A 32 10.156 29.937 -0.728 1.00 34.96 H new ATOM 0 HE2 LYS A 32 9.700 31.213 1.267 1.00 37.42 H new ATOM 0 HE3 LYS A 32 9.907 29.898 2.080 1.00 37.42 H new ATOM 0 HZ1 LYS A 32 11.886 31.083 1.996 1.00 40.03 H new ATOM 0 HZ2 LYS A 32 12.094 29.824 1.300 1.00 40.03 H new ATOM 0 HZ3 LYS A 32 11.901 31.049 0.543 1.00 40.03 H new ATOM 265 N ALA A 33 6.283 26.344 -1.345 1.00 22.47 N ATOM 266 CA ALA A 33 5.494 25.396 -0.525 1.00 24.64 C ATOM 267 C ALA A 33 6.167 24.016 -0.485 1.00 25.81 C ATOM 268 O ALA A 33 6.286 23.422 0.613 1.00 27.11 O ATOM 269 CB ALA A 33 4.003 25.275 -1.034 1.00 23.92 C ATOM 0 H ALA A 33 5.899 26.620 -2.063 1.00 22.47 H new ATOM 0 HA ALA A 33 5.465 25.752 0.377 1.00 24.64 H new ATOM 0 HB1 ALA A 33 3.520 24.647 -0.474 1.00 23.92 H new ATOM 0 HB2 ALA A 33 3.574 26.144 -0.990 1.00 23.92 H new ATOM 0 HB3 ALA A 33 3.999 24.959 -1.951 1.00 23.92 H new ATOM 270 N GLU A 34 6.655 23.571 -1.648 1.00 27.06 N ATOM 271 CA GLU A 34 7.350 22.306 -1.774 1.00 31.92 C ATOM 272 C GLU A 34 8.584 22.321 -0.895 1.00 32.64 C ATOM 273 O GLU A 34 8.803 21.364 -0.163 1.00 33.12 O ATOM 274 CB GLU A 34 7.820 22.066 -3.217 1.00 32.87 C ATOM 275 CG GLU A 34 8.063 20.588 -3.574 1.00 43.45 C ATOM 276 CD GLU A 34 6.775 19.705 -3.475 1.00 52.16 C ATOM 277 OE1 GLU A 34 6.013 19.538 -4.483 1.00 55.21 O ATOM 278 OE2 GLU A 34 6.541 19.163 -2.363 1.00 58.20 O ATOM 0 H GLU A 34 6.587 24.006 -2.387 1.00 27.06 H new ATOM 0 HA GLU A 34 6.732 21.605 -1.512 1.00 31.92 H new ATOM 0 HB2 GLU A 34 7.157 22.429 -3.825 1.00 32.87 H new ATOM 0 HB3 GLU A 34 8.641 22.561 -3.364 1.00 32.87 H new ATOM 0 HG2 GLU A 34 8.416 20.534 -4.476 1.00 43.45 H new ATOM 0 HG3 GLU A 34 8.741 20.227 -2.982 1.00 43.45 H new ATOM 279 N GLN A 35 9.382 23.396 -0.938 1.00 32.44 N ATOM 280 CA GLN A 35 10.567 23.508 -0.062 1.00 33.00 C ATOM 281 C GLN A 35 10.254 23.513 1.426 1.00 33.66 C ATOM 282 O GLN A 35 11.063 23.044 2.221 1.00 33.96 O ATOM 283 CB GLN A 35 11.358 24.788 -0.406 1.00 33.77 C ATOM 284 CG GLN A 35 11.998 24.703 -1.797 1.00 37.69 C ATOM 285 CD GLN A 35 12.285 26.070 -2.424 1.00 44.75 C ATOM 286 OE1 GLN A 35 11.938 27.125 -1.876 1.00 46.32 O ATOM 287 NE2 GLN A 35 12.894 26.050 -3.593 1.00 47.87 N ATOM 0 H GLN A 35 9.259 24.067 -1.461 1.00 32.44 H new ATOM 0 HA GLN A 35 11.090 22.709 -0.234 1.00 33.00 H new ATOM 0 HB2 GLN A 35 10.765 25.555 -0.369 1.00 33.77 H new ATOM 0 HB3 GLN A 35 12.049 24.931 0.260 1.00 33.77 H new ATOM 0 HG2 GLN A 35 12.828 24.204 -1.733 1.00 37.69 H new ATOM 0 HG3 GLN A 35 11.411 24.203 -2.385 1.00 37.69 H new ATOM 0 HE21 GLN A 35 13.122 25.300 -3.946 1.00 47.87 H new ATOM 0 HE22 GLN A 35 13.063 26.787 -4.002 1.00 47.87 H new ATOM 288 N GLU A 36 9.125 24.089 1.839 1.00 31.13 N ATOM 289 CA GLU A 36 8.761 24.164 3.233 1.00 32.54 C ATOM 290 C GLU A 36 8.050 22.956 3.788 1.00 33.23 C ATOM 291 O GLU A 36 7.694 22.947 4.966 1.00 33.43 O ATOM 292 CB GLU A 36 7.878 25.396 3.495 1.00 33.15 C ATOM 293 CG GLU A 36 8.592 26.727 3.310 1.00 36.90 C ATOM 294 CD GLU A 36 7.740 27.858 3.865 1.00 43.83 C ATOM 295 OE1 GLU A 36 8.155 28.491 4.856 1.00 50.06 O ATOM 296 OE2 GLU A 36 6.608 28.062 3.397 1.00 41.13 O ATOM 0 H GLU A 36 8.552 24.447 1.307 1.00 31.13 H new ATOM 0 HA GLU A 36 9.613 24.220 3.693 1.00 32.54 H new ATOM 0 HB2 GLU A 36 7.113 25.365 2.899 1.00 33.15 H new ATOM 0 HB3 GLU A 36 7.534 25.348 4.401 1.00 33.15 H new ATOM 0 HG2 GLU A 36 9.450 26.707 3.762 1.00 36.90 H new ATOM 0 HG3 GLU A 36 8.770 26.879 2.369 1.00 36.90 H new ATOM 297 N GLY A 37 7.747 21.983 2.931 1.00 32.36 N ATOM 298 CA GLY A 37 7.197 20.688 3.349 1.00 33.09 C ATOM 299 C GLY A 37 5.685 20.693 3.294 1.00 32.90 C ATOM 300 O GLY A 37 5.060 20.032 4.117 1.00 32.49 O ATOM 0 H GLY A 37 7.855 22.054 2.081 1.00 32.36 H new ATOM 0 HA2 GLY A 37 7.542 19.987 2.775 1.00 33.09 H new ATOM 0 HA3 GLY A 37 7.490 20.485 4.251 1.00 33.09 H new ATOM 301 N PHE A 38 5.068 21.458 2.354 1.00 31.05 N ATOM 302 CA PHE A 38 3.617 21.360 2.099 1.00 28.60 C ATOM 303 C PHE A 38 3.347 20.951 0.651 1.00 29.00 C ATOM 304 O PHE A 38 2.993 21.836 -0.183 1.00 25.06 O ATOM 305 CB PHE A 38 2.966 22.737 2.304 1.00 29.23 C ATOM 306 CG PHE A 38 3.165 23.325 3.660 1.00 30.13 C ATOM 307 CD1 PHE A 38 3.972 24.444 3.839 1.00 31.56 C ATOM 308 CD2 PHE A 38 2.503 22.785 4.784 1.00 31.21 C ATOM 309 CE1 PHE A 38 4.116 25.020 5.093 1.00 33.56 C ATOM 310 CE2 PHE A 38 2.660 23.364 6.031 1.00 30.21 C ATOM 311 CZ PHE A 38 3.452 24.480 6.188 1.00 34.14 C ATOM 0 H PHE A 38 5.476 22.033 1.861 1.00 31.05 H new ATOM 0 HA PHE A 38 3.253 20.699 2.709 1.00 28.60 H new ATOM 0 HB2 PHE A 38 3.322 23.351 1.643 1.00 29.23 H new ATOM 0 HB3 PHE A 38 2.014 22.659 2.135 1.00 29.23 H new ATOM 0 HD1 PHE A 38 4.420 24.810 3.110 1.00 31.56 H new ATOM 0 HD2 PHE A 38 1.959 22.037 4.686 1.00 31.21 H new ATOM 0 HE1 PHE A 38 4.658 25.768 5.201 1.00 33.56 H new ATOM 0 HE2 PHE A 38 2.228 22.997 6.768 1.00 30.21 H new ATOM 0 HZ PHE A 38 3.542 24.872 7.026 1.00 34.14 H new ATOM 312 N PRO A 39 3.512 19.638 0.319 1.00 29.20 N ATOM 313 CA PRO A 39 3.334 19.206 -1.086 1.00 29.13 C ATOM 314 C PRO A 39 1.916 19.310 -1.636 1.00 27.96 C ATOM 315 O PRO A 39 1.728 19.527 -2.850 1.00 28.20 O ATOM 316 CB PRO A 39 3.868 17.753 -1.117 1.00 28.95 C ATOM 317 CG PRO A 39 3.759 17.275 0.370 1.00 31.48 C ATOM 318 CD PRO A 39 4.010 18.527 1.186 1.00 29.33 C ATOM 0 HA PRO A 39 3.817 19.806 -1.676 1.00 29.13 H new ATOM 0 HB2 PRO A 39 3.341 17.194 -1.709 1.00 28.95 H new ATOM 0 HB3 PRO A 39 4.784 17.718 -1.435 1.00 28.95 H new ATOM 0 HG2 PRO A 39 2.885 16.900 0.558 1.00 31.48 H new ATOM 0 HG3 PRO A 39 4.412 16.586 0.569 1.00 31.48 H new ATOM 0 HD2 PRO A 39 3.537 18.499 2.032 1.00 29.33 H new ATOM 0 HD3 PRO A 39 4.952 18.633 1.391 1.00 29.33 H new ATOM 319 N ASN A 40 0.931 19.240 -0.756 1.00 28.04 N ATOM 320 CA ASN A 40 -0.464 19.341 -1.218 1.00 27.58 C ATOM 321 C ASN A 40 -0.871 20.795 -1.498 1.00 25.36 C ATOM 322 O ASN A 40 -1.574 21.053 -2.468 1.00 26.62 O ATOM 323 CB ASN A 40 -1.427 18.666 -0.234 1.00 26.50 C ATOM 324 CG ASN A 40 -1.343 17.142 -0.270 1.00 32.48 C ATOM 325 OD1 ASN A 40 -0.999 16.519 -1.303 1.00 35.02 O ATOM 326 ND2 ASN A 40 -1.761 16.517 0.854 1.00 37.01 N ATOM 0 H ASN A 40 1.033 19.137 0.092 1.00 28.04 H new ATOM 0 HA ASN A 40 -0.523 18.864 -2.060 1.00 27.58 H new ATOM 0 HB2 ASN A 40 -1.233 18.975 0.665 1.00 26.50 H new ATOM 0 HB3 ASN A 40 -2.335 18.940 -0.438 1.00 26.50 H new ATOM 0 HD21 ASN A 40 -1.799 15.658 0.880 1.00 37.01 H new ATOM 0 HD22 ASN A 40 -1.989 16.978 1.543 1.00 37.01 H new ATOM 327 N ILE A 41 -0.376 21.716 -0.681 1.00 25.12 N ATOM 328 CA ILE A 41 -0.528 23.178 -0.955 1.00 24.65 C ATOM 329 C ILE A 41 0.246 23.519 -2.287 1.00 24.24 C ATOM 330 O ILE A 41 -0.245 24.317 -3.093 1.00 21.02 O ATOM 331 CB ILE A 41 0.056 24.066 0.164 1.00 25.12 C ATOM 332 CG1 ILE A 41 -0.667 23.945 1.541 1.00 31.71 C ATOM 333 CG2 ILE A 41 0.035 25.585 -0.221 1.00 24.36 C ATOM 334 CD1 ILE A 41 -1.942 23.596 1.392 1.00 36.39 C ATOM 0 H ILE A 41 0.054 21.534 0.041 1.00 25.12 H new ATOM 0 HA ILE A 41 -1.479 23.360 -1.018 1.00 24.65 H new ATOM 0 HB ILE A 41 0.962 23.731 0.257 1.00 25.12 H new ATOM 0 HG12 ILE A 41 -0.212 23.287 2.090 1.00 31.71 H new ATOM 0 HG13 ILE A 41 -0.615 24.792 2.011 1.00 31.71 H new ATOM 0 HG21 ILE A 41 0.409 26.108 0.505 1.00 24.36 H new ATOM 0 HG22 ILE A 41 0.562 25.723 -1.023 1.00 24.36 H new ATOM 0 HG23 ILE A 41 -0.879 25.865 -0.384 1.00 24.36 H new ATOM 0 HD11 ILE A 41 -2.363 23.529 2.263 1.00 36.39 H new ATOM 0 HD12 ILE A 41 -2.401 24.266 0.862 1.00 36.39 H new ATOM 0 HD13 ILE A 41 -1.992 22.738 0.942 1.00 36.39 H new ATOM 335 N ALA A 42 1.425 22.897 -2.513 1.00 22.40 N ATOM 336 CA ALA A 42 2.180 23.094 -3.743 1.00 23.04 C ATOM 337 C ALA A 42 1.352 22.674 -4.932 1.00 22.98 C ATOM 338 O ALA A 42 1.300 23.373 -5.964 1.00 23.11 O ATOM 339 CB ALA A 42 3.522 22.331 -3.691 1.00 24.01 C ATOM 0 H ALA A 42 1.795 22.357 -1.955 1.00 22.40 H new ATOM 0 HA ALA A 42 2.386 24.037 -3.836 1.00 23.04 H new ATOM 0 HB1 ALA A 42 4.009 22.475 -4.518 1.00 24.01 H new ATOM 0 HB2 ALA A 42 4.050 22.655 -2.945 1.00 24.01 H new ATOM 0 HB3 ALA A 42 3.351 21.383 -3.578 1.00 24.01 H new ATOM 340 N LYS A 43 0.656 21.557 -4.790 1.00 23.05 N ATOM 341 CA LYS A 43 -0.114 20.979 -5.865 1.00 25.04 C ATOM 342 C LYS A 43 -1.272 21.909 -6.117 1.00 22.20 C ATOM 343 O LYS A 43 -1.636 22.097 -7.269 1.00 22.26 O ATOM 344 CB LYS A 43 -0.642 19.582 -5.422 1.00 26.41 C ATOM 345 CG LYS A 43 -1.427 18.845 -6.446 1.00 34.62 C ATOM 346 CD LYS A 43 -1.593 17.350 -6.036 1.00 42.22 C ATOM 347 CE LYS A 43 -2.465 17.215 -4.819 1.00 41.56 C ATOM 348 NZ LYS A 43 -2.140 15.904 -4.145 1.00 48.49 N ATOM 0 H LYS A 43 0.620 21.111 -4.056 1.00 23.05 H new ATOM 0 HA LYS A 43 0.420 20.866 -6.667 1.00 25.04 H new ATOM 0 HB2 LYS A 43 0.115 19.035 -5.161 1.00 26.41 H new ATOM 0 HB3 LYS A 43 -1.195 19.697 -4.633 1.00 26.41 H new ATOM 0 HG2 LYS A 43 -2.299 19.256 -6.550 1.00 34.62 H new ATOM 0 HG3 LYS A 43 -0.982 18.903 -7.306 1.00 34.62 H new ATOM 0 HD2 LYS A 43 -1.981 16.851 -6.772 1.00 42.22 H new ATOM 0 HD3 LYS A 43 -0.722 16.962 -5.858 1.00 42.22 H new ATOM 0 HE2 LYS A 43 -2.312 17.955 -4.210 1.00 41.56 H new ATOM 0 HE3 LYS A 43 -3.402 17.243 -5.070 1.00 41.56 H new ATOM 0 HZ1 LYS A 43 -1.981 16.046 -3.281 1.00 48.49 H new ATOM 0 HZ2 LYS A 43 -2.828 15.347 -4.232 1.00 48.49 H new ATOM 0 HZ3 LYS A 43 -1.419 15.546 -4.524 1.00 48.49 H new ATOM 349 N LEU A 44 -1.871 22.419 -5.049 1.00 21.67 N ATOM 350 CA LEU A 44 -2.960 23.364 -5.152 1.00 21.60 C ATOM 351 C LEU A 44 -2.515 24.645 -5.961 1.00 19.68 C ATOM 352 O LEU A 44 -3.220 25.095 -6.879 1.00 19.83 O ATOM 353 CB LEU A 44 -3.451 23.737 -3.764 1.00 21.56 C ATOM 354 CG LEU A 44 -4.575 24.802 -3.760 1.00 20.90 C ATOM 355 CD1 LEU A 44 -5.826 24.225 -4.430 1.00 26.15 C ATOM 356 CD2 LEU A 44 -4.904 25.258 -2.370 1.00 24.07 C ATOM 0 H LEU A 44 -1.652 22.222 -4.241 1.00 21.67 H new ATOM 0 HA LEU A 44 -3.691 22.950 -5.637 1.00 21.60 H new ATOM 0 HB2 LEU A 44 -3.774 22.938 -3.319 1.00 21.56 H new ATOM 0 HB3 LEU A 44 -2.702 24.068 -3.244 1.00 21.56 H new ATOM 0 HG LEU A 44 -4.260 25.574 -4.255 1.00 20.90 H new ATOM 0 HD11 LEU A 44 -6.531 24.891 -4.428 1.00 26.15 H new ATOM 0 HD12 LEU A 44 -5.618 23.977 -5.345 1.00 26.15 H new ATOM 0 HD13 LEU A 44 -6.122 23.441 -3.942 1.00 26.15 H new ATOM 0 HD21 LEU A 44 -5.610 25.923 -2.406 1.00 24.07 H new ATOM 0 HD22 LEU A 44 -5.201 24.500 -1.842 1.00 24.07 H new ATOM 0 HD23 LEU A 44 -4.115 25.647 -1.961 1.00 24.07 H new ATOM 357 N PHE A 45 -1.383 25.217 -5.570 1.00 19.08 N ATOM 358 CA PHE A 45 -0.825 26.432 -6.321 1.00 19.77 C ATOM 359 C PHE A 45 -0.582 26.087 -7.762 1.00 20.28 C ATOM 360 O PHE A 45 -0.918 26.884 -8.645 1.00 19.51 O ATOM 361 CB PHE A 45 0.504 26.925 -5.710 1.00 19.69 C ATOM 362 CG PHE A 45 0.355 27.848 -4.527 1.00 21.50 C ATOM 363 CD1 PHE A 45 -0.442 29.010 -4.605 1.00 18.56 C ATOM 364 CD2 PHE A 45 0.992 27.544 -3.315 1.00 21.05 C ATOM 365 CE1 PHE A 45 -0.540 29.906 -3.461 1.00 19.32 C ATOM 366 CE2 PHE A 45 0.915 28.436 -2.189 1.00 20.56 C ATOM 367 CZ PHE A 45 0.130 29.590 -2.265 1.00 18.29 C ATOM 0 H PHE A 45 -0.910 24.956 -4.901 1.00 19.08 H new ATOM 0 HA PHE A 45 -1.487 27.137 -6.247 1.00 19.77 H new ATOM 0 HB2 PHE A 45 1.026 26.154 -5.438 1.00 19.69 H new ATOM 0 HB3 PHE A 45 1.011 27.382 -6.399 1.00 19.69 H new ATOM 0 HD1 PHE A 45 -0.905 29.204 -5.388 1.00 18.56 H new ATOM 0 HD2 PHE A 45 1.473 26.752 -3.238 1.00 21.05 H new ATOM 0 HE1 PHE A 45 -1.044 30.685 -3.521 1.00 19.32 H new ATOM 0 HE2 PHE A 45 1.387 28.245 -1.411 1.00 20.56 H new ATOM 0 HZ PHE A 45 0.051 30.148 -1.526 1.00 18.29 H new ATOM 368 N ARG A 46 0.003 24.923 -8.047 1.00 19.54 N ATOM 369 CA ARG A 46 0.227 24.576 -9.469 1.00 20.47 C ATOM 370 C ARG A 46 -1.057 24.426 -10.302 1.00 19.58 C ATOM 371 O ARG A 46 -1.130 24.825 -11.479 1.00 18.64 O ATOM 372 CB ARG A 46 1.034 23.251 -9.540 1.00 22.73 C ATOM 373 CG ARG A 46 2.505 23.472 -9.154 1.00 26.33 C ATOM 374 CD ARG A 46 3.284 22.170 -9.418 1.00 34.65 C ATOM 375 NE ARG A 46 4.410 22.132 -8.512 1.00 44.55 N ATOM 376 CZ ARG A 46 4.475 21.293 -7.473 1.00 45.37 C ATOM 377 NH1 ARG A 46 3.485 20.382 -7.247 1.00 46.02 N ATOM 378 NH2 ARG A 46 5.553 21.342 -6.702 1.00 44.28 N ATOM 0 H ARG A 46 0.268 24.342 -7.471 1.00 19.54 H new ATOM 0 HA ARG A 46 0.712 25.321 -9.857 1.00 20.47 H new ATOM 0 HB2 ARG A 46 0.636 22.595 -8.946 1.00 22.73 H new ATOM 0 HB3 ARG A 46 0.984 22.887 -10.438 1.00 22.73 H new ATOM 0 HG2 ARG A 46 2.883 24.201 -9.671 1.00 26.33 H new ATOM 0 HG3 ARG A 46 2.574 23.722 -8.219 1.00 26.33 H new ATOM 0 HD2 ARG A 46 2.712 21.399 -9.281 1.00 34.65 H new ATOM 0 HD3 ARG A 46 3.588 22.137 -10.339 1.00 34.65 H new ATOM 0 HE ARG A 46 5.066 22.672 -8.647 1.00 44.55 H new ATOM 0 HH11 ARG A 46 2.808 20.342 -7.776 1.00 46.02 H new ATOM 0 HH12 ARG A 46 3.538 19.847 -6.575 1.00 46.02 H new ATOM 0 HH21 ARG A 46 6.182 21.901 -6.878 1.00 44.28 H new ATOM 0 HH22 ARG A 46 5.623 20.814 -6.026 1.00 44.28 H new ATOM 379 N ALA A 47 -2.103 23.828 -9.700 1.00 20.44 N ATOM 380 CA ALA A 47 -3.267 23.571 -10.474 1.00 19.71 C ATOM 381 C ALA A 47 -3.950 24.936 -10.690 1.00 20.37 C ATOM 382 O ALA A 47 -4.497 25.189 -11.763 1.00 17.41 O ATOM 383 CB ALA A 47 -4.254 22.587 -9.692 1.00 20.63 C ATOM 0 H ALA A 47 -2.135 23.582 -8.877 1.00 20.44 H new ATOM 0 HA ALA A 47 -3.039 23.147 -11.316 1.00 19.71 H new ATOM 0 HB1 ALA A 47 -5.042 22.422 -10.233 1.00 20.63 H new ATOM 0 HB2 ALA A 47 -3.802 21.747 -9.516 1.00 20.63 H new ATOM 0 HB3 ALA A 47 -4.518 22.994 -8.852 1.00 20.63 H new ATOM 384 N ILE A 48 -3.993 25.760 -9.640 1.00 17.67 N ATOM 385 CA ILE A 48 -4.674 27.047 -9.797 1.00 19.75 C ATOM 386 C ILE A 48 -3.834 27.919 -10.787 1.00 19.63 C ATOM 387 O ILE A 48 -4.367 28.662 -11.601 1.00 18.23 O ATOM 388 CB ILE A 48 -4.880 27.716 -8.415 1.00 18.52 C ATOM 389 CG1 ILE A 48 -6.025 26.954 -7.684 1.00 20.63 C ATOM 390 CG2 ILE A 48 -5.331 29.205 -8.609 1.00 19.64 C ATOM 391 CD1 ILE A 48 -6.244 27.594 -6.255 1.00 21.41 C ATOM 0 H ILE A 48 -3.653 25.605 -8.866 1.00 17.67 H new ATOM 0 HA ILE A 48 -5.562 26.934 -10.171 1.00 19.75 H new ATOM 0 HB ILE A 48 -4.054 27.689 -7.908 1.00 18.52 H new ATOM 0 HG12 ILE A 48 -6.844 27.004 -8.202 1.00 20.63 H new ATOM 0 HG13 ILE A 48 -5.800 26.014 -7.599 1.00 20.63 H new ATOM 0 HG21 ILE A 48 -5.459 29.620 -7.742 1.00 19.64 H new ATOM 0 HG22 ILE A 48 -4.649 29.688 -9.101 1.00 19.64 H new ATOM 0 HG23 ILE A 48 -6.165 29.229 -9.104 1.00 19.64 H new ATOM 0 HD11 ILE A 48 -6.956 27.123 -5.795 1.00 21.41 H new ATOM 0 HD12 ILE A 48 -5.425 27.524 -5.740 1.00 21.41 H new ATOM 0 HD13 ILE A 48 -6.485 28.529 -6.352 1.00 21.41 H new ATOM 392 N ALA A 49 -2.503 27.764 -10.750 1.00 18.13 N ATOM 393 CA ALA A 49 -1.735 28.526 -11.821 1.00 17.50 C ATOM 394 C ALA A 49 -2.206 28.066 -13.211 1.00 17.59 C ATOM 395 O ALA A 49 -2.202 28.898 -14.098 1.00 18.71 O ATOM 396 CB ALA A 49 -0.170 28.161 -11.687 1.00 17.75 C ATOM 0 H ALA A 49 -2.048 27.289 -10.196 1.00 18.13 H new ATOM 0 HA ALA A 49 -1.883 29.478 -11.712 1.00 17.50 H new ATOM 0 HB1 ALA A 49 0.333 28.640 -12.364 1.00 17.75 H new ATOM 0 HB2 ALA A 49 0.148 28.417 -10.807 1.00 17.75 H new ATOM 0 HB3 ALA A 49 -0.049 27.206 -11.809 1.00 17.75 H new ATOM 397 N TYR A 50 -2.537 26.775 -13.422 1.00 18.21 N ATOM 398 CA TYR A 50 -2.996 26.361 -14.718 1.00 20.05 C ATOM 399 C TYR A 50 -4.352 27.022 -15.059 1.00 18.91 C ATOM 400 O TYR A 50 -4.599 27.391 -16.194 1.00 16.63 O ATOM 401 CB TYR A 50 -3.074 24.819 -14.858 1.00 21.22 C ATOM 402 CG TYR A 50 -3.679 24.373 -16.208 1.00 23.44 C ATOM 403 CD1 TYR A 50 -2.987 24.511 -17.448 1.00 26.48 C ATOM 404 CD2 TYR A 50 -4.952 23.852 -16.250 1.00 20.12 C ATOM 405 CE1 TYR A 50 -3.587 24.124 -18.682 1.00 26.82 C ATOM 406 CE2 TYR A 50 -5.543 23.484 -17.476 1.00 20.16 C ATOM 407 CZ TYR A 50 -4.865 23.602 -18.635 1.00 25.39 C ATOM 408 OH TYR A 50 -5.514 23.235 -19.783 1.00 28.96 O ATOM 0 H TYR A 50 -2.497 26.153 -12.830 1.00 18.21 H new ATOM 0 HA TYR A 50 -2.336 26.664 -15.361 1.00 20.05 H new ATOM 0 HB2 TYR A 50 -2.184 24.444 -14.767 1.00 21.22 H new ATOM 0 HB3 TYR A 50 -3.609 24.459 -14.133 1.00 21.22 H new ATOM 0 HD1 TYR A 50 -2.125 24.861 -17.451 1.00 26.48 H new ATOM 0 HD2 TYR A 50 -5.429 23.741 -15.459 1.00 20.12 H new ATOM 0 HE1 TYR A 50 -3.135 24.219 -19.489 1.00 26.82 H new ATOM 0 HE2 TYR A 50 -6.413 23.155 -17.485 1.00 20.16 H new ATOM 0 HH TYR A 50 -4.952 22.988 -20.356 1.00 28.96 H new ATOM 409 N ALA A 51 -5.246 27.123 -14.086 1.00 18.29 N ATOM 410 CA ALA A 51 -6.521 27.839 -14.268 1.00 16.73 C ATOM 411 C ALA A 51 -6.258 29.223 -14.699 1.00 17.23 C ATOM 412 O ALA A 51 -6.967 29.718 -15.531 1.00 16.91 O ATOM 413 CB ALA A 51 -7.326 27.836 -12.891 1.00 16.79 C ATOM 0 H ALA A 51 -5.140 26.784 -13.303 1.00 18.29 H new ATOM 0 HA ALA A 51 -7.050 27.396 -14.949 1.00 16.73 H new ATOM 0 HB1 ALA A 51 -8.166 28.307 -13.006 1.00 16.79 H new ATOM 0 HB2 ALA A 51 -7.502 26.921 -12.621 1.00 16.79 H new ATOM 0 HB3 ALA A 51 -6.799 28.279 -12.207 1.00 16.79 H new ATOM 414 N GLU A 52 -5.253 29.885 -14.144 1.00 15.41 N ATOM 415 CA GLU A 52 -5.007 31.267 -14.599 1.00 16.52 C ATOM 416 C GLU A 52 -4.417 31.341 -15.986 1.00 16.74 C ATOM 417 O GLU A 52 -4.605 32.342 -16.641 1.00 18.01 O ATOM 418 CB GLU A 52 -4.023 32.001 -13.661 1.00 16.38 C ATOM 419 CG GLU A 52 -4.290 31.874 -12.108 1.00 15.72 C ATOM 420 CD GLU A 52 -5.751 32.309 -11.657 1.00 20.54 C ATOM 421 OE1 GLU A 52 -5.958 32.353 -10.417 1.00 18.53 O ATOM 422 OE2 GLU A 52 -6.637 32.647 -12.539 1.00 17.54 O ATOM 0 H GLU A 52 -4.724 29.584 -13.537 1.00 15.41 H new ATOM 0 HA GLU A 52 -5.882 31.686 -14.595 1.00 16.52 H new ATOM 0 HB2 GLU A 52 -3.129 31.671 -13.842 1.00 16.38 H new ATOM 0 HB3 GLU A 52 -4.030 32.943 -13.893 1.00 16.38 H new ATOM 0 HG2 GLU A 52 -4.140 30.954 -11.839 1.00 15.72 H new ATOM 0 HG3 GLU A 52 -3.641 32.417 -11.634 1.00 15.72 H new ATOM 423 N PHE A 53 -3.632 30.334 -16.358 1.00 16.52 N ATOM 424 CA PHE A 53 -3.235 30.170 -17.799 1.00 16.60 C ATOM 425 C PHE A 53 -4.484 30.114 -18.706 1.00 18.77 C ATOM 426 O PHE A 53 -4.533 30.737 -19.752 1.00 15.51 O ATOM 427 CB PHE A 53 -2.375 28.915 -17.987 1.00 16.79 C ATOM 428 CG PHE A 53 -2.301 28.425 -19.452 1.00 18.44 C ATOM 429 CD1 PHE A 53 -1.372 29.015 -20.340 1.00 17.67 C ATOM 430 CD2 PHE A 53 -3.156 27.381 -19.893 1.00 17.92 C ATOM 431 CE1 PHE A 53 -1.329 28.573 -21.636 1.00 18.53 C ATOM 432 CE2 PHE A 53 -3.127 26.946 -21.166 1.00 19.63 C ATOM 433 CZ PHE A 53 -2.227 27.549 -22.059 1.00 17.43 C ATOM 0 H PHE A 53 -3.315 29.739 -15.824 1.00 16.52 H new ATOM 0 HA PHE A 53 -2.706 30.941 -18.056 1.00 16.60 H new ATOM 0 HB2 PHE A 53 -1.477 29.098 -17.670 1.00 16.79 H new ATOM 0 HB3 PHE A 53 -2.732 28.203 -17.434 1.00 16.79 H new ATOM 0 HD1 PHE A 53 -0.801 29.690 -20.050 1.00 17.67 H new ATOM 0 HD2 PHE A 53 -3.747 26.990 -19.291 1.00 17.92 H new ATOM 0 HE1 PHE A 53 -0.719 28.938 -22.235 1.00 18.53 H new ATOM 0 HE2 PHE A 53 -3.690 26.262 -21.448 1.00 19.63 H new ATOM 0 HZ PHE A 53 -2.216 27.274 -22.947 1.00 17.43 H new ATOM 434 N VAL A 54 -5.504 29.335 -18.302 1.00 16.77 N ATOM 435 CA VAL A 54 -6.677 29.293 -19.074 1.00 15.29 C ATOM 436 C VAL A 54 -7.345 30.679 -19.191 1.00 15.32 C ATOM 437 O VAL A 54 -7.779 31.079 -20.310 1.00 15.61 O ATOM 438 CB VAL A 54 -7.656 28.219 -18.488 1.00 16.49 C ATOM 439 CG1 VAL A 54 -8.939 28.214 -19.331 1.00 19.86 C ATOM 440 CG2 VAL A 54 -6.996 26.783 -18.583 1.00 17.79 C ATOM 0 H VAL A 54 -5.506 28.846 -17.595 1.00 16.77 H new ATOM 0 HA VAL A 54 -6.439 29.034 -19.978 1.00 15.29 H new ATOM 0 HB VAL A 54 -7.850 28.431 -17.562 1.00 16.49 H new ATOM 0 HG11 VAL A 54 -9.555 27.553 -18.979 1.00 19.86 H new ATOM 0 HG12 VAL A 54 -9.352 29.091 -19.297 1.00 19.86 H new ATOM 0 HG13 VAL A 54 -8.721 27.995 -20.251 1.00 19.86 H new ATOM 0 HG21 VAL A 54 -7.605 26.122 -18.219 1.00 17.79 H new ATOM 0 HG22 VAL A 54 -6.809 26.573 -19.511 1.00 17.79 H new ATOM 0 HG23 VAL A 54 -6.169 26.773 -18.077 1.00 17.79 H new ATOM 441 N HIS A 55 -7.436 31.401 -18.083 1.00 13.85 N ATOM 442 CA HIS A 55 -8.126 32.665 -18.149 1.00 13.79 C ATOM 443 C HIS A 55 -7.326 33.631 -19.008 1.00 16.26 C ATOM 444 O HIS A 55 -7.879 34.372 -19.764 1.00 14.79 O ATOM 445 CB HIS A 55 -8.161 33.242 -16.725 1.00 14.19 C ATOM 446 CG HIS A 55 -8.963 32.416 -15.725 1.00 15.29 C ATOM 447 ND1 HIS A 55 -8.875 32.653 -14.345 1.00 18.15 N ATOM 448 CD2 HIS A 55 -9.961 31.482 -15.925 1.00 19.49 C ATOM 449 CE1 HIS A 55 -9.720 31.817 -13.741 1.00 16.67 C ATOM 450 NE2 HIS A 55 -10.354 31.061 -14.662 1.00 19.75 N ATOM 0 H HIS A 55 -7.117 31.184 -17.314 1.00 13.85 H new ATOM 0 HA HIS A 55 -9.015 32.544 -18.518 1.00 13.79 H new ATOM 0 HB2 HIS A 55 -7.251 33.327 -16.400 1.00 14.19 H new ATOM 0 HB3 HIS A 55 -8.534 34.137 -16.760 1.00 14.19 H new ATOM 0 HD2 HIS A 55 -10.301 31.193 -16.741 1.00 19.49 H new ATOM 0 HE1 HIS A 55 -9.853 31.763 -12.822 1.00 16.67 H new ATOM 0 HE2 HIS A 55 -10.908 30.425 -14.494 1.00 19.75 H new ATOM 451 N ALA A 56 -5.998 33.648 -18.820 1.00 15.76 N ATOM 452 CA ALA A 56 -5.178 34.550 -19.650 1.00 16.42 C ATOM 453 C ALA A 56 -5.245 34.215 -21.132 1.00 15.90 C ATOM 454 O ALA A 56 -5.358 35.147 -21.925 1.00 16.08 O ATOM 455 CB ALA A 56 -3.656 34.476 -19.159 1.00 15.94 C ATOM 0 H ALA A 56 -5.568 33.171 -18.247 1.00 15.76 H new ATOM 0 HA ALA A 56 -5.535 35.445 -19.543 1.00 16.42 H new ATOM 0 HB1 ALA A 56 -3.112 35.068 -19.702 1.00 15.94 H new ATOM 0 HB2 ALA A 56 -3.602 34.749 -18.230 1.00 15.94 H new ATOM 0 HB3 ALA A 56 -3.331 33.566 -19.248 1.00 15.94 H new ATOM 456 N LYS A 57 -5.190 32.924 -21.471 1.00 16.45 N ATOM 457 CA LYS A 57 -5.260 32.509 -22.846 1.00 16.24 C ATOM 458 C LYS A 57 -6.626 32.969 -23.434 1.00 17.77 C ATOM 459 O LYS A 57 -6.669 33.477 -24.560 1.00 16.24 O ATOM 460 CB LYS A 57 -5.160 30.988 -22.913 1.00 17.05 C ATOM 461 CG LYS A 57 -5.358 30.517 -24.328 1.00 21.60 C ATOM 462 CD LYS A 57 -5.019 29.030 -24.397 1.00 24.87 C ATOM 463 CE LYS A 57 -6.075 28.168 -23.809 1.00 30.20 C ATOM 464 NZ LYS A 57 -5.999 26.806 -24.553 1.00 35.69 N ATOM 0 H LYS A 57 -5.112 32.280 -20.907 1.00 16.45 H new ATOM 0 HA LYS A 57 -4.534 32.902 -23.355 1.00 16.24 H new ATOM 0 HB2 LYS A 57 -4.293 30.699 -22.587 1.00 17.05 H new ATOM 0 HB3 LYS A 57 -5.828 30.587 -22.335 1.00 17.05 H new ATOM 0 HG2 LYS A 57 -6.275 30.667 -24.608 1.00 21.60 H new ATOM 0 HG3 LYS A 57 -4.791 31.020 -24.933 1.00 21.60 H new ATOM 0 HD2 LYS A 57 -4.880 28.777 -25.323 1.00 24.87 H new ATOM 0 HD3 LYS A 57 -4.183 28.872 -23.932 1.00 24.87 H new ATOM 0 HE2 LYS A 57 -5.933 28.049 -22.857 1.00 30.20 H new ATOM 0 HE3 LYS A 57 -6.950 28.572 -23.917 1.00 30.20 H new ATOM 0 HZ1 LYS A 57 -6.302 26.160 -24.021 1.00 35.69 H new ATOM 0 HZ2 LYS A 57 -6.498 26.842 -25.289 1.00 35.69 H new ATOM 0 HZ3 LYS A 57 -5.154 26.636 -24.775 1.00 35.69 H new ATOM 465 N ASN A 58 -7.715 32.766 -22.702 1.00 17.39 N ATOM 466 CA ASN A 58 -9.016 33.274 -23.200 1.00 17.89 C ATOM 467 C ASN A 58 -9.034 34.773 -23.498 1.00 17.86 C ATOM 468 O ASN A 58 -9.550 35.149 -24.560 1.00 16.06 O ATOM 469 CB ASN A 58 -10.189 33.001 -22.214 1.00 16.50 C ATOM 470 CG ASN A 58 -10.475 31.514 -22.091 1.00 23.14 C ATOM 471 OD1 ASN A 58 -10.139 30.734 -22.948 1.00 22.44 O ATOM 472 ND2 ASN A 58 -10.991 31.114 -20.951 1.00 22.98 N ATOM 0 H ASN A 58 -7.738 32.357 -21.946 1.00 17.39 H new ATOM 0 HA ASN A 58 -9.136 32.780 -24.026 1.00 17.89 H new ATOM 0 HB2 ASN A 58 -9.971 33.363 -21.341 1.00 16.50 H new ATOM 0 HB3 ASN A 58 -10.986 33.461 -22.521 1.00 16.50 H new ATOM 0 HD21 ASN A 58 -11.098 30.274 -20.798 1.00 22.98 H new ATOM 0 HD22 ASN A 58 -11.222 31.692 -20.357 1.00 22.98 H new ATOM 473 N HIS A 59 -8.530 35.604 -22.574 1.00 16.32 N ATOM 474 CA HIS A 59 -8.496 37.094 -22.823 1.00 17.99 C ATOM 475 C HIS A 59 -7.607 37.362 -24.066 1.00 17.46 C ATOM 476 O HIS A 59 -7.912 38.196 -24.889 1.00 17.68 O ATOM 477 CB HIS A 59 -7.821 37.799 -21.632 1.00 17.18 C ATOM 478 CG HIS A 59 -8.577 37.669 -20.353 1.00 14.63 C ATOM 479 ND1 HIS A 59 -9.959 37.556 -20.310 1.00 17.62 N ATOM 480 CD2 HIS A 59 -8.144 37.660 -19.078 1.00 17.91 C ATOM 481 CE1 HIS A 59 -10.338 37.469 -19.031 1.00 17.92 C ATOM 482 NE2 HIS A 59 -9.257 37.495 -18.261 1.00 17.85 N ATOM 0 H HIS A 59 -8.209 35.355 -21.816 1.00 16.32 H new ATOM 0 HA HIS A 59 -9.401 37.419 -22.948 1.00 17.99 H new ATOM 0 HB2 HIS A 59 -6.931 37.433 -21.511 1.00 17.18 H new ATOM 0 HB3 HIS A 59 -7.714 38.740 -21.841 1.00 17.18 H new ATOM 0 HD2 HIS A 59 -7.262 37.748 -18.796 1.00 17.91 H new ATOM 0 HE1 HIS A 59 -11.215 37.401 -18.730 1.00 17.92 H new ATOM 0 HE2 HIS A 59 -9.247 37.422 -17.404 1.00 17.85 H new ATOM 483 N PHE A 60 -6.470 36.653 -24.161 1.00 17.54 N ATOM 484 CA PHE A 60 -5.467 36.839 -25.247 1.00 16.89 C ATOM 485 C PHE A 60 -6.031 36.500 -26.624 1.00 16.20 C ATOM 486 O PHE A 60 -5.914 37.305 -27.528 1.00 17.01 O ATOM 487 CB PHE A 60 -4.299 35.871 -25.032 1.00 15.80 C ATOM 488 CG PHE A 60 -3.047 36.188 -25.850 1.00 18.51 C ATOM 489 CD1 PHE A 60 -2.666 35.323 -26.899 1.00 20.37 C ATOM 490 CD2 PHE A 60 -2.221 37.241 -25.498 1.00 18.54 C ATOM 491 CE1 PHE A 60 -1.478 35.542 -27.644 1.00 23.11 C ATOM 492 CE2 PHE A 60 -1.006 37.497 -26.246 1.00 23.69 C ATOM 493 CZ PHE A 60 -0.672 36.579 -27.310 1.00 20.85 C ATOM 0 H PHE A 60 -6.251 36.044 -23.595 1.00 17.54 H new ATOM 0 HA PHE A 60 -5.200 37.771 -25.216 1.00 16.89 H new ATOM 0 HB2 PHE A 60 -4.064 35.871 -24.091 1.00 15.80 H new ATOM 0 HB3 PHE A 60 -4.595 34.973 -25.251 1.00 15.80 H new ATOM 0 HD1 PHE A 60 -3.205 34.594 -27.106 1.00 20.37 H new ATOM 0 HD2 PHE A 60 -2.446 37.786 -24.779 1.00 18.54 H new ATOM 0 HE1 PHE A 60 -1.256 34.981 -28.352 1.00 23.11 H new ATOM 0 HE2 PHE A 60 -0.462 38.225 -26.048 1.00 23.69 H new ATOM 0 HZ PHE A 60 0.121 36.703 -27.780 1.00 20.85 H new ATOM 494 N ILE A 61 -6.774 35.413 -26.705 1.00 17.35 N ATOM 495 CA ILE A 61 -7.529 35.073 -27.919 1.00 18.96 C ATOM 496 C ILE A 61 -8.673 36.086 -28.191 1.00 19.80 C ATOM 497 O ILE A 61 -8.939 36.480 -29.368 1.00 18.46 O ATOM 498 CB ILE A 61 -8.094 33.621 -27.827 1.00 19.77 C ATOM 499 CG1 ILE A 61 -6.812 32.713 -27.909 1.00 20.93 C ATOM 500 CG2 ILE A 61 -9.098 33.364 -28.979 1.00 21.71 C ATOM 501 CD1 ILE A 61 -7.109 31.271 -27.697 1.00 25.99 C ATOM 0 H ILE A 61 -6.862 34.846 -26.065 1.00 17.35 H new ATOM 0 HA ILE A 61 -6.913 35.122 -28.666 1.00 18.96 H new ATOM 0 HB ILE A 61 -8.596 33.443 -27.016 1.00 19.77 H new ATOM 0 HG12 ILE A 61 -6.395 32.828 -28.777 1.00 20.93 H new ATOM 0 HG13 ILE A 61 -6.170 33.007 -27.244 1.00 20.93 H new ATOM 0 HG21 ILE A 61 -9.443 32.460 -28.912 1.00 21.71 H new ATOM 0 HG22 ILE A 61 -9.832 33.995 -28.916 1.00 21.71 H new ATOM 0 HG23 ILE A 61 -8.649 33.476 -29.831 1.00 21.71 H new ATOM 0 HD11 ILE A 61 -6.287 30.759 -27.758 1.00 25.99 H new ATOM 0 HD12 ILE A 61 -7.503 31.147 -26.819 1.00 25.99 H new ATOM 0 HD13 ILE A 61 -7.731 30.965 -28.376 1.00 25.99 H new ATOM 502 N ALA A 62 -9.356 36.526 -27.148 1.00 18.24 N ATOM 503 CA ALA A 62 -10.431 37.512 -27.367 1.00 19.81 C ATOM 504 C ALA A 62 -9.904 38.850 -27.932 1.00 20.83 C ATOM 505 O ALA A 62 -10.620 39.536 -28.667 1.00 21.49 O ATOM 506 CB ALA A 62 -11.171 37.748 -26.046 1.00 20.24 C ATOM 0 H ALA A 62 -9.230 36.286 -26.332 1.00 18.24 H new ATOM 0 HA ALA A 62 -11.037 37.149 -28.032 1.00 19.81 H new ATOM 0 HB1 ALA A 62 -11.880 38.396 -26.183 1.00 20.24 H new ATOM 0 HB2 ALA A 62 -11.553 36.912 -25.735 1.00 20.24 H new ATOM 0 HB3 ALA A 62 -10.549 38.085 -25.382 1.00 20.24 H new ATOM 507 N LEU A 63 -8.657 39.193 -27.581 1.00 19.44 N ATOM 508 CA LEU A 63 -7.995 40.362 -28.129 1.00 19.09 C ATOM 509 C LEU A 63 -7.468 40.124 -29.528 1.00 21.51 C ATOM 510 O LEU A 63 -6.989 41.078 -30.104 1.00 21.31 O ATOM 511 CB LEU A 63 -6.817 40.773 -27.263 1.00 19.71 C ATOM 512 CG LEU A 63 -7.242 41.339 -25.824 1.00 19.72 C ATOM 513 CD1 LEU A 63 -6.081 41.206 -24.792 1.00 19.76 C ATOM 514 CD2 LEU A 63 -7.623 42.797 -25.982 1.00 22.23 C ATOM 0 H LEU A 63 -8.180 38.749 -27.019 1.00 19.44 H new ATOM 0 HA LEU A 63 -8.668 41.060 -28.153 1.00 19.09 H new ATOM 0 HB2 LEU A 63 -6.233 40.008 -27.141 1.00 19.71 H new ATOM 0 HB3 LEU A 63 -6.304 41.451 -27.730 1.00 19.71 H new ATOM 0 HG LEU A 63 -7.991 40.822 -25.489 1.00 19.72 H new ATOM 0 HD11 LEU A 63 -6.369 41.556 -23.934 1.00 19.76 H new ATOM 0 HD12 LEU A 63 -5.840 40.272 -24.695 1.00 19.76 H new ATOM 0 HD13 LEU A 63 -5.312 41.708 -25.104 1.00 19.76 H new ATOM 0 HD21 LEU A 63 -7.884 43.159 -25.121 1.00 22.23 H new ATOM 0 HD22 LEU A 63 -6.864 43.295 -26.325 1.00 22.23 H new ATOM 0 HD23 LEU A 63 -8.365 42.872 -26.602 1.00 22.23 H new ATOM 515 N GLY A 64 -7.514 38.899 -30.025 1.00 22.26 N ATOM 516 CA GLY A 64 -7.057 38.599 -31.399 1.00 23.68 C ATOM 517 C GLY A 64 -5.550 38.473 -31.503 1.00 25.89 C ATOM 518 O GLY A 64 -5.014 38.512 -32.613 1.00 25.96 O ATOM 0 H GLY A 64 -7.805 38.216 -29.591 1.00 22.26 H new ATOM 0 HA2 GLY A 64 -7.468 37.773 -31.699 1.00 23.68 H new ATOM 0 HA3 GLY A 64 -7.361 39.300 -31.997 1.00 23.68 H new ATOM 519 N LYS A 65 -4.842 38.242 -30.394 1.00 23.38 N ATOM 520 CA LYS A 65 -3.366 38.255 -30.413 1.00 23.70 C ATOM 521 C LYS A 65 -2.731 36.877 -30.696 1.00 23.15 C ATOM 522 O LYS A 65 -1.501 36.755 -30.804 1.00 25.34 O ATOM 523 CB LYS A 65 -2.883 38.774 -29.089 1.00 23.73 C ATOM 524 CG LYS A 65 -3.306 40.246 -29.012 1.00 29.28 C ATOM 525 CD LYS A 65 -2.501 40.970 -28.024 1.00 41.45 C ATOM 526 CE LYS A 65 -2.374 42.472 -28.402 1.00 45.47 C ATOM 527 NZ LYS A 65 -1.497 43.128 -27.345 1.00 47.55 N ATOM 0 H LYS A 65 -5.189 38.077 -29.625 1.00 23.38 H new ATOM 0 HA LYS A 65 -3.091 38.828 -31.146 1.00 23.70 H new ATOM 0 HB2 LYS A 65 -3.269 38.266 -28.358 1.00 23.73 H new ATOM 0 HB3 LYS A 65 -1.920 38.688 -29.016 1.00 23.73 H new ATOM 0 HG2 LYS A 65 -3.206 40.661 -29.883 1.00 29.28 H new ATOM 0 HG3 LYS A 65 -4.245 40.305 -28.776 1.00 29.28 H new ATOM 0 HD2 LYS A 65 -2.907 40.887 -27.147 1.00 41.45 H new ATOM 0 HD3 LYS A 65 -1.618 40.572 -27.966 1.00 41.45 H new ATOM 0 HE2 LYS A 65 -1.981 42.571 -29.283 1.00 45.47 H new ATOM 0 HE3 LYS A 65 -3.247 42.893 -28.432 1.00 45.47 H new ATOM 0 HZ1 LYS A 65 -1.798 43.949 -27.177 1.00 47.55 H new ATOM 0 HZ2 LYS A 65 -1.521 42.645 -26.598 1.00 47.55 H new ATOM 0 HZ3 LYS A 65 -0.659 43.174 -27.641 1.00 47.55 H new ATOM 528 N LEU A 66 -3.508 35.807 -30.794 1.00 21.36 N ATOM 529 CA LEU A 66 -2.895 34.531 -31.082 1.00 20.96 C ATOM 530 C LEU A 66 -3.040 34.253 -32.606 1.00 23.24 C ATOM 531 O LEU A 66 -4.122 34.480 -33.186 1.00 23.55 O ATOM 532 CB LEU A 66 -3.571 33.397 -30.258 1.00 21.63 C ATOM 533 CG LEU A 66 -3.035 31.964 -30.505 1.00 22.09 C ATOM 534 CD1 LEU A 66 -1.587 31.846 -30.082 1.00 21.14 C ATOM 535 CD2 LEU A 66 -3.926 30.905 -29.663 1.00 19.60 C ATOM 0 H LEU A 66 -4.363 35.800 -30.700 1.00 21.36 H new ATOM 0 HA LEU A 66 -1.957 34.555 -30.835 1.00 20.96 H new ATOM 0 HB2 LEU A 66 -3.470 33.603 -29.315 1.00 21.63 H new ATOM 0 HB3 LEU A 66 -4.522 33.405 -30.450 1.00 21.63 H new ATOM 0 HG LEU A 66 -3.095 31.773 -31.454 1.00 22.09 H new ATOM 0 HD11 LEU A 66 -1.274 30.942 -30.246 1.00 21.14 H new ATOM 0 HD12 LEU A 66 -1.049 32.471 -30.592 1.00 21.14 H new ATOM 0 HD13 LEU A 66 -1.508 32.048 -29.137 1.00 21.14 H new ATOM 0 HD21 LEU A 66 -3.592 30.007 -29.816 1.00 19.60 H new ATOM 0 HD22 LEU A 66 -3.869 31.114 -28.717 1.00 19.60 H new ATOM 0 HD23 LEU A 66 -4.851 30.959 -29.951 1.00 19.60 H new ATOM 536 N GLY A 67 -1.936 33.861 -33.255 1.00 22.94 N ATOM 537 CA GLY A 67 -1.989 33.582 -34.739 1.00 23.81 C ATOM 538 C GLY A 67 -1.334 32.232 -34.905 1.00 23.31 C ATOM 539 O GLY A 67 -1.261 31.391 -33.976 1.00 22.03 O ATOM 0 H GLY A 67 -1.166 33.748 -32.889 1.00 22.94 H new ATOM 0 HA2 GLY A 67 -2.904 33.571 -35.062 1.00 23.81 H new ATOM 0 HA3 GLY A 67 -1.519 34.265 -35.242 1.00 23.81 H new ATOM 540 N LYS A 68 -0.806 31.997 -36.123 1.00 23.81 N ATOM 541 CA LYS A 68 -0.053 30.776 -36.401 1.00 24.19 C ATOM 542 C LYS A 68 1.398 30.921 -35.907 1.00 24.29 C ATOM 543 O LYS A 68 1.864 32.025 -35.553 1.00 25.44 O ATOM 544 CB LYS A 68 -0.063 30.562 -37.934 1.00 24.65 C ATOM 545 CG LYS A 68 -1.471 30.574 -38.484 1.00 28.12 C ATOM 546 CD LYS A 68 -1.308 30.423 -39.986 1.00 36.07 C ATOM 547 CE LYS A 68 -2.532 30.951 -40.710 1.00 41.77 C ATOM 548 NZ LYS A 68 -2.494 30.357 -42.123 1.00 41.79 N ATOM 0 H LYS A 68 -0.877 32.534 -36.791 1.00 23.81 H new ATOM 0 HA LYS A 68 -0.454 30.021 -35.944 1.00 24.19 H new ATOM 0 HB2 LYS A 68 0.459 31.258 -38.363 1.00 24.65 H new ATOM 0 HB3 LYS A 68 0.362 29.716 -38.147 1.00 24.65 H new ATOM 0 HG2 LYS A 68 -1.999 29.849 -38.113 1.00 28.12 H new ATOM 0 HG3 LYS A 68 -1.928 31.400 -38.262 1.00 28.12 H new ATOM 0 HD2 LYS A 68 -0.519 30.904 -40.281 1.00 36.07 H new ATOM 0 HD3 LYS A 68 -1.171 29.489 -40.210 1.00 36.07 H new ATOM 0 HE2 LYS A 68 -3.345 30.691 -40.248 1.00 41.77 H new ATOM 0 HE3 LYS A 68 -2.522 31.920 -40.743 1.00 41.77 H new ATOM 0 HZ1 LYS A 68 -3.323 30.286 -42.438 1.00 41.79 H new ATOM 0 HZ2 LYS A 68 -2.019 30.889 -42.656 1.00 41.79 H new ATOM 0 HZ3 LYS A 68 -2.117 29.551 -42.096 1.00 41.79 H new ATOM 549 N THR A 69 2.101 29.804 -35.865 1.00 24.54 N ATOM 550 CA THR A 69 3.408 29.745 -35.253 1.00 25.02 C ATOM 551 C THR A 69 4.374 30.780 -35.809 1.00 25.01 C ATOM 552 O THR A 69 5.103 31.420 -35.001 1.00 22.91 O ATOM 553 CB THR A 69 3.945 28.307 -35.275 1.00 25.31 C ATOM 554 OG1 THR A 69 3.079 27.510 -34.440 1.00 24.81 O ATOM 555 CG2 THR A 69 5.346 28.232 -34.707 1.00 25.35 C ATOM 0 H THR A 69 1.830 29.056 -36.193 1.00 24.54 H new ATOM 0 HA THR A 69 3.315 29.995 -34.320 1.00 25.02 H new ATOM 0 HB THR A 69 3.968 27.990 -36.191 1.00 25.31 H new ATOM 0 HG1 THR A 69 2.418 27.251 -34.888 1.00 24.81 H new ATOM 0 HG21 THR A 69 5.658 27.314 -34.734 1.00 25.35 H new ATOM 0 HG22 THR A 69 5.939 28.790 -35.234 1.00 25.35 H new ATOM 0 HG23 THR A 69 5.340 28.544 -33.789 1.00 25.35 H new ATOM 556 N PRO A 70 4.443 30.960 -37.171 1.00 26.09 N ATOM 557 CA PRO A 70 5.386 32.043 -37.599 1.00 26.88 C ATOM 558 C PRO A 70 5.058 33.427 -37.040 1.00 25.53 C ATOM 559 O PRO A 70 5.985 34.126 -36.620 1.00 26.65 O ATOM 560 CB PRO A 70 5.298 32.042 -39.167 1.00 26.99 C ATOM 561 CG PRO A 70 4.720 30.609 -39.473 1.00 28.37 C ATOM 562 CD PRO A 70 3.744 30.335 -38.320 1.00 27.03 C ATOM 0 HA PRO A 70 6.275 31.863 -37.256 1.00 26.88 H new ATOM 0 HB2 PRO A 70 4.716 32.744 -39.497 1.00 26.99 H new ATOM 0 HB3 PRO A 70 6.166 32.177 -39.578 1.00 26.99 H new ATOM 0 HG2 PRO A 70 4.268 30.586 -40.331 1.00 28.37 H new ATOM 0 HG3 PRO A 70 5.425 29.943 -39.505 1.00 28.37 H new ATOM 0 HD2 PRO A 70 2.874 30.735 -38.477 1.00 27.03 H new ATOM 0 HD3 PRO A 70 3.599 29.385 -38.184 1.00 27.03 H new ATOM 563 N GLU A 71 3.787 33.836 -37.000 1.00 25.06 N ATOM 564 CA GLU A 71 3.432 35.128 -36.444 1.00 24.88 C ATOM 565 C GLU A 71 3.673 35.174 -34.911 1.00 24.08 C ATOM 566 O GLU A 71 3.983 36.241 -34.377 1.00 23.92 O ATOM 567 CB GLU A 71 1.951 35.498 -36.655 1.00 28.83 C ATOM 568 CG GLU A 71 1.554 35.739 -38.119 1.00 38.04 C ATOM 569 CD GLU A 71 1.840 34.550 -39.086 1.00 52.10 C ATOM 570 OE1 GLU A 71 1.693 33.328 -38.736 1.00 54.98 O ATOM 571 OE2 GLU A 71 2.245 34.859 -40.237 1.00 57.40 O ATOM 0 H GLU A 71 3.121 33.376 -37.291 1.00 25.06 H new ATOM 0 HA GLU A 71 4.000 35.756 -36.917 1.00 24.88 H new ATOM 0 HB2 GLU A 71 1.398 34.787 -36.295 1.00 28.83 H new ATOM 0 HB3 GLU A 71 1.754 36.298 -36.143 1.00 28.83 H new ATOM 0 HG2 GLU A 71 0.607 35.945 -38.153 1.00 38.04 H new ATOM 0 HG3 GLU A 71 2.026 36.522 -38.443 1.00 38.04 H new ATOM 572 N ASN A 72 3.451 34.076 -34.235 1.00 21.81 N ATOM 573 CA ASN A 72 3.667 34.069 -32.746 1.00 20.51 C ATOM 574 C ASN A 72 5.174 34.219 -32.514 1.00 20.72 C ATOM 575 O ASN A 72 5.611 34.964 -31.633 1.00 21.31 O ATOM 576 CB ASN A 72 3.173 32.734 -32.246 1.00 21.30 C ATOM 577 CG ASN A 72 1.661 32.564 -32.397 1.00 17.31 C ATOM 578 OD1 ASN A 72 0.919 33.539 -32.500 1.00 21.24 O ATOM 579 ND2 ASN A 72 1.211 31.324 -32.377 1.00 21.72 N ATOM 0 H ASN A 72 3.184 33.332 -34.574 1.00 21.81 H new ATOM 0 HA ASN A 72 3.200 34.782 -32.284 1.00 20.51 H new ATOM 0 HB2 ASN A 72 3.624 32.025 -32.731 1.00 21.30 H new ATOM 0 HB3 ASN A 72 3.413 32.635 -31.311 1.00 21.30 H new ATOM 0 HD21 ASN A 72 0.367 31.172 -32.437 1.00 21.72 H new ATOM 0 HD22 ASN A 72 1.762 30.668 -32.304 1.00 21.72 H new ATOM 580 N LEU A 73 6.010 33.514 -33.336 1.00 20.76 N ATOM 581 CA LEU A 73 7.480 33.684 -33.193 1.00 23.65 C ATOM 582 C LEU A 73 7.886 35.123 -33.402 1.00 22.51 C ATOM 583 O LEU A 73 8.777 35.654 -32.705 1.00 25.32 O ATOM 584 CB LEU A 73 8.225 32.768 -34.200 1.00 21.38 C ATOM 585 CG LEU A 73 8.237 31.308 -33.772 1.00 21.41 C ATOM 586 CD1 LEU A 73 8.556 30.336 -34.990 1.00 26.99 C ATOM 587 CD2 LEU A 73 9.201 31.074 -32.576 1.00 24.84 C ATOM 0 H LEU A 73 5.757 32.964 -33.947 1.00 20.76 H new ATOM 0 HA LEU A 73 7.725 33.430 -32.290 1.00 23.65 H new ATOM 0 HB2 LEU A 73 7.804 32.842 -35.071 1.00 21.38 H new ATOM 0 HB3 LEU A 73 9.138 33.079 -34.299 1.00 21.38 H new ATOM 0 HG LEU A 73 7.342 31.090 -33.467 1.00 21.41 H new ATOM 0 HD11 LEU A 73 8.555 29.417 -34.680 1.00 26.99 H new ATOM 0 HD12 LEU A 73 7.880 30.445 -35.677 1.00 26.99 H new ATOM 0 HD13 LEU A 73 9.428 30.552 -35.357 1.00 26.99 H new ATOM 0 HD21 LEU A 73 9.187 30.137 -32.327 1.00 24.84 H new ATOM 0 HD22 LEU A 73 10.102 31.326 -32.832 1.00 24.84 H new ATOM 0 HD23 LEU A 73 8.917 31.613 -31.821 1.00 24.84 H new ATOM 588 N GLN A 74 7.259 35.786 -34.364 1.00 22.36 N ATOM 589 CA GLN A 74 7.529 37.207 -34.628 1.00 25.17 C ATOM 590 C GLN A 74 7.190 38.146 -33.436 1.00 24.01 C ATOM 591 O GLN A 74 7.928 39.081 -33.121 1.00 22.05 O ATOM 592 CB GLN A 74 6.839 37.724 -35.913 1.00 25.22 C ATOM 593 CG GLN A 74 7.128 39.282 -36.257 1.00 27.04 C ATOM 594 CD GLN A 74 8.648 39.477 -36.522 1.00 31.04 C ATOM 595 OE1 GLN A 74 9.355 38.554 -36.948 1.00 28.47 O ATOM 596 NE2 GLN A 74 9.168 40.621 -36.137 1.00 36.43 N ATOM 0 H GLN A 74 6.669 35.435 -34.882 1.00 22.36 H new ATOM 0 HA GLN A 74 8.490 37.239 -34.759 1.00 25.17 H new ATOM 0 HB2 GLN A 74 7.129 37.181 -36.662 1.00 25.22 H new ATOM 0 HB3 GLN A 74 5.881 37.597 -35.825 1.00 25.22 H new ATOM 0 HG2 GLN A 74 6.616 39.552 -37.035 1.00 27.04 H new ATOM 0 HG3 GLN A 74 6.843 39.845 -35.520 1.00 27.04 H new ATOM 0 HE21 GLN A 74 8.658 41.248 -35.844 1.00 36.43 H new ATOM 0 HE22 GLN A 74 10.018 40.742 -36.178 1.00 36.43 H new ATOM 597 N MET A 75 6.049 37.933 -32.823 1.00 25.13 N ATOM 598 CA MET A 75 5.753 38.598 -31.515 1.00 25.85 C ATOM 599 C MET A 75 6.886 38.308 -30.470 1.00 25.67 C ATOM 600 O MET A 75 7.296 39.234 -29.760 1.00 25.20 O ATOM 601 CB MET A 75 4.366 38.101 -31.003 1.00 26.38 C ATOM 602 CG MET A 75 3.764 39.000 -29.904 1.00 33.91 C ATOM 603 SD MET A 75 1.962 38.656 -29.530 1.00 40.76 S ATOM 604 CE MET A 75 1.203 38.582 -31.095 1.00 34.31 C ATOM 0 H MET A 75 5.425 37.421 -33.119 1.00 25.13 H new ATOM 0 HA MET A 75 5.722 39.560 -31.638 1.00 25.85 H new ATOM 0 HB2 MET A 75 3.749 38.057 -31.750 1.00 26.38 H new ATOM 0 HB3 MET A 75 4.459 37.199 -30.659 1.00 26.38 H new ATOM 0 HG2 MET A 75 4.280 38.888 -29.090 1.00 33.91 H new ATOM 0 HG3 MET A 75 3.857 39.927 -30.173 1.00 33.91 H new ATOM 0 HE1 MET A 75 0.250 38.436 -30.986 1.00 34.31 H new ATOM 0 HE2 MET A 75 1.350 39.417 -31.566 1.00 34.31 H new ATOM 0 HE3 MET A 75 1.585 37.851 -31.606 1.00 34.31 H new ATOM 605 N GLY A 76 7.356 37.043 -30.394 1.00 25.37 N ATOM 606 CA GLY A 76 8.529 36.668 -29.558 1.00 23.87 C ATOM 607 C GLY A 76 9.733 37.539 -29.904 1.00 23.83 C ATOM 608 O GLY A 76 10.418 38.156 -29.045 1.00 22.25 O ATOM 0 H GLY A 76 7.008 36.383 -30.821 1.00 25.37 H new ATOM 0 HA2 GLY A 76 8.309 36.769 -28.619 1.00 23.87 H new ATOM 0 HA3 GLY A 76 8.748 35.734 -29.699 1.00 23.87 H new ATOM 609 N ILE A 77 10.076 37.536 -31.178 1.00 21.32 N ATOM 610 CA ILE A 77 11.214 38.330 -31.583 1.00 22.54 C ATOM 611 C ILE A 77 11.090 39.796 -31.193 1.00 21.58 C ATOM 612 O ILE A 77 12.056 40.363 -30.692 1.00 23.67 O ATOM 613 CB ILE A 77 11.407 38.242 -33.190 1.00 21.14 C ATOM 614 CG1 ILE A 77 11.634 36.801 -33.676 1.00 27.41 C ATOM 615 CG2 ILE A 77 12.459 39.295 -33.674 1.00 22.40 C ATOM 616 CD1 ILE A 77 12.743 36.251 -33.106 1.00 37.30 C ATOM 0 H ILE A 77 9.680 37.098 -31.803 1.00 21.32 H new ATOM 0 HA ILE A 77 11.981 37.962 -31.117 1.00 22.54 H new ATOM 0 HB ILE A 77 10.576 38.491 -33.624 1.00 21.14 H new ATOM 0 HG12 ILE A 77 10.857 36.260 -33.463 1.00 27.41 H new ATOM 0 HG13 ILE A 77 11.728 36.795 -34.641 1.00 27.41 H new ATOM 0 HG21 ILE A 77 12.563 39.230 -34.636 1.00 22.40 H new ATOM 0 HG22 ILE A 77 12.155 40.186 -33.442 1.00 22.40 H new ATOM 0 HG23 ILE A 77 13.311 39.122 -33.245 1.00 22.40 H new ATOM 0 HD11 ILE A 77 12.859 35.345 -33.432 1.00 37.30 H new ATOM 0 HD12 ILE A 77 13.522 36.780 -33.338 1.00 37.30 H new ATOM 0 HD13 ILE A 77 12.638 36.237 -32.142 1.00 37.30 H new ATOM 617 N GLU A 78 9.943 40.435 -31.443 1.00 21.96 N ATOM 618 CA GLU A 78 9.847 41.813 -31.136 1.00 24.16 C ATOM 619 C GLU A 78 9.922 42.100 -29.653 1.00 22.93 C ATOM 620 O GLU A 78 10.538 43.098 -29.261 1.00 22.55 O ATOM 621 CB GLU A 78 8.528 42.385 -31.613 1.00 25.67 C ATOM 622 CG GLU A 78 8.626 42.630 -33.159 1.00 33.61 C ATOM 623 CD GLU A 78 7.259 42.576 -33.862 1.00 43.10 C ATOM 624 OE1 GLU A 78 7.203 42.713 -35.114 1.00 47.78 O ATOM 625 OE2 GLU A 78 6.226 42.368 -33.190 1.00 51.67 O ATOM 0 H GLU A 78 9.238 40.078 -31.782 1.00 21.96 H new ATOM 0 HA GLU A 78 10.603 42.221 -31.586 1.00 24.16 H new ATOM 0 HB2 GLU A 78 7.803 41.773 -31.413 1.00 25.67 H new ATOM 0 HB3 GLU A 78 8.333 43.216 -31.151 1.00 25.67 H new ATOM 0 HG2 GLU A 78 9.033 43.496 -33.319 1.00 33.61 H new ATOM 0 HG3 GLU A 78 9.212 41.964 -33.551 1.00 33.61 H new ATOM 626 N GLY A 79 9.259 41.261 -28.859 1.00 20.39 N ATOM 627 CA GLY A 79 9.309 41.461 -27.371 1.00 19.92 C ATOM 628 C GLY A 79 10.719 41.258 -26.865 1.00 19.07 C ATOM 629 O GLY A 79 11.210 42.040 -26.031 1.00 19.42 O ATOM 0 H GLY A 79 8.789 40.593 -29.127 1.00 20.39 H new ATOM 0 HA2 GLY A 79 9.003 42.354 -27.147 1.00 19.92 H new ATOM 0 HA3 GLY A 79 8.708 40.838 -26.934 1.00 19.92 H new ATOM 630 N GLU A 80 11.393 40.185 -27.304 1.00 18.66 N ATOM 631 CA GLU A 80 12.715 39.943 -26.808 1.00 17.52 C ATOM 632 C GLU A 80 13.669 41.128 -27.270 1.00 18.21 C ATOM 633 O GLU A 80 14.559 41.578 -26.521 1.00 17.42 O ATOM 634 CB GLU A 80 13.257 38.597 -27.329 1.00 15.78 C ATOM 635 CG GLU A 80 12.502 37.282 -26.842 1.00 17.76 C ATOM 636 CD GLU A 80 12.784 36.941 -25.347 1.00 18.69 C ATOM 637 OE1 GLU A 80 12.142 36.155 -24.697 1.00 23.53 O ATOM 638 OE2 GLU A 80 13.708 37.397 -24.667 1.00 18.59 O ATOM 0 H GLU A 80 11.098 39.611 -27.872 1.00 18.66 H new ATOM 0 HA GLU A 80 12.686 39.902 -25.839 1.00 17.52 H new ATOM 0 HB2 GLU A 80 13.235 38.617 -28.299 1.00 15.78 H new ATOM 0 HB3 GLU A 80 14.189 38.525 -27.068 1.00 15.78 H new ATOM 0 HG2 GLU A 80 11.547 37.397 -26.969 1.00 17.76 H new ATOM 0 HG3 GLU A 80 12.774 36.534 -27.397 1.00 17.76 H new ATOM 639 N THR A 81 13.491 41.568 -28.498 1.00 17.76 N ATOM 640 CA THR A 81 14.328 42.679 -29.005 1.00 19.78 C ATOM 641 C THR A 81 14.100 43.954 -28.235 1.00 16.84 C ATOM 642 O THR A 81 15.018 44.655 -27.926 1.00 16.78 O ATOM 643 CB THR A 81 14.035 42.893 -30.528 1.00 20.63 C ATOM 644 OG1 THR A 81 14.378 41.657 -31.188 1.00 23.63 O ATOM 645 CG2 THR A 81 14.927 44.022 -31.049 1.00 24.50 C ATOM 0 H THR A 81 12.912 41.259 -29.054 1.00 17.76 H new ATOM 0 HA THR A 81 15.260 42.439 -28.882 1.00 19.78 H new ATOM 0 HB THR A 81 13.108 43.128 -30.689 1.00 20.63 H new ATOM 0 HG1 THR A 81 13.737 41.118 -31.124 1.00 23.63 H new ATOM 0 HG21 THR A 81 14.753 44.163 -31.993 1.00 24.50 H new ATOM 0 HG22 THR A 81 14.736 44.838 -30.560 1.00 24.50 H new ATOM 0 HG23 THR A 81 15.859 43.782 -30.925 1.00 24.50 H new ATOM 646 N PHE A 82 12.867 44.193 -27.865 1.00 17.08 N ATOM 647 CA PHE A 82 12.530 45.326 -26.977 1.00 18.00 C ATOM 648 C PHE A 82 13.264 45.210 -25.656 1.00 17.06 C ATOM 649 O PHE A 82 13.911 46.202 -25.166 1.00 19.11 O ATOM 650 CB PHE A 82 10.998 45.414 -26.774 1.00 19.59 C ATOM 651 CG PHE A 82 10.601 46.395 -25.684 1.00 22.06 C ATOM 652 CD1 PHE A 82 10.071 45.903 -24.475 1.00 25.50 C ATOM 653 CD2 PHE A 82 10.810 47.774 -25.844 1.00 24.93 C ATOM 654 CE1 PHE A 82 9.770 46.806 -23.418 1.00 27.04 C ATOM 655 CE2 PHE A 82 10.527 48.667 -24.846 1.00 25.66 C ATOM 656 CZ PHE A 82 10.007 48.152 -23.594 1.00 22.61 C ATOM 0 H PHE A 82 12.192 43.719 -28.108 1.00 17.08 H new ATOM 0 HA PHE A 82 12.821 46.150 -27.398 1.00 18.00 H new ATOM 0 HB2 PHE A 82 10.581 45.679 -27.609 1.00 19.59 H new ATOM 0 HB3 PHE A 82 10.655 44.534 -26.552 1.00 19.59 H new ATOM 0 HD1 PHE A 82 9.919 44.992 -24.368 1.00 25.50 H new ATOM 0 HD2 PHE A 82 11.150 48.089 -26.650 1.00 24.93 H new ATOM 0 HE1 PHE A 82 9.417 46.491 -22.617 1.00 27.04 H new ATOM 0 HE2 PHE A 82 10.664 49.579 -24.967 1.00 25.66 H new ATOM 0 HZ PHE A 82 9.830 48.741 -22.897 1.00 22.61 H new ATOM 657 N GLU A 83 13.235 44.031 -25.040 1.00 19.02 N ATOM 658 CA GLU A 83 13.952 43.911 -23.771 1.00 19.14 C ATOM 659 C GLU A 83 15.468 44.066 -23.853 1.00 19.98 C ATOM 660 O GLU A 83 16.107 44.642 -22.942 1.00 19.87 O ATOM 661 CB GLU A 83 13.581 42.554 -23.170 1.00 18.93 C ATOM 662 CG GLU A 83 12.121 42.605 -22.721 1.00 24.94 C ATOM 663 CD GLU A 83 11.602 41.246 -22.261 1.00 39.91 C ATOM 664 OE1 GLU A 83 10.363 41.050 -22.203 1.00 46.58 O ATOM 665 OE2 GLU A 83 12.434 40.368 -21.965 1.00 42.41 O ATOM 0 H GLU A 83 12.831 43.325 -25.318 1.00 19.02 H new ATOM 0 HA GLU A 83 13.677 44.655 -23.212 1.00 19.14 H new ATOM 0 HB2 GLU A 83 13.708 41.849 -23.825 1.00 18.93 H new ATOM 0 HB3 GLU A 83 14.158 42.349 -22.418 1.00 18.93 H new ATOM 0 HG2 GLU A 83 12.031 43.244 -21.997 1.00 24.94 H new ATOM 0 HG3 GLU A 83 11.572 42.926 -23.453 1.00 24.94 H new ATOM 666 N VAL A 84 16.039 43.563 -24.939 1.00 20.35 N ATOM 667 CA VAL A 84 17.470 43.657 -25.141 1.00 20.27 C ATOM 668 C VAL A 84 17.951 45.046 -25.438 1.00 19.56 C ATOM 669 O VAL A 84 18.976 45.468 -24.909 1.00 20.68 O ATOM 670 CB VAL A 84 17.856 42.718 -26.390 1.00 22.78 C ATOM 671 CG1 VAL A 84 19.287 43.038 -26.965 1.00 22.52 C ATOM 672 CG2 VAL A 84 17.754 41.227 -25.956 1.00 20.82 C ATOM 0 H VAL A 84 15.612 43.163 -25.570 1.00 20.35 H new ATOM 0 HA VAL A 84 17.894 43.381 -24.313 1.00 20.27 H new ATOM 0 HB VAL A 84 17.228 42.896 -27.108 1.00 22.78 H new ATOM 0 HG11 VAL A 84 19.474 42.449 -27.713 1.00 22.52 H new ATOM 0 HG12 VAL A 84 19.317 43.960 -27.264 1.00 22.52 H new ATOM 0 HG13 VAL A 84 19.952 42.902 -26.272 1.00 22.52 H new ATOM 0 HG21 VAL A 84 17.985 40.655 -26.705 1.00 20.82 H new ATOM 0 HG22 VAL A 84 18.366 41.061 -25.222 1.00 20.82 H new ATOM 0 HG23 VAL A 84 16.847 41.034 -25.671 1.00 20.82 H new ATOM 673 N GLU A 85 17.266 45.762 -26.324 1.00 20.43 N ATOM 674 CA GLU A 85 17.851 47.049 -26.827 1.00 20.81 C ATOM 675 C GLU A 85 17.347 48.230 -26.017 1.00 21.52 C ATOM 676 O GLU A 85 17.974 49.314 -25.980 1.00 22.11 O ATOM 677 CB GLU A 85 17.357 47.248 -28.267 1.00 22.40 C ATOM 678 CG GLU A 85 17.894 46.156 -29.187 1.00 23.02 C ATOM 679 CD GLU A 85 17.518 46.469 -30.653 1.00 32.59 C ATOM 680 OE1 GLU A 85 17.978 45.732 -31.523 1.00 31.92 O ATOM 681 OE2 GLU A 85 16.683 47.395 -30.919 1.00 30.28 O ATOM 0 H GLU A 85 16.497 45.551 -26.646 1.00 20.43 H new ATOM 0 HA GLU A 85 18.818 47.003 -26.763 1.00 20.81 H new ATOM 0 HB2 GLU A 85 16.387 47.241 -28.283 1.00 22.40 H new ATOM 0 HB3 GLU A 85 17.640 48.117 -28.592 1.00 22.40 H new ATOM 0 HG2 GLU A 85 18.858 46.093 -29.099 1.00 23.02 H new ATOM 0 HG3 GLU A 85 17.529 45.296 -28.928 1.00 23.02 H new ATOM 682 N GLU A 86 16.201 48.055 -25.398 1.00 19.66 N ATOM 683 CA GLU A 86 15.551 49.226 -24.728 1.00 19.47 C ATOM 684 C GLU A 86 15.376 48.983 -23.263 1.00 18.99 C ATOM 685 O GLU A 86 15.941 49.732 -22.434 1.00 18.76 O ATOM 686 CB GLU A 86 14.208 49.419 -25.345 1.00 21.28 C ATOM 687 CG GLU A 86 14.335 50.042 -26.826 1.00 22.78 C ATOM 688 CD GLU A 86 14.603 51.574 -26.766 1.00 29.88 C ATOM 689 OE1 GLU A 86 15.010 52.107 -27.801 1.00 37.81 O ATOM 690 OE2 GLU A 86 14.435 52.267 -25.715 1.00 22.40 O ATOM 0 H GLU A 86 15.776 47.309 -25.340 1.00 19.66 H new ATOM 0 HA GLU A 86 16.112 50.009 -24.842 1.00 19.47 H new ATOM 0 HB2 GLU A 86 13.743 48.569 -25.387 1.00 21.28 H new ATOM 0 HB3 GLU A 86 13.674 50.007 -24.788 1.00 21.28 H new ATOM 0 HG2 GLU A 86 15.055 49.603 -27.305 1.00 22.78 H new ATOM 0 HG3 GLU A 86 13.519 49.872 -27.323 1.00 22.78 H new ATOM 691 N MET A 87 14.513 48.034 -22.911 1.00 16.63 N ATOM 692 CA MET A 87 14.061 47.967 -21.505 1.00 16.83 C ATOM 693 C MET A 87 15.173 47.621 -20.527 1.00 16.23 C ATOM 694 O MET A 87 15.399 48.408 -19.561 1.00 17.89 O ATOM 695 CB MET A 87 12.922 46.924 -21.328 1.00 16.80 C ATOM 696 CG MET A 87 12.185 47.169 -19.968 1.00 20.11 C ATOM 697 SD MET A 87 10.970 45.865 -19.707 1.00 24.69 S ATOM 698 CE MET A 87 12.077 44.563 -19.071 1.00 25.17 C ATOM 0 H MET A 87 14.184 47.439 -23.438 1.00 16.63 H new ATOM 0 HA MET A 87 13.742 48.860 -21.302 1.00 16.83 H new ATOM 0 HB2 MET A 87 12.293 46.992 -22.063 1.00 16.80 H new ATOM 0 HB3 MET A 87 13.288 46.026 -21.350 1.00 16.80 H new ATOM 0 HG2 MET A 87 12.825 47.180 -19.239 1.00 20.11 H new ATOM 0 HG3 MET A 87 11.749 48.035 -19.976 1.00 20.11 H new ATOM 0 HE1 MET A 87 11.836 43.711 -19.467 1.00 25.17 H new ATOM 0 HE2 MET A 87 12.995 44.778 -19.301 1.00 25.17 H new ATOM 0 HE3 MET A 87 11.990 44.507 -18.107 1.00 25.17 H new ATOM 699 N TYR A 88 15.797 46.449 -20.671 1.00 15.73 N ATOM 700 CA TYR A 88 16.761 46.060 -19.659 1.00 15.78 C ATOM 701 C TYR A 88 18.024 46.942 -19.554 1.00 16.67 C ATOM 702 O TYR A 88 18.503 47.177 -18.447 1.00 16.25 O ATOM 703 CB TYR A 88 17.128 44.573 -19.655 1.00 14.47 C ATOM 704 CG TYR A 88 16.048 43.679 -18.995 1.00 15.00 C ATOM 705 CD1 TYR A 88 15.658 43.930 -17.643 1.00 17.00 C ATOM 706 CD2 TYR A 88 15.455 42.650 -19.689 1.00 15.00 C ATOM 707 CE1 TYR A 88 14.687 43.156 -17.012 1.00 17.85 C ATOM 708 CE2 TYR A 88 14.461 41.864 -19.085 1.00 16.86 C ATOM 709 CZ TYR A 88 14.115 42.138 -17.713 1.00 16.99 C ATOM 710 OH TYR A 88 13.218 41.350 -17.038 1.00 20.19 O ATOM 0 H TYR A 88 15.681 45.893 -21.317 1.00 15.73 H new ATOM 0 HA TYR A 88 16.254 46.230 -18.850 1.00 15.78 H new ATOM 0 HB2 TYR A 88 17.269 44.278 -20.568 1.00 14.47 H new ATOM 0 HB3 TYR A 88 17.969 44.455 -19.185 1.00 14.47 H new ATOM 0 HD1 TYR A 88 16.061 44.625 -17.175 1.00 17.00 H new ATOM 0 HD2 TYR A 88 15.714 42.474 -20.565 1.00 15.00 H new ATOM 0 HE1 TYR A 88 14.435 43.330 -16.134 1.00 17.85 H new ATOM 0 HE2 TYR A 88 14.037 41.184 -19.558 1.00 16.86 H new ATOM 0 HH TYR A 88 13.090 40.640 -17.468 1.00 20.19 H new ATOM 711 N PRO A 89 18.593 47.373 -20.677 1.00 17.49 N ATOM 712 CA PRO A 89 19.736 48.296 -20.548 1.00 16.43 C ATOM 713 C PRO A 89 19.409 49.535 -19.720 1.00 16.79 C ATOM 714 O PRO A 89 20.224 49.936 -18.849 1.00 17.37 O ATOM 715 CB PRO A 89 20.056 48.678 -22.048 1.00 18.01 C ATOM 716 CG PRO A 89 19.623 47.429 -22.827 1.00 19.74 C ATOM 717 CD PRO A 89 18.259 47.065 -22.102 1.00 16.94 C ATOM 0 HA PRO A 89 20.482 47.890 -20.080 1.00 16.43 H new ATOM 0 HB2 PRO A 89 19.564 49.465 -22.330 1.00 18.01 H new ATOM 0 HB3 PRO A 89 20.998 48.871 -22.176 1.00 18.01 H new ATOM 0 HG2 PRO A 89 19.497 47.612 -23.771 1.00 19.74 H new ATOM 0 HG3 PRO A 89 20.274 46.713 -22.761 1.00 19.74 H new ATOM 0 HD2 PRO A 89 17.518 47.599 -22.428 1.00 16.94 H new ATOM 0 HD3 PRO A 89 18.015 46.135 -22.228 1.00 16.94 H new ATOM 718 N VAL A 90 18.201 50.139 -19.936 1.00 15.85 N ATOM 719 CA VAL A 90 17.768 51.292 -19.167 1.00 15.90 C ATOM 720 C VAL A 90 17.495 50.947 -17.702 1.00 15.99 C ATOM 721 O VAL A 90 17.982 51.673 -16.832 1.00 17.20 O ATOM 722 CB VAL A 90 16.523 51.993 -19.850 1.00 16.03 C ATOM 723 CG1 VAL A 90 15.863 52.989 -18.875 1.00 16.89 C ATOM 724 CG2 VAL A 90 17.004 52.651 -21.125 1.00 21.26 C ATOM 0 H VAL A 90 17.635 49.878 -20.529 1.00 15.85 H new ATOM 0 HA VAL A 90 18.501 51.927 -19.164 1.00 15.90 H new ATOM 0 HB VAL A 90 15.837 51.345 -20.074 1.00 16.03 H new ATOM 0 HG11 VAL A 90 15.103 53.410 -19.307 1.00 16.89 H new ATOM 0 HG12 VAL A 90 15.563 52.516 -18.083 1.00 16.89 H new ATOM 0 HG13 VAL A 90 16.507 53.668 -18.621 1.00 16.89 H new ATOM 0 HG21 VAL A 90 16.258 53.089 -21.564 1.00 21.26 H new ATOM 0 HG22 VAL A 90 17.685 53.308 -20.913 1.00 21.26 H new ATOM 0 HG23 VAL A 90 17.377 51.978 -21.716 1.00 21.26 H new ATOM 725 N TYR A 91 16.748 49.852 -17.442 1.00 14.78 N ATOM 726 CA TYR A 91 16.449 49.532 -16.088 1.00 16.55 C ATOM 727 C TYR A 91 17.776 49.191 -15.325 1.00 16.75 C ATOM 728 O TYR A 91 17.929 49.510 -14.124 1.00 17.29 O ATOM 729 CB TYR A 91 15.517 48.298 -16.061 1.00 15.23 C ATOM 730 CG TYR A 91 14.066 48.569 -16.361 1.00 17.01 C ATOM 731 CD1 TYR A 91 13.602 49.880 -16.612 1.00 19.59 C ATOM 732 CD2 TYR A 91 13.173 47.521 -16.373 1.00 18.58 C ATOM 733 CE1 TYR A 91 12.270 50.101 -16.891 1.00 21.02 C ATOM 734 CE2 TYR A 91 11.836 47.748 -16.636 1.00 19.91 C ATOM 735 CZ TYR A 91 11.398 49.017 -16.851 1.00 20.84 C ATOM 736 OH TYR A 91 10.082 49.227 -17.194 1.00 20.70 O ATOM 0 H TYR A 91 16.427 49.315 -18.033 1.00 14.78 H new ATOM 0 HA TYR A 91 16.016 50.287 -15.660 1.00 16.55 H new ATOM 0 HB2 TYR A 91 15.847 47.650 -16.702 1.00 15.23 H new ATOM 0 HB3 TYR A 91 15.578 47.886 -15.185 1.00 15.23 H new ATOM 0 HD1 TYR A 91 14.196 50.595 -16.589 1.00 19.59 H new ATOM 0 HD2 TYR A 91 13.471 46.657 -16.203 1.00 18.58 H new ATOM 0 HE1 TYR A 91 11.962 50.953 -17.101 1.00 21.02 H new ATOM 0 HE2 TYR A 91 11.238 47.036 -16.666 1.00 19.91 H new ATOM 0 HH TYR A 91 9.658 48.505 -17.133 1.00 20.70 H new ATOM 737 N ASN A 92 18.696 48.496 -16.045 1.00 17.07 N ATOM 738 CA ASN A 92 19.969 48.084 -15.398 1.00 18.18 C ATOM 739 C ASN A 92 20.761 49.364 -15.081 1.00 18.54 C ATOM 740 O ASN A 92 21.348 49.485 -14.019 1.00 19.15 O ATOM 741 CB ASN A 92 20.755 47.215 -16.371 1.00 15.73 C ATOM 742 CG ASN A 92 22.129 46.830 -15.855 1.00 23.32 C ATOM 743 OD1 ASN A 92 23.101 47.502 -16.221 1.00 21.33 O ATOM 744 ND2 ASN A 92 22.233 45.763 -15.004 1.00 22.63 N ATOM 0 H ASN A 92 18.607 48.264 -16.868 1.00 17.07 H new ATOM 0 HA ASN A 92 19.806 47.580 -14.586 1.00 18.18 H new ATOM 0 HB2 ASN A 92 20.249 46.409 -16.557 1.00 15.73 H new ATOM 0 HB3 ASN A 92 20.853 47.689 -17.212 1.00 15.73 H new ATOM 0 HD21 ASN A 92 23.002 45.531 -14.697 1.00 22.63 H new ATOM 0 HD22 ASN A 92 21.529 45.324 -14.776 1.00 22.63 H new ATOM 745 N LYS A 93 20.810 50.339 -16.001 1.00 18.47 N ATOM 746 CA LYS A 93 21.644 51.535 -15.750 1.00 19.11 C ATOM 747 C LYS A 93 21.016 52.348 -14.643 1.00 19.07 C ATOM 748 O LYS A 93 21.713 52.971 -13.788 1.00 18.57 O ATOM 749 CB LYS A 93 21.624 52.401 -17.020 1.00 21.08 C ATOM 750 CG LYS A 93 22.365 53.718 -16.977 1.00 21.28 C ATOM 751 CD LYS A 93 23.825 53.636 -16.566 1.00 33.52 C ATOM 752 CE LYS A 93 24.628 52.754 -17.396 1.00 33.88 C ATOM 753 NZ LYS A 93 26.069 53.125 -16.917 1.00 39.79 N ATOM 0 H LYS A 93 20.387 50.334 -16.750 1.00 18.47 H new ATOM 0 HA LYS A 93 22.546 51.269 -15.511 1.00 19.11 H new ATOM 0 HB2 LYS A 93 21.991 51.874 -17.747 1.00 21.08 H new ATOM 0 HB3 LYS A 93 20.698 52.585 -17.242 1.00 21.08 H new ATOM 0 HG2 LYS A 93 22.315 54.128 -17.855 1.00 21.28 H new ATOM 0 HG3 LYS A 93 21.905 54.310 -16.361 1.00 21.28 H new ATOM 0 HD2 LYS A 93 24.209 54.527 -16.592 1.00 33.52 H new ATOM 0 HD3 LYS A 93 23.875 53.333 -15.646 1.00 33.52 H new ATOM 0 HE2 LYS A 93 24.421 51.819 -17.245 1.00 33.88 H new ATOM 0 HE3 LYS A 93 24.501 52.924 -18.342 1.00 33.88 H new ATOM 0 HZ1 LYS A 93 26.664 52.628 -17.354 1.00 39.79 H new ATOM 0 HZ2 LYS A 93 26.224 53.986 -17.081 1.00 39.79 H new ATOM 0 HZ3 LYS A 93 26.140 52.973 -16.043 1.00 39.79 H new ATOM 754 N ALA A 94 19.686 52.363 -14.601 1.00 19.24 N ATOM 755 CA ALA A 94 19.011 53.074 -13.518 1.00 19.15 C ATOM 756 C ALA A 94 19.284 52.435 -12.148 1.00 19.47 C ATOM 757 O ALA A 94 19.481 53.155 -11.140 1.00 20.01 O ATOM 758 CB ALA A 94 17.487 53.125 -13.742 1.00 17.56 C ATOM 0 H ALA A 94 19.169 51.980 -15.171 1.00 19.24 H new ATOM 0 HA ALA A 94 19.372 53.974 -13.523 1.00 19.15 H new ATOM 0 HB1 ALA A 94 17.068 53.602 -13.009 1.00 17.56 H new ATOM 0 HB2 ALA A 94 17.297 53.583 -14.576 1.00 17.56 H new ATOM 0 HB3 ALA A 94 17.135 52.222 -13.783 1.00 17.56 H new ATOM 759 N ALA A 95 19.249 51.105 -12.090 1.00 18.92 N ATOM 760 CA ALA A 95 19.541 50.394 -10.837 1.00 18.78 C ATOM 761 C ALA A 95 20.970 50.693 -10.423 1.00 18.39 C ATOM 762 O ALA A 95 21.277 50.922 -9.198 1.00 18.42 O ATOM 763 CB ALA A 95 19.337 48.874 -11.024 1.00 21.05 C ATOM 0 H ALA A 95 19.060 50.596 -12.757 1.00 18.92 H new ATOM 0 HA ALA A 95 18.935 50.695 -10.142 1.00 18.78 H new ATOM 0 HB1 ALA A 95 19.532 48.416 -10.191 1.00 21.05 H new ATOM 0 HB2 ALA A 95 18.418 48.700 -11.280 1.00 21.05 H new ATOM 0 HB3 ALA A 95 19.932 48.550 -11.718 1.00 21.05 H new ATOM 764 N GLU A 96 21.858 50.770 -11.412 1.00 19.60 N ATOM 765 CA GLU A 96 23.226 51.082 -11.051 1.00 22.78 C ATOM 766 C GLU A 96 23.347 52.502 -10.537 1.00 23.53 C ATOM 767 O GLU A 96 24.037 52.741 -9.537 1.00 21.30 O ATOM 768 CB GLU A 96 24.169 50.828 -12.261 1.00 24.71 C ATOM 769 CG GLU A 96 25.525 51.516 -12.096 1.00 30.24 C ATOM 770 CD GLU A 96 26.261 51.545 -13.447 1.00 45.89 C ATOM 771 OE1 GLU A 96 26.838 50.490 -13.816 1.00 50.62 O ATOM 772 OE2 GLU A 96 26.231 52.591 -14.138 1.00 44.22 O ATOM 0 H GLU A 96 21.699 50.652 -12.249 1.00 19.60 H new ATOM 0 HA GLU A 96 23.497 50.495 -10.328 1.00 22.78 H new ATOM 0 HB2 GLU A 96 24.304 49.873 -12.368 1.00 24.71 H new ATOM 0 HB3 GLU A 96 23.744 51.147 -13.072 1.00 24.71 H new ATOM 0 HG2 GLU A 96 25.401 52.420 -11.766 1.00 30.24 H new ATOM 0 HG3 GLU A 96 26.059 51.044 -11.437 1.00 30.24 H new ATOM 773 N PHE A 97 22.688 53.462 -11.219 1.00 20.84 N ATOM 774 CA PHE A 97 22.675 54.853 -10.803 1.00 21.27 C ATOM 775 C PHE A 97 22.094 55.000 -9.391 1.00 20.56 C ATOM 776 O PHE A 97 22.518 55.859 -8.625 1.00 21.84 O ATOM 777 CB PHE A 97 21.824 55.652 -11.810 1.00 19.66 C ATOM 778 CG PHE A 97 21.668 57.106 -11.503 1.00 25.45 C ATOM 779 CD1 PHE A 97 20.430 57.621 -11.108 1.00 24.26 C ATOM 780 CD2 PHE A 97 22.739 57.979 -11.715 1.00 28.47 C ATOM 781 CE1 PHE A 97 20.280 58.926 -10.914 1.00 30.42 C ATOM 782 CE2 PHE A 97 22.604 59.366 -11.467 1.00 30.13 C ATOM 783 CZ PHE A 97 21.378 59.845 -11.071 1.00 26.64 C ATOM 0 H PHE A 97 22.239 53.309 -11.936 1.00 20.84 H new ATOM 0 HA PHE A 97 23.584 55.192 -10.784 1.00 21.27 H new ATOM 0 HB2 PHE A 97 22.223 55.563 -12.690 1.00 19.66 H new ATOM 0 HB3 PHE A 97 20.942 55.250 -11.856 1.00 19.66 H new ATOM 0 HD1 PHE A 97 19.709 57.048 -10.981 1.00 24.26 H new ATOM 0 HD2 PHE A 97 23.550 57.644 -12.023 1.00 28.47 H new ATOM 0 HE1 PHE A 97 19.445 59.255 -10.671 1.00 30.42 H new ATOM 0 HE2 PHE A 97 23.328 59.940 -11.570 1.00 30.13 H new ATOM 0 HZ PHE A 97 21.259 60.752 -10.906 1.00 26.64 H new ATOM 784 N GLN A 98 21.114 54.206 -9.015 1.00 19.30 N ATOM 785 CA GLN A 98 20.522 54.406 -7.706 1.00 19.44 C ATOM 786 C GLN A 98 21.204 53.525 -6.669 1.00 21.85 C ATOM 787 O GLN A 98 20.678 53.436 -5.559 1.00 22.69 O ATOM 788 CB GLN A 98 19.016 54.023 -7.687 1.00 19.16 C ATOM 789 CG GLN A 98 18.185 54.923 -8.630 1.00 20.13 C ATOM 790 CD GLN A 98 16.751 55.018 -8.223 1.00 18.40 C ATOM 791 OE1 GLN A 98 16.023 54.008 -8.192 1.00 19.82 O ATOM 792 NE2 GLN A 98 16.302 56.263 -7.912 1.00 20.30 N ATOM 0 H GLN A 98 20.783 53.564 -9.483 1.00 19.30 H new ATOM 0 HA GLN A 98 20.632 55.348 -7.502 1.00 19.44 H new ATOM 0 HB2 GLN A 98 18.914 53.095 -7.952 1.00 19.16 H new ATOM 0 HB3 GLN A 98 18.674 54.099 -6.782 1.00 19.16 H new ATOM 0 HG2 GLN A 98 18.572 55.812 -8.646 1.00 20.13 H new ATOM 0 HG3 GLN A 98 18.238 54.574 -9.534 1.00 20.13 H new ATOM 0 HE21 GLN A 98 16.838 56.934 -7.946 1.00 20.30 H new ATOM 0 HE22 GLN A 98 15.482 56.379 -7.681 1.00 20.30 H new ATOM 793 N GLY A 99 22.259 52.834 -7.065 1.00 22.03 N ATOM 794 CA GLY A 99 23.035 51.959 -6.105 1.00 24.85 C ATOM 795 C GLY A 99 22.327 50.648 -5.686 1.00 25.04 C ATOM 796 O GLY A 99 22.678 50.086 -4.614 1.00 23.25 O ATOM 0 H GLY A 99 22.563 52.837 -7.870 1.00 22.03 H new ATOM 0 HA2 GLY A 99 23.886 51.734 -6.512 1.00 24.85 H new ATOM 0 HA3 GLY A 99 23.230 52.474 -5.306 1.00 24.85 H new ATOM 797 N GLU A 100 21.351 50.132 -6.458 1.00 19.48 N ATOM 798 CA GLU A 100 20.502 48.972 -6.019 1.00 20.52 C ATOM 799 C GLU A 100 21.139 47.712 -6.629 1.00 21.43 C ATOM 800 O GLU A 100 20.832 47.262 -7.778 1.00 20.39 O ATOM 801 CB GLU A 100 19.021 49.151 -6.489 1.00 20.56 C ATOM 802 CG GLU A 100 18.293 50.259 -5.672 1.00 22.47 C ATOM 803 CD GLU A 100 17.808 49.737 -4.271 1.00 28.99 C ATOM 804 OE1 GLU A 100 17.070 50.445 -3.587 1.00 29.33 O ATOM 805 OE2 GLU A 100 18.100 48.569 -3.851 1.00 32.16 O ATOM 0 H GLU A 100 21.156 50.431 -7.240 1.00 19.48 H new ATOM 0 HA GLU A 100 20.471 48.907 -5.052 1.00 20.52 H new ATOM 0 HB2 GLU A 100 19.005 49.379 -7.432 1.00 20.56 H new ATOM 0 HB3 GLU A 100 18.546 48.311 -6.392 1.00 20.56 H new ATOM 0 HG2 GLU A 100 18.891 51.012 -5.546 1.00 22.47 H new ATOM 0 HG3 GLU A 100 17.531 50.583 -6.177 1.00 22.47 H new ATOM 806 N LYS A 101 22.146 47.192 -5.926 1.00 21.80 N ATOM 807 CA LYS A 101 22.927 46.103 -6.516 1.00 22.73 C ATOM 808 C LYS A 101 22.115 44.850 -6.835 1.00 20.91 C ATOM 809 O LYS A 101 22.454 44.116 -7.778 1.00 19.79 O ATOM 810 CB LYS A 101 24.041 45.696 -5.484 1.00 24.07 C ATOM 811 CG LYS A 101 24.979 46.897 -5.094 1.00 33.09 C ATOM 812 CD LYS A 101 25.340 47.888 -6.232 1.00 43.55 C ATOM 813 CE LYS A 101 26.287 49.019 -5.661 1.00 48.65 C ATOM 814 NZ LYS A 101 27.497 48.362 -4.975 1.00 53.59 N ATOM 0 H LYS A 101 22.387 47.442 -5.139 1.00 21.80 H new ATOM 0 HA LYS A 101 23.279 46.435 -7.357 1.00 22.73 H new ATOM 0 HB2 LYS A 101 23.621 45.346 -4.683 1.00 24.07 H new ATOM 0 HB3 LYS A 101 24.578 44.980 -5.859 1.00 24.07 H new ATOM 0 HG2 LYS A 101 24.553 47.396 -4.380 1.00 33.09 H new ATOM 0 HG3 LYS A 101 25.803 46.534 -4.734 1.00 33.09 H new ATOM 0 HD2 LYS A 101 25.781 47.418 -6.956 1.00 43.55 H new ATOM 0 HD3 LYS A 101 24.533 48.282 -6.599 1.00 43.55 H new ATOM 0 HE2 LYS A 101 26.584 49.601 -6.378 1.00 48.65 H new ATOM 0 HE3 LYS A 101 25.803 49.573 -5.028 1.00 48.65 H new ATOM 0 HZ1 LYS A 101 28.214 48.879 -5.078 1.00 53.59 H new ATOM 0 HZ2 LYS A 101 27.327 48.260 -4.107 1.00 53.59 H new ATOM 0 HZ3 LYS A 101 27.651 47.566 -5.343 1.00 53.59 H new ATOM 815 N GLU A 102 21.098 44.536 -6.010 1.00 20.69 N ATOM 816 CA GLU A 102 20.295 43.326 -6.287 1.00 21.58 C ATOM 817 C GLU A 102 19.575 43.499 -7.647 1.00 19.16 C ATOM 818 O GLU A 102 19.419 42.543 -8.397 1.00 18.50 O ATOM 819 CB GLU A 102 19.188 43.121 -5.254 1.00 22.32 C ATOM 820 CG GLU A 102 19.688 42.545 -3.973 1.00 33.05 C ATOM 821 CD GLU A 102 18.529 42.640 -2.948 1.00 40.78 C ATOM 822 OE1 GLU A 102 18.495 43.571 -2.089 1.00 37.90 O ATOM 823 OE2 GLU A 102 17.598 41.810 -3.112 1.00 43.54 O ATOM 0 H GLU A 102 20.864 44.987 -5.316 1.00 20.69 H new ATOM 0 HA GLU A 102 20.906 42.573 -6.273 1.00 21.58 H new ATOM 0 HB2 GLU A 102 18.758 43.972 -5.075 1.00 22.32 H new ATOM 0 HB3 GLU A 102 18.511 42.534 -5.625 1.00 22.32 H new ATOM 0 HG2 GLU A 102 19.962 41.623 -4.096 1.00 33.05 H new ATOM 0 HG3 GLU A 102 20.465 43.033 -3.658 1.00 33.05 H new ATOM 824 N ALA A 103 19.103 44.723 -7.916 1.00 19.66 N ATOM 825 CA ALA A 103 18.356 44.973 -9.158 1.00 17.64 C ATOM 826 C ALA A 103 19.349 45.000 -10.315 1.00 18.43 C ATOM 827 O ALA A 103 19.023 44.640 -11.473 1.00 18.42 O ATOM 828 CB ALA A 103 17.591 46.314 -9.062 1.00 18.75 C ATOM 0 H ALA A 103 19.201 45.408 -7.406 1.00 19.66 H new ATOM 0 HA ALA A 103 17.703 44.271 -9.303 1.00 17.64 H new ATOM 0 HB1 ALA A 103 17.103 46.468 -9.886 1.00 18.75 H new ATOM 0 HB2 ALA A 103 16.968 46.279 -8.319 1.00 18.75 H new ATOM 0 HB3 ALA A 103 18.222 47.037 -8.921 1.00 18.75 H new ATOM 829 N VAL A 104 20.556 45.487 -10.038 1.00 18.35 N ATOM 830 CA VAL A 104 21.556 45.458 -11.100 1.00 18.84 C ATOM 831 C VAL A 104 21.765 43.981 -11.532 1.00 16.04 C ATOM 832 O VAL A 104 21.868 43.691 -12.715 1.00 16.10 O ATOM 833 CB VAL A 104 22.896 46.074 -10.615 1.00 20.42 C ATOM 834 CG1 VAL A 104 24.058 45.687 -11.659 1.00 22.20 C ATOM 835 CG2 VAL A 104 22.786 47.614 -10.580 1.00 21.15 C ATOM 0 H VAL A 104 20.807 45.821 -9.286 1.00 18.35 H new ATOM 0 HA VAL A 104 21.247 45.986 -11.853 1.00 18.84 H new ATOM 0 HB VAL A 104 23.096 45.734 -9.729 1.00 20.42 H new ATOM 0 HG11 VAL A 104 24.899 46.068 -11.363 1.00 22.20 H new ATOM 0 HG12 VAL A 104 24.141 44.722 -11.708 1.00 22.20 H new ATOM 0 HG13 VAL A 104 23.835 46.037 -12.536 1.00 22.20 H new ATOM 0 HG21 VAL A 104 23.626 47.992 -10.276 1.00 21.15 H new ATOM 0 HG22 VAL A 104 22.586 47.945 -11.470 1.00 21.15 H new ATOM 0 HG23 VAL A 104 22.076 47.874 -9.972 1.00 21.15 H new ATOM 836 N ARG A 105 21.812 43.078 -10.556 1.00 15.56 N ATOM 837 CA ARG A 105 22.016 41.667 -10.846 1.00 17.95 C ATOM 838 C ARG A 105 20.844 41.013 -11.535 1.00 16.46 C ATOM 839 O ARG A 105 21.034 40.391 -12.582 1.00 18.08 O ATOM 840 CB ARG A 105 22.276 40.888 -9.529 1.00 18.63 C ATOM 841 CG ARG A 105 22.531 39.397 -9.917 1.00 23.96 C ATOM 842 CD ARG A 105 23.259 38.642 -8.738 1.00 37.40 C ATOM 843 NE ARG A 105 22.474 38.920 -7.576 1.00 43.13 N ATOM 844 CZ ARG A 105 21.414 38.219 -7.176 1.00 53.31 C ATOM 845 NH1 ARG A 105 21.063 37.085 -7.802 1.00 54.79 N ATOM 846 NH2 ARG A 105 20.731 38.636 -6.091 1.00 55.86 N ATOM 0 H ARG A 105 21.728 43.264 -9.721 1.00 15.56 H new ATOM 0 HA ARG A 105 22.777 41.632 -11.446 1.00 17.95 H new ATOM 0 HB2 ARG A 105 23.041 41.255 -9.059 1.00 18.63 H new ATOM 0 HB3 ARG A 105 21.515 40.961 -8.932 1.00 18.63 H new ATOM 0 HG2 ARG A 105 21.689 38.960 -10.118 1.00 23.96 H new ATOM 0 HG3 ARG A 105 23.072 39.353 -10.721 1.00 23.96 H new ATOM 0 HD2 ARG A 105 23.307 37.688 -8.909 1.00 37.40 H new ATOM 0 HD3 ARG A 105 24.170 38.957 -8.629 1.00 37.40 H new ATOM 0 HE ARG A 105 22.705 39.595 -7.096 1.00 43.13 H new ATOM 0 HH11 ARG A 105 21.524 36.802 -8.470 1.00 54.79 H new ATOM 0 HH12 ARG A 105 20.377 36.641 -7.535 1.00 54.79 H new ATOM 0 HH21 ARG A 105 20.982 39.343 -5.670 1.00 55.86 H new ATOM 0 HH22 ARG A 105 20.044 38.195 -5.819 1.00 55.86 H new ATOM 847 N THR A 106 19.582 41.284 -11.093 1.00 16.62 N ATOM 848 CA THR A 106 18.458 40.588 -11.742 1.00 16.30 C ATOM 849 C THR A 106 18.219 41.090 -13.180 1.00 16.25 C ATOM 850 O THR A 106 17.860 40.284 -14.086 1.00 15.46 O ATOM 851 CB THR A 106 17.097 40.711 -10.955 1.00 17.79 C ATOM 852 OG1 THR A 106 16.673 42.055 -10.915 1.00 17.48 O ATOM 853 CG2 THR A 106 17.236 40.168 -9.543 1.00 20.37 C ATOM 0 H THR A 106 19.376 41.831 -10.462 1.00 16.62 H new ATOM 0 HA THR A 106 18.729 39.657 -11.749 1.00 16.30 H new ATOM 0 HB THR A 106 16.431 40.183 -11.422 1.00 17.79 H new ATOM 0 HG1 THR A 106 15.901 42.115 -11.240 1.00 17.48 H new ATOM 0 HG21 THR A 106 16.389 40.254 -9.078 1.00 20.37 H new ATOM 0 HG22 THR A 106 17.491 39.233 -9.579 1.00 20.37 H new ATOM 0 HG23 THR A 106 17.917 40.670 -9.068 1.00 20.37 H new ATOM 854 N THR A 107 18.443 42.376 -13.386 1.00 15.90 N ATOM 855 CA THR A 107 18.344 42.930 -14.761 1.00 16.82 C ATOM 856 C THR A 107 19.483 42.440 -15.687 1.00 16.80 C ATOM 857 O THR A 107 19.242 42.197 -16.841 1.00 17.96 O ATOM 858 CB THR A 107 18.282 44.470 -14.791 1.00 15.38 C ATOM 859 OG1 THR A 107 19.432 45.082 -14.147 1.00 18.01 O ATOM 860 CG2 THR A 107 16.957 44.894 -14.028 1.00 15.48 C ATOM 0 H THR A 107 18.649 42.944 -12.774 1.00 15.90 H new ATOM 0 HA THR A 107 17.502 42.588 -15.101 1.00 16.82 H new ATOM 0 HB THR A 107 18.285 44.773 -15.712 1.00 15.38 H new ATOM 0 HG1 THR A 107 19.365 44.996 -13.314 1.00 18.01 H new ATOM 0 HG21 THR A 107 16.881 45.861 -14.025 1.00 15.48 H new ATOM 0 HG22 THR A 107 16.188 44.511 -14.478 1.00 15.48 H new ATOM 0 HG23 THR A 107 16.992 44.570 -13.114 1.00 15.48 H new ATOM 861 N HIS A 108 20.684 42.341 -15.142 1.00 16.04 N ATOM 862 CA HIS A 108 21.811 41.732 -15.901 1.00 17.46 C ATOM 863 C HIS A 108 21.524 40.309 -16.290 1.00 18.04 C ATOM 864 O HIS A 108 21.771 39.943 -17.431 1.00 18.63 O ATOM 865 CB HIS A 108 23.108 41.841 -15.065 1.00 16.99 C ATOM 866 CG HIS A 108 24.285 41.173 -15.733 1.00 22.74 C ATOM 867 ND1 HIS A 108 24.941 40.075 -15.197 1.00 27.86 N ATOM 868 CD2 HIS A 108 24.872 41.427 -16.924 1.00 23.57 C ATOM 869 CE1 HIS A 108 25.934 39.706 -16.019 1.00 25.08 C ATOM 870 NE2 HIS A 108 25.907 40.501 -17.089 1.00 28.54 N ATOM 0 H HIS A 108 20.883 42.610 -14.350 1.00 16.04 H new ATOM 0 HA HIS A 108 21.926 42.222 -16.730 1.00 17.46 H new ATOM 0 HB2 HIS A 108 23.314 42.777 -14.914 1.00 16.99 H new ATOM 0 HB3 HIS A 108 22.963 41.438 -14.195 1.00 16.99 H new ATOM 0 HD2 HIS A 108 24.631 42.096 -17.524 1.00 23.57 H new ATOM 0 HE1 HIS A 108 26.538 39.015 -15.869 1.00 25.08 H new ATOM 0 HE2 HIS A 108 26.436 40.453 -17.765 1.00 28.54 H new ATOM 871 N TYR A 109 21.036 39.485 -15.344 1.00 18.07 N ATOM 872 CA TYR A 109 20.702 38.094 -15.650 1.00 17.23 C ATOM 873 C TYR A 109 19.689 38.039 -16.765 1.00 18.60 C ATOM 874 O TYR A 109 19.792 37.248 -17.684 1.00 17.76 O ATOM 875 CB TYR A 109 20.069 37.443 -14.426 1.00 16.61 C ATOM 876 CG TYR A 109 21.028 37.070 -13.323 1.00 20.15 C ATOM 877 CD1 TYR A 109 22.439 37.206 -13.494 1.00 23.21 C ATOM 878 CD2 TYR A 109 20.537 36.456 -12.128 1.00 21.56 C ATOM 879 CE1 TYR A 109 23.350 36.793 -12.471 1.00 25.12 C ATOM 880 CE2 TYR A 109 21.470 36.038 -11.095 1.00 23.07 C ATOM 881 CZ TYR A 109 22.839 36.181 -11.321 1.00 24.94 C ATOM 882 OH TYR A 109 23.730 35.782 -10.335 1.00 26.26 O ATOM 0 H TYR A 109 20.895 39.716 -14.528 1.00 18.07 H new ATOM 0 HA TYR A 109 21.515 37.633 -15.908 1.00 17.23 H new ATOM 0 HB2 TYR A 109 19.403 38.049 -14.064 1.00 16.61 H new ATOM 0 HB3 TYR A 109 19.600 36.643 -14.710 1.00 16.61 H new ATOM 0 HD1 TYR A 109 22.771 37.569 -14.283 1.00 23.21 H new ATOM 0 HD2 TYR A 109 19.624 36.325 -12.012 1.00 21.56 H new ATOM 0 HE1 TYR A 109 24.265 36.929 -12.569 1.00 25.12 H new ATOM 0 HE2 TYR A 109 21.159 35.680 -10.295 1.00 23.07 H new ATOM 0 HH TYR A 109 23.307 35.432 -9.700 1.00 26.26 H new ATOM 883 N ALA A 110 18.622 38.850 -16.658 1.00 17.25 N ATOM 884 CA ALA A 110 17.542 38.699 -17.647 1.00 17.89 C ATOM 885 C ALA A 110 18.082 39.155 -18.983 1.00 17.57 C ATOM 886 O ALA A 110 17.852 38.524 -20.034 1.00 19.46 O ATOM 887 CB ALA A 110 16.333 39.625 -17.212 1.00 17.37 C ATOM 0 H ALA A 110 18.507 39.457 -16.060 1.00 17.25 H new ATOM 0 HA ALA A 110 17.238 37.780 -17.705 1.00 17.89 H new ATOM 0 HB1 ALA A 110 15.611 39.538 -17.854 1.00 17.37 H new ATOM 0 HB2 ALA A 110 16.019 39.357 -16.334 1.00 17.37 H new ATOM 0 HB3 ALA A 110 16.627 40.549 -17.181 1.00 17.37 H new ATOM 888 N LEU A 111 18.780 40.273 -18.981 1.00 15.84 N ATOM 889 CA LEU A 111 19.278 40.844 -20.261 1.00 18.42 C ATOM 890 C LEU A 111 20.121 39.846 -21.060 1.00 18.32 C ATOM 891 O LEU A 111 19.892 39.696 -22.269 1.00 18.19 O ATOM 892 CB LEU A 111 20.121 42.141 -19.971 1.00 17.94 C ATOM 893 CG LEU A 111 20.889 42.841 -21.134 1.00 24.48 C ATOM 894 CD1 LEU A 111 19.962 43.149 -22.311 1.00 23.66 C ATOM 895 CD2 LEU A 111 21.471 44.125 -20.613 1.00 22.68 C ATOM 0 H LEU A 111 18.983 40.723 -18.277 1.00 15.84 H new ATOM 0 HA LEU A 111 18.502 41.062 -20.801 1.00 18.42 H new ATOM 0 HB2 LEU A 111 19.520 42.797 -19.585 1.00 17.94 H new ATOM 0 HB3 LEU A 111 20.772 41.916 -19.288 1.00 17.94 H new ATOM 0 HG LEU A 111 21.586 42.246 -21.451 1.00 24.48 H new ATOM 0 HD11 LEU A 111 20.467 43.583 -23.016 1.00 23.66 H new ATOM 0 HD12 LEU A 111 19.581 42.323 -22.648 1.00 23.66 H new ATOM 0 HD13 LEU A 111 19.249 43.737 -22.016 1.00 23.66 H new ATOM 0 HD21 LEU A 111 21.953 44.574 -21.325 1.00 22.68 H new ATOM 0 HD22 LEU A 111 20.757 44.699 -20.295 1.00 22.68 H new ATOM 0 HD23 LEU A 111 22.080 43.932 -19.883 1.00 22.68 H new ATOM 896 N GLU A 112 21.091 39.181 -20.406 1.00 20.02 N ATOM 897 CA GLU A 112 21.965 38.286 -21.172 1.00 20.91 C ATOM 898 C GLU A 112 21.179 37.134 -21.743 1.00 21.21 C ATOM 899 O GLU A 112 21.495 36.622 -22.862 1.00 20.69 O ATOM 900 CB GLU A 112 23.140 37.795 -20.319 1.00 22.24 C ATOM 901 CG GLU A 112 23.948 38.971 -19.670 1.00 24.54 C ATOM 902 CD GLU A 112 24.394 40.137 -20.674 1.00 37.51 C ATOM 903 OE1 GLU A 112 24.600 41.321 -20.280 1.00 42.48 O ATOM 904 OE2 GLU A 112 24.560 39.903 -21.869 1.00 37.34 O ATOM 0 H GLU A 112 21.251 39.232 -19.563 1.00 20.02 H new ATOM 0 HA GLU A 112 22.337 38.789 -21.913 1.00 20.91 H new ATOM 0 HB2 GLU A 112 22.806 37.212 -19.619 1.00 22.24 H new ATOM 0 HB3 GLU A 112 23.736 37.264 -20.870 1.00 22.24 H new ATOM 0 HG2 GLU A 112 23.410 39.362 -18.964 1.00 24.54 H new ATOM 0 HG3 GLU A 112 24.742 38.605 -19.251 1.00 24.54 H new ATOM 905 N ALA A 113 20.127 36.690 -21.039 1.00 19.91 N ATOM 906 CA ALA A 113 19.322 35.599 -21.615 1.00 17.64 C ATOM 907 C ALA A 113 18.385 36.089 -22.708 1.00 17.91 C ATOM 908 O ALA A 113 18.171 35.351 -23.656 1.00 17.88 O ATOM 909 CB ALA A 113 18.529 34.933 -20.482 1.00 18.65 C ATOM 0 H ALA A 113 19.873 36.985 -20.272 1.00 19.91 H new ATOM 0 HA ALA A 113 19.919 34.959 -22.033 1.00 17.64 H new ATOM 0 HB1 ALA A 113 17.992 34.211 -20.844 1.00 18.65 H new ATOM 0 HB2 ALA A 113 19.144 34.578 -19.821 1.00 18.65 H new ATOM 0 HB3 ALA A 113 17.949 35.589 -20.064 1.00 18.65 H new ATOM 910 N GLU A 114 17.807 37.296 -22.607 1.00 17.66 N ATOM 911 CA GLU A 114 16.941 37.730 -23.695 1.00 19.97 C ATOM 912 C GLU A 114 17.701 37.847 -25.036 1.00 18.01 C ATOM 913 O GLU A 114 17.083 37.667 -26.119 1.00 18.21 O ATOM 914 CB GLU A 114 16.272 39.082 -23.382 1.00 19.73 C ATOM 915 CG GLU A 114 15.794 39.251 -21.912 1.00 21.74 C ATOM 916 CD GLU A 114 14.851 38.176 -21.360 1.00 19.79 C ATOM 917 OE1 GLU A 114 14.331 38.492 -20.207 1.00 15.77 O ATOM 918 OE2 GLU A 114 14.559 37.144 -22.042 1.00 20.61 O ATOM 0 H GLU A 114 17.900 37.846 -21.953 1.00 17.66 H new ATOM 0 HA GLU A 114 16.260 37.045 -23.781 1.00 19.97 H new ATOM 0 HB2 GLU A 114 16.898 39.793 -23.589 1.00 19.73 H new ATOM 0 HB3 GLU A 114 15.510 39.195 -23.971 1.00 19.73 H new ATOM 0 HG2 GLU A 114 16.578 39.286 -21.342 1.00 21.74 H new ATOM 0 HG3 GLU A 114 15.350 40.110 -21.836 1.00 21.74 H new ATOM 919 N LYS A 115 19.008 38.142 -24.953 1.00 17.79 N ATOM 920 CA LYS A 115 19.840 38.153 -26.181 1.00 17.14 C ATOM 921 C LYS A 115 19.768 36.827 -26.957 1.00 18.60 C ATOM 922 O LYS A 115 19.634 36.754 -28.199 1.00 19.52 O ATOM 923 CB LYS A 115 21.305 38.490 -25.845 1.00 19.53 C ATOM 924 CG LYS A 115 21.440 39.855 -25.391 1.00 20.79 C ATOM 925 CD LYS A 115 22.897 40.219 -25.004 1.00 26.58 C ATOM 926 CE LYS A 115 22.881 41.678 -24.473 1.00 27.19 C ATOM 927 NZ LYS A 115 24.316 42.056 -24.194 1.00 31.93 N ATOM 0 H LYS A 115 19.424 38.333 -24.225 1.00 17.79 H new ATOM 0 HA LYS A 115 19.475 38.844 -26.756 1.00 17.14 H new ATOM 0 HB2 LYS A 115 21.629 37.885 -25.159 1.00 19.53 H new ATOM 0 HB3 LYS A 115 21.859 38.352 -26.629 1.00 19.53 H new ATOM 0 HG2 LYS A 115 21.136 40.455 -26.090 1.00 20.79 H new ATOM 0 HG3 LYS A 115 20.862 39.995 -24.625 1.00 20.79 H new ATOM 0 HD2 LYS A 115 23.233 39.612 -24.326 1.00 26.58 H new ATOM 0 HD3 LYS A 115 23.485 40.141 -25.772 1.00 26.58 H new ATOM 0 HE2 LYS A 115 22.488 42.278 -25.126 1.00 27.19 H new ATOM 0 HE3 LYS A 115 22.345 41.745 -23.668 1.00 27.19 H new ATOM 0 HZ1 LYS A 115 24.358 42.916 -23.970 1.00 31.93 H new ATOM 0 HZ2 LYS A 115 24.629 41.560 -23.525 1.00 31.93 H new ATOM 0 HZ3 LYS A 115 24.807 41.915 -24.923 1.00 31.93 H new ATOM 928 N ILE A 116 19.843 35.746 -26.210 1.00 17.98 N ATOM 929 CA ILE A 116 19.779 34.401 -26.751 1.00 19.99 C ATOM 930 C ILE A 116 18.392 34.063 -27.238 1.00 19.89 C ATOM 931 O ILE A 116 18.173 33.558 -28.404 1.00 17.72 O ATOM 932 CB ILE A 116 20.159 33.370 -25.633 1.00 18.14 C ATOM 933 CG1 ILE A 116 21.611 33.618 -25.185 1.00 25.52 C ATOM 934 CG2 ILE A 116 19.986 31.912 -26.130 1.00 18.75 C ATOM 935 CD1 ILE A 116 22.568 33.593 -26.335 1.00 37.04 C ATOM 0 H ILE A 116 19.935 35.770 -25.355 1.00 17.98 H new ATOM 0 HA ILE A 116 20.398 34.357 -27.497 1.00 19.99 H new ATOM 0 HB ILE A 116 19.561 33.494 -24.879 1.00 18.14 H new ATOM 0 HG12 ILE A 116 21.668 34.477 -24.737 1.00 25.52 H new ATOM 0 HG13 ILE A 116 21.868 32.943 -24.537 1.00 25.52 H new ATOM 0 HG21 ILE A 116 20.228 31.297 -25.420 1.00 18.75 H new ATOM 0 HG22 ILE A 116 19.062 31.764 -26.385 1.00 18.75 H new ATOM 0 HG23 ILE A 116 20.560 31.761 -26.897 1.00 18.75 H new ATOM 0 HD11 ILE A 116 23.468 33.753 -26.011 1.00 37.04 H new ATOM 0 HD12 ILE A 116 22.530 32.726 -26.769 1.00 37.04 H new ATOM 0 HD13 ILE A 116 22.327 34.284 -26.972 1.00 37.04 H new ATOM 936 N HIS A 117 17.396 34.427 -26.409 1.00 17.43 N ATOM 937 CA HIS A 117 15.988 34.160 -26.879 1.00 18.44 C ATOM 938 C HIS A 117 15.660 34.798 -28.223 1.00 16.92 C ATOM 939 O HIS A 117 15.067 34.167 -29.066 1.00 18.30 O ATOM 940 CB HIS A 117 14.985 34.707 -25.797 1.00 14.70 C ATOM 941 CG HIS A 117 15.135 34.062 -24.466 1.00 16.49 C ATOM 942 ND1 HIS A 117 14.542 34.594 -23.316 1.00 13.57 N ATOM 943 CD2 HIS A 117 15.874 32.986 -24.087 1.00 17.23 C ATOM 944 CE1 HIS A 117 14.950 33.847 -22.296 1.00 14.65 C ATOM 945 NE2 HIS A 117 15.727 32.857 -22.731 1.00 17.98 N ATOM 0 H HIS A 117 17.483 34.797 -25.637 1.00 17.43 H new ATOM 0 HA HIS A 117 15.906 33.201 -26.998 1.00 18.44 H new ATOM 0 HB2 HIS A 117 15.115 35.663 -25.701 1.00 14.70 H new ATOM 0 HB3 HIS A 117 14.077 34.574 -26.112 1.00 14.70 H new ATOM 0 HD2 HIS A 117 16.383 32.441 -24.643 1.00 17.23 H new ATOM 0 HE1 HIS A 117 14.725 33.994 -21.406 1.00 14.65 H new ATOM 0 HE2 HIS A 117 16.077 32.241 -22.243 1.00 17.98 H new ATOM 946 N ALA A 118 16.048 36.026 -28.424 1.00 19.09 N ATOM 947 CA ALA A 118 15.699 36.750 -29.647 1.00 19.85 C ATOM 948 C ALA A 118 16.316 35.941 -30.815 1.00 22.39 C ATOM 949 O ALA A 118 15.634 35.663 -31.841 1.00 24.40 O ATOM 950 CB ALA A 118 16.330 38.200 -29.644 1.00 20.46 C ATOM 0 H ALA A 118 16.521 36.478 -27.866 1.00 19.09 H new ATOM 0 HA ALA A 118 14.737 36.843 -29.725 1.00 19.85 H new ATOM 0 HB1 ALA A 118 16.086 38.661 -30.462 1.00 20.46 H new ATOM 0 HB2 ALA A 118 15.995 38.697 -28.881 1.00 20.46 H new ATOM 0 HB3 ALA A 118 17.296 38.133 -29.587 1.00 20.46 H new ATOM 951 N GLU A 119 17.578 35.529 -30.625 1.00 20.96 N ATOM 952 CA GLU A 119 18.260 34.838 -31.740 1.00 23.94 C ATOM 953 C GLU A 119 17.628 33.438 -32.067 1.00 23.31 C ATOM 954 O GLU A 119 17.407 33.080 -33.264 1.00 24.57 O ATOM 955 CB GLU A 119 19.739 34.728 -31.411 1.00 24.42 C ATOM 956 CG GLU A 119 20.467 34.023 -32.528 1.00 35.07 C ATOM 957 CD GLU A 119 20.406 34.830 -33.848 1.00 44.94 C ATOM 958 OE1 GLU A 119 20.234 36.111 -33.838 1.00 46.50 O ATOM 959 OE2 GLU A 119 20.477 34.150 -34.894 1.00 52.01 O ATOM 0 H GLU A 119 18.037 35.630 -29.905 1.00 20.96 H new ATOM 0 HA GLU A 119 18.144 35.363 -32.547 1.00 23.94 H new ATOM 0 HB2 GLU A 119 20.115 35.612 -31.278 1.00 24.42 H new ATOM 0 HB3 GLU A 119 19.858 34.241 -30.580 1.00 24.42 H new ATOM 0 HG2 GLU A 119 21.393 33.885 -32.275 1.00 35.07 H new ATOM 0 HG3 GLU A 119 20.077 33.146 -32.666 1.00 35.07 H new ATOM 960 N LEU A 120 17.295 32.682 -31.009 1.00 21.38 N ATOM 961 CA LEU A 120 16.604 31.348 -31.162 1.00 21.11 C ATOM 962 C LEU A 120 15.290 31.478 -31.875 1.00 22.12 C ATOM 963 O LEU A 120 14.939 30.646 -32.752 1.00 22.42 O ATOM 964 CB LEU A 120 16.448 30.690 -29.792 1.00 20.98 C ATOM 965 CG LEU A 120 17.758 30.250 -29.058 1.00 19.91 C ATOM 966 CD1 LEU A 120 17.434 29.637 -27.723 1.00 23.32 C ATOM 967 CD2 LEU A 120 18.515 29.215 -29.970 1.00 25.88 C ATOM 0 H LEU A 120 17.452 32.906 -30.194 1.00 21.38 H new ATOM 0 HA LEU A 120 17.156 30.775 -31.717 1.00 21.11 H new ATOM 0 HB2 LEU A 120 15.972 31.307 -29.214 1.00 20.98 H new ATOM 0 HB3 LEU A 120 15.884 29.907 -29.897 1.00 20.98 H new ATOM 0 HG LEU A 120 18.322 31.023 -28.899 1.00 19.91 H new ATOM 0 HD11 LEU A 120 18.255 29.370 -27.281 1.00 23.32 H new ATOM 0 HD12 LEU A 120 16.968 30.286 -27.173 1.00 23.32 H new ATOM 0 HD13 LEU A 120 16.869 28.859 -27.852 1.00 23.32 H new ATOM 0 HD21 LEU A 120 19.331 28.931 -29.529 1.00 25.88 H new ATOM 0 HD22 LEU A 120 17.947 28.444 -30.125 1.00 25.88 H new ATOM 0 HD23 LEU A 120 18.734 29.631 -30.819 1.00 25.88 H new ATOM 968 N TYR A 121 14.509 32.518 -31.519 1.00 22.21 N ATOM 969 CA TYR A 121 13.206 32.707 -32.202 1.00 21.74 C ATOM 970 C TYR A 121 13.381 33.134 -33.682 1.00 25.36 C ATOM 971 O TYR A 121 12.592 32.730 -34.576 1.00 22.06 O ATOM 972 CB TYR A 121 12.330 33.764 -31.471 1.00 23.00 C ATOM 973 CG TYR A 121 11.731 33.241 -30.141 1.00 17.99 C ATOM 974 CD1 TYR A 121 11.451 34.157 -29.088 1.00 23.18 C ATOM 975 CD2 TYR A 121 11.383 31.903 -29.975 1.00 19.52 C ATOM 976 CE1 TYR A 121 10.974 33.695 -27.862 1.00 19.00 C ATOM 977 CE2 TYR A 121 10.845 31.408 -28.748 1.00 21.51 C ATOM 978 CZ TYR A 121 10.638 32.359 -27.700 1.00 22.10 C ATOM 979 OH TYR A 121 10.057 31.890 -26.522 1.00 21.45 O ATOM 0 H TYR A 121 14.701 33.100 -30.915 1.00 22.21 H new ATOM 0 HA TYR A 121 12.760 31.846 -32.177 1.00 21.74 H new ATOM 0 HB2 TYR A 121 12.866 34.552 -31.290 1.00 23.00 H new ATOM 0 HB3 TYR A 121 11.609 34.040 -32.058 1.00 23.00 H new ATOM 0 HD1 TYR A 121 11.587 35.068 -29.218 1.00 23.18 H new ATOM 0 HD2 TYR A 121 11.505 31.314 -30.684 1.00 19.52 H new ATOM 0 HE1 TYR A 121 10.881 34.285 -27.150 1.00 19.00 H new ATOM 0 HE2 TYR A 121 10.639 30.508 -28.636 1.00 21.51 H new ATOM 0 HH TYR A 121 9.837 32.541 -26.039 1.00 21.45 H new ATOM 980 N ARG A 122 14.386 33.977 -33.934 1.00 24.38 N ATOM 981 CA ARG A 122 14.687 34.325 -35.355 1.00 26.90 C ATOM 982 C ARG A 122 15.024 33.053 -36.129 1.00 26.60 C ATOM 983 O ARG A 122 14.468 32.894 -37.257 1.00 28.08 O ATOM 984 CB ARG A 122 15.901 35.274 -35.420 1.00 27.33 C ATOM 985 CG ARG A 122 15.627 36.735 -35.211 1.00 35.08 C ATOM 986 CD ARG A 122 17.047 37.570 -35.238 1.00 36.31 C ATOM 987 NE ARG A 122 16.857 38.741 -34.398 1.00 43.94 N ATOM 988 CZ ARG A 122 17.532 39.058 -33.278 1.00 48.64 C ATOM 989 NH1 ARG A 122 17.174 40.181 -32.606 1.00 52.43 N ATOM 990 NH2 ARG A 122 18.591 38.333 -32.837 1.00 48.71 N ATOM 0 H ARG A 122 14.888 34.347 -33.342 1.00 24.38 H new ATOM 0 HA ARG A 122 13.911 34.759 -35.742 1.00 26.90 H new ATOM 0 HB2 ARG A 122 16.545 34.988 -34.753 1.00 27.33 H new ATOM 0 HB3 ARG A 122 16.324 35.166 -36.286 1.00 27.33 H new ATOM 0 HG2 ARG A 122 15.033 37.065 -35.904 1.00 35.08 H new ATOM 0 HG3 ARG A 122 15.177 36.871 -34.363 1.00 35.08 H new ATOM 0 HD2 ARG A 122 17.775 37.022 -34.906 1.00 36.31 H new ATOM 0 HD3 ARG A 122 17.277 37.829 -36.144 1.00 36.31 H new ATOM 0 HE ARG A 122 16.245 39.293 -34.644 1.00 43.94 H new ATOM 0 HH11 ARG A 122 16.530 40.670 -32.898 1.00 52.43 H new ATOM 0 HH12 ARG A 122 17.591 40.404 -31.888 1.00 52.43 H new ATOM 0 HH21 ARG A 122 18.853 37.643 -33.278 1.00 48.71 H new ATOM 0 HH22 ARG A 122 19.000 38.564 -32.117 1.00 48.71 H new ATOM 991 N LYS A 123 15.865 32.154 -35.559 1.00 27.87 N ATOM 992 CA LYS A 123 16.279 30.889 -36.254 1.00 29.83 C ATOM 993 C LYS A 123 15.041 29.998 -36.440 1.00 30.10 C ATOM 994 O LYS A 123 14.748 29.503 -37.546 1.00 27.24 O ATOM 995 CB LYS A 123 17.366 30.108 -35.493 1.00 30.41 C ATOM 996 CG LYS A 123 18.750 30.709 -35.629 1.00 38.07 C ATOM 997 CD LYS A 123 19.742 30.196 -34.559 1.00 45.67 C ATOM 998 CE LYS A 123 21.144 30.636 -35.053 1.00 53.28 C ATOM 999 NZ LYS A 123 22.349 30.068 -34.338 1.00 55.94 N ATOM 0 H LYS A 123 16.207 32.252 -34.776 1.00 27.87 H new ATOM 0 HA LYS A 123 16.663 31.139 -37.109 1.00 29.83 H new ATOM 0 HB2 LYS A 123 17.129 30.070 -34.553 1.00 30.41 H new ATOM 0 HB3 LYS A 123 17.385 29.194 -35.818 1.00 30.41 H new ATOM 0 HG2 LYS A 123 19.100 30.506 -36.511 1.00 38.07 H new ATOM 0 HG3 LYS A 123 18.685 31.675 -35.565 1.00 38.07 H new ATOM 0 HD2 LYS A 123 19.543 30.574 -33.688 1.00 45.67 H new ATOM 0 HD3 LYS A 123 19.690 29.232 -34.468 1.00 45.67 H new ATOM 0 HE2 LYS A 123 21.217 30.403 -35.992 1.00 53.28 H new ATOM 0 HE3 LYS A 123 21.191 31.603 -34.996 1.00 53.28 H new ATOM 0 HZ1 LYS A 123 23.092 30.390 -34.707 1.00 55.94 H new ATOM 0 HZ2 LYS A 123 22.321 30.298 -33.479 1.00 55.94 H new ATOM 0 HZ3 LYS A 123 22.344 29.181 -34.407 1.00 55.94 H new ATOM 1000 N ALA A 124 14.236 29.862 -35.368 1.00 27.48 N ATOM 1001 CA ALA A 124 12.987 29.090 -35.462 1.00 27.82 C ATOM 1002 C ALA A 124 11.994 29.587 -36.531 1.00 28.10 C ATOM 1003 O ALA A 124 11.356 28.768 -37.230 1.00 28.10 O ATOM 1004 CB ALA A 124 12.260 29.071 -34.112 1.00 27.22 C ATOM 0 H ALA A 124 14.394 30.203 -34.594 1.00 27.48 H new ATOM 0 HA ALA A 124 13.273 28.202 -35.729 1.00 27.82 H new ATOM 0 HB1 ALA A 124 11.440 28.559 -34.193 1.00 27.22 H new ATOM 0 HB2 ALA A 124 12.831 28.663 -33.442 1.00 27.22 H new ATOM 0 HB3 ALA A 124 12.048 29.979 -33.846 1.00 27.22 H new ATOM 1005 N LYS A 125 11.791 30.901 -36.620 1.00 26.50 N ATOM 1006 CA LYS A 125 10.848 31.456 -37.568 1.00 27.89 C ATOM 1007 C LYS A 125 11.215 31.165 -39.058 1.00 30.86 C ATOM 1008 O LYS A 125 10.324 30.914 -39.909 1.00 28.54 O ATOM 1009 CB LYS A 125 10.744 32.958 -37.383 1.00 26.22 C ATOM 1010 CG LYS A 125 9.656 33.535 -38.200 1.00 27.53 C ATOM 1011 CD LYS A 125 9.455 35.043 -38.008 1.00 26.30 C ATOM 1012 CE LYS A 125 8.434 35.505 -39.037 1.00 29.95 C ATOM 1013 NZ LYS A 125 8.483 36.998 -39.204 1.00 29.51 N ATOM 0 H LYS A 125 12.195 31.485 -36.135 1.00 26.50 H new ATOM 0 HA LYS A 125 10.001 31.020 -37.384 1.00 27.89 H new ATOM 0 HB2 LYS A 125 10.588 33.159 -36.447 1.00 26.22 H new ATOM 0 HB3 LYS A 125 11.586 33.373 -37.626 1.00 26.22 H new ATOM 0 HG2 LYS A 125 9.841 33.361 -39.136 1.00 27.53 H new ATOM 0 HG3 LYS A 125 8.827 33.079 -37.985 1.00 27.53 H new ATOM 0 HD2 LYS A 125 9.144 35.234 -37.109 1.00 26.30 H new ATOM 0 HD3 LYS A 125 10.294 35.516 -38.124 1.00 26.30 H new ATOM 0 HE2 LYS A 125 8.609 35.074 -39.888 1.00 29.95 H new ATOM 0 HE3 LYS A 125 7.544 35.235 -38.760 1.00 29.95 H new ATOM 0 HZ1 LYS A 125 7.670 37.302 -39.400 1.00 29.51 H new ATOM 0 HZ2 LYS A 125 8.765 37.372 -38.447 1.00 29.51 H new ATOM 0 HZ3 LYS A 125 9.043 37.205 -39.864 1.00 29.51 H new ATOM 1014 N GLU A 126 12.514 31.240 -39.326 1.00 32.27 N ATOM 1015 CA GLU A 126 13.060 30.871 -40.673 1.00 35.85 C ATOM 1016 C GLU A 126 12.555 29.515 -41.085 1.00 35.91 C ATOM 1017 O GLU A 126 12.148 29.319 -42.227 1.00 39.27 O ATOM 1018 CB GLU A 126 14.600 30.847 -40.658 1.00 36.23 C ATOM 1019 CG GLU A 126 15.267 32.235 -40.485 1.00 44.42 C ATOM 1020 CD GLU A 126 16.821 32.156 -40.344 1.00 56.57 C ATOM 1021 OE1 GLU A 126 17.447 31.549 -41.242 1.00 59.83 O ATOM 1022 OE2 GLU A 126 17.417 32.677 -39.352 1.00 59.31 O ATOM 0 H GLU A 126 13.108 31.498 -38.760 1.00 32.27 H new ATOM 0 HA GLU A 126 12.760 31.541 -41.307 1.00 35.85 H new ATOM 0 HB2 GLU A 126 14.895 30.268 -39.938 1.00 36.23 H new ATOM 0 HB3 GLU A 126 14.913 30.452 -41.487 1.00 36.23 H new ATOM 0 HG2 GLU A 126 15.045 32.792 -41.248 1.00 44.42 H new ATOM 0 HG3 GLU A 126 14.898 32.669 -39.700 1.00 44.42 H new ATOM 1023 N LYS A 127 12.602 28.564 -40.183 1.00 35.92 N ATOM 1024 CA LYS A 127 12.084 27.235 -40.470 1.00 36.57 C ATOM 1025 C LYS A 127 10.581 27.168 -40.495 1.00 37.56 C ATOM 1026 O LYS A 127 10.015 26.623 -41.447 1.00 37.19 O ATOM 1027 CB LYS A 127 12.662 26.228 -39.528 1.00 36.36 C ATOM 1028 CG LYS A 127 14.134 25.836 -39.901 1.00 42.23 C ATOM 1029 CD LYS A 127 14.925 25.645 -38.611 1.00 48.11 C ATOM 1030 CE LYS A 127 16.305 24.881 -38.773 1.00 53.58 C ATOM 1031 NZ LYS A 127 16.583 23.953 -37.563 1.00 53.73 N ATOM 0 H LYS A 127 12.929 28.660 -39.394 1.00 35.92 H new ATOM 0 HA LYS A 127 12.369 27.018 -41.371 1.00 36.57 H new ATOM 0 HB2 LYS A 127 12.644 26.585 -38.626 1.00 36.36 H new ATOM 0 HB3 LYS A 127 12.108 25.432 -39.530 1.00 36.36 H new ATOM 0 HG2 LYS A 127 14.143 25.020 -40.426 1.00 42.23 H new ATOM 0 HG3 LYS A 127 14.540 26.528 -40.446 1.00 42.23 H new ATOM 0 HD2 LYS A 127 15.098 26.517 -38.222 1.00 48.11 H new ATOM 0 HD3 LYS A 127 14.374 25.157 -37.979 1.00 48.11 H new ATOM 0 HE2 LYS A 127 16.292 24.357 -39.589 1.00 53.58 H new ATOM 0 HE3 LYS A 127 17.025 25.525 -38.861 1.00 53.58 H new ATOM 0 HZ1 LYS A 127 17.462 23.872 -37.446 1.00 53.73 H new ATOM 0 HZ2 LYS A 127 16.217 24.302 -36.831 1.00 53.73 H new ATOM 0 HZ3 LYS A 127 16.230 23.151 -37.717 1.00 53.73 H new ATOM 1032 N ALA A 128 9.918 27.709 -39.458 1.00 35.10 N ATOM 1033 CA ALA A 128 8.455 27.739 -39.414 1.00 35.90 C ATOM 1034 C ALA A 128 7.762 28.334 -40.660 1.00 37.06 C ATOM 1035 O ALA A 128 6.848 27.746 -41.179 1.00 34.95 O ATOM 1036 CB ALA A 128 7.947 28.469 -38.089 1.00 34.73 C ATOM 0 H ALA A 128 10.302 28.062 -38.774 1.00 35.10 H new ATOM 0 HA ALA A 128 8.191 26.806 -39.407 1.00 35.90 H new ATOM 0 HB1 ALA A 128 6.977 28.480 -38.077 1.00 34.73 H new ATOM 0 HB2 ALA A 128 8.275 27.992 -37.311 1.00 34.73 H new ATOM 0 HB3 ALA A 128 8.280 29.380 -38.073 1.00 34.73 H new ATOM 1037 N GLU A 129 8.200 29.507 -41.119 1.00 38.71 N ATOM 1038 CA GLU A 129 7.519 30.225 -42.175 1.00 42.04 C ATOM 1039 C GLU A 129 7.552 29.479 -43.567 1.00 42.87 C ATOM 1040 O GLU A 129 6.821 29.878 -44.483 1.00 43.45 O ATOM 1041 CB GLU A 129 8.135 31.630 -42.310 1.00 41.54 C ATOM 1042 CG GLU A 129 7.140 32.731 -42.648 1.00 49.21 C ATOM 1043 CD GLU A 129 7.723 34.160 -42.598 1.00 57.21 C ATOM 1044 OE1 GLU A 129 8.983 34.294 -42.557 1.00 60.20 O ATOM 1045 OE2 GLU A 129 6.916 35.150 -42.618 1.00 57.87 O ATOM 0 H GLU A 129 8.903 29.903 -40.821 1.00 38.71 H new ATOM 0 HA GLU A 129 6.584 30.284 -41.924 1.00 42.04 H new ATOM 0 HB2 GLU A 129 8.579 31.856 -41.478 1.00 41.54 H new ATOM 0 HB3 GLU A 129 8.818 31.606 -42.998 1.00 41.54 H new ATOM 0 HG2 GLU A 129 6.786 32.569 -43.537 1.00 49.21 H new ATOM 0 HG3 GLU A 129 6.393 32.677 -42.031 1.00 49.21 H new ATOM 1046 N LYS A 130 8.372 28.421 -43.678 1.00 43.76 N ATOM 1047 CA LYS A 130 8.472 27.443 -44.814 1.00 44.63 C ATOM 1048 C LYS A 130 7.863 26.088 -44.469 1.00 45.46 C ATOM 1049 O LYS A 130 8.225 25.057 -45.045 1.00 45.78 O ATOM 1050 CB LYS A 130 9.934 27.157 -45.110 1.00 44.68 C ATOM 1051 CG LYS A 130 10.625 28.240 -45.965 1.00 47.66 C ATOM 1052 CD LYS A 130 12.142 28.181 -45.860 1.00 53.83 C ATOM 1053 CE LYS A 130 12.577 26.765 -45.433 1.00 55.73 C ATOM 1054 NZ LYS A 130 14.025 26.681 -45.122 1.00 57.56 N ATOM 0 H LYS A 130 8.930 28.232 -43.052 1.00 43.76 H new ATOM 0 HA LYS A 130 8.001 27.846 -45.560 1.00 44.63 H new ATOM 0 HB2 LYS A 130 10.412 27.066 -44.271 1.00 44.68 H new ATOM 0 HB3 LYS A 130 10.001 26.305 -45.568 1.00 44.68 H new ATOM 0 HG2 LYS A 130 10.363 28.132 -46.893 1.00 47.66 H new ATOM 0 HG3 LYS A 130 10.318 29.116 -45.683 1.00 47.66 H new ATOM 0 HD2 LYS A 130 12.543 28.409 -46.713 1.00 53.83 H new ATOM 0 HD3 LYS A 130 12.456 28.834 -45.215 1.00 53.83 H new ATOM 0 HE2 LYS A 130 12.066 26.495 -44.654 1.00 55.73 H new ATOM 0 HE3 LYS A 130 12.365 26.138 -46.142 1.00 55.73 H new ATOM 0 HZ1 LYS A 130 14.229 25.849 -44.881 1.00 57.56 H new ATOM 0 HZ2 LYS A 130 14.497 26.906 -45.842 1.00 57.56 H new ATOM 0 HZ3 LYS A 130 14.219 27.238 -44.455 1.00 57.56 H new ATOM 1055 N GLY A 131 7.015 26.057 -43.443 1.00 44.98 N ATOM 1056 CA GLY A 131 6.435 24.791 -42.999 1.00 42.44 C ATOM 1057 C GLY A 131 7.293 23.740 -42.345 1.00 42.56 C ATOM 1058 O GLY A 131 6.885 22.609 -42.263 1.00 43.94 O ATOM 0 H GLY A 131 6.765 26.748 -42.996 1.00 44.98 H new ATOM 0 HA2 GLY A 131 5.723 25.006 -42.377 1.00 42.44 H new ATOM 0 HA3 GLY A 131 6.020 24.380 -43.773 1.00 42.44 H new ATOM 1059 N GLU A 132 8.485 24.054 -41.851 1.00 41.19 N ATOM 1060 CA GLU A 132 9.294 23.033 -41.252 1.00 40.23 C ATOM 1061 C GLU A 132 9.430 23.336 -39.754 1.00 38.76 C ATOM 1062 O GLU A 132 9.385 24.499 -39.337 1.00 36.05 O ATOM 1063 CB GLU A 132 10.672 23.018 -41.914 1.00 42.63 C ATOM 1064 CG GLU A 132 10.557 22.965 -43.494 1.00 47.72 C ATOM 1065 CD GLU A 132 11.908 23.119 -44.223 1.00 55.75 C ATOM 1066 OE1 GLU A 132 11.885 23.327 -45.472 1.00 59.03 O ATOM 1067 OE2 GLU A 132 12.979 23.044 -43.560 1.00 56.05 O ATOM 0 H GLU A 132 8.830 24.842 -41.857 1.00 41.19 H new ATOM 0 HA GLU A 132 8.882 22.163 -41.373 1.00 40.23 H new ATOM 0 HB2 GLU A 132 11.167 23.809 -41.651 1.00 42.63 H new ATOM 0 HB3 GLU A 132 11.175 22.251 -41.599 1.00 42.63 H new ATOM 0 HG2 GLU A 132 10.154 22.121 -43.752 1.00 47.72 H new ATOM 0 HG3 GLU A 132 9.958 23.668 -43.790 1.00 47.72 H new ATOM 1068 N ASP A 133 9.538 22.256 -38.997 1.00 37.47 N ATOM 1069 CA ASP A 133 9.907 22.300 -37.572 1.00 36.99 C ATOM 1070 C ASP A 133 11.410 22.518 -37.415 1.00 37.61 C ATOM 1071 O ASP A 133 12.192 22.278 -38.343 1.00 39.62 O ATOM 1072 CB ASP A 133 9.455 21.019 -36.874 1.00 35.82 C ATOM 1073 CG ASP A 133 9.332 21.190 -35.388 1.00 33.86 C ATOM 1074 OD1 ASP A 133 9.080 20.171 -34.753 1.00 33.17 O ATOM 1075 OD2 ASP A 133 9.492 22.331 -34.853 1.00 32.78 O ATOM 0 H ASP A 133 9.399 21.460 -39.292 1.00 37.47 H new ATOM 0 HA ASP A 133 9.455 23.048 -37.152 1.00 36.99 H new ATOM 0 HB2 ASP A 133 8.600 20.740 -37.237 1.00 35.82 H new ATOM 0 HB3 ASP A 133 10.088 20.309 -37.064 1.00 35.82 H new ATOM 1076 N ILE A 134 11.840 23.026 -36.282 1.00 36.26 N ATOM 1077 CA ILE A 134 13.262 23.141 -36.048 1.00 35.30 C ATOM 1078 C ILE A 134 13.715 21.763 -35.623 1.00 36.51 C ATOM 1079 O ILE A 134 12.911 20.895 -35.203 1.00 35.17 O ATOM 1080 CB ILE A 134 13.620 24.244 -34.986 1.00 35.46 C ATOM 1081 CG1 ILE A 134 13.001 23.871 -33.620 1.00 32.52 C ATOM 1082 CG2 ILE A 134 13.093 25.564 -35.470 1.00 31.86 C ATOM 1083 CD1 ILE A 134 13.292 24.951 -32.578 1.00 33.84 C ATOM 0 H ILE A 134 11.337 23.307 -35.644 1.00 36.26 H new ATOM 0 HA ILE A 134 13.722 23.433 -36.850 1.00 35.30 H new ATOM 0 HB ILE A 134 14.582 24.307 -34.874 1.00 35.46 H new ATOM 0 HG12 ILE A 134 12.042 23.757 -33.715 1.00 32.52 H new ATOM 0 HG13 ILE A 134 13.359 23.021 -33.319 1.00 32.52 H new ATOM 0 HG21 ILE A 134 13.307 26.255 -34.824 1.00 31.86 H new ATOM 0 HG22 ILE A 134 13.501 25.782 -36.323 1.00 31.86 H new ATOM 0 HG23 ILE A 134 12.130 25.509 -35.577 1.00 31.86 H new ATOM 0 HD11 ILE A 134 12.895 24.698 -31.730 1.00 33.84 H new ATOM 0 HD12 ILE A 134 14.251 25.047 -32.470 1.00 33.84 H new ATOM 0 HD13 ILE A 134 12.914 25.795 -32.872 1.00 33.84 H new ATOM 1084 N GLU A 135 15.016 21.545 -35.731 1.00 36.74 N ATOM 1085 CA GLU A 135 15.512 20.266 -35.351 1.00 39.05 C ATOM 1086 C GLU A 135 16.296 20.541 -34.113 1.00 40.31 C ATOM 1087 O GLU A 135 17.456 21.029 -34.195 1.00 42.47 O ATOM 1088 CB GLU A 135 16.430 19.709 -36.460 1.00 39.26 C ATOM 1089 CG GLU A 135 15.685 19.572 -37.761 1.00 43.99 C ATOM 1090 CD GLU A 135 16.497 18.812 -38.815 1.00 51.83 C ATOM 1091 OE1 GLU A 135 16.296 17.569 -38.891 1.00 54.58 O ATOM 1092 OE2 GLU A 135 17.326 19.465 -39.517 1.00 51.86 O ATOM 0 H GLU A 135 15.600 22.110 -36.013 1.00 36.74 H new ATOM 0 HA GLU A 135 14.811 19.610 -35.210 1.00 39.05 H new ATOM 0 HB2 GLU A 135 17.191 20.298 -36.580 1.00 39.26 H new ATOM 0 HB3 GLU A 135 16.779 18.845 -36.191 1.00 39.26 H new ATOM 0 HG2 GLU A 135 14.847 19.109 -37.605 1.00 43.99 H new ATOM 0 HG3 GLU A 135 15.463 20.454 -38.099 1.00 43.99 H new ATOM 1093 N ILE A 136 15.719 20.206 -32.960 1.00 38.82 N ATOM 1094 CA ILE A 136 16.455 20.327 -31.735 1.00 38.35 C ATOM 1095 C ILE A 136 16.102 19.173 -30.832 1.00 37.99 C ATOM 1096 O ILE A 136 14.967 18.678 -30.814 1.00 38.39 O ATOM 1097 CB ILE A 136 16.175 21.696 -31.049 1.00 38.93 C ATOM 1098 CG1 ILE A 136 14.722 21.780 -30.625 1.00 36.91 C ATOM 1099 CG2 ILE A 136 16.504 22.821 -32.010 1.00 38.31 C ATOM 1100 CD1 ILE A 136 14.392 23.047 -29.685 1.00 33.96 C ATOM 0 H ILE A 136 14.915 19.912 -32.879 1.00 38.82 H new ATOM 0 HA ILE A 136 17.406 20.297 -31.925 1.00 38.35 H new ATOM 0 HB ILE A 136 16.733 21.777 -30.259 1.00 38.93 H new ATOM 0 HG12 ILE A 136 14.164 21.822 -31.418 1.00 36.91 H new ATOM 0 HG13 ILE A 136 14.484 20.967 -30.153 1.00 36.91 H new ATOM 0 HG21 ILE A 136 16.329 23.674 -31.582 1.00 38.31 H new ATOM 0 HG22 ILE A 136 17.440 22.770 -32.259 1.00 38.31 H new ATOM 0 HG23 ILE A 136 15.953 22.740 -32.804 1.00 38.31 H new ATOM 0 HD11 ILE A 136 13.451 23.040 -29.452 1.00 33.96 H new ATOM 0 HD12 ILE A 136 14.926 22.998 -28.876 1.00 33.96 H new ATOM 0 HD13 ILE A 136 14.601 23.866 -30.161 1.00 33.96 H new ATOM 1101 N LYS A 137 17.066 18.751 -30.059 1.00 36.98 N ATOM 1102 CA LYS A 137 16.819 17.643 -29.148 1.00 38.62 C ATOM 1103 C LYS A 137 16.422 18.084 -27.742 1.00 36.67 C ATOM 1104 O LYS A 137 15.444 17.590 -27.173 1.00 37.23 O ATOM 1105 CB LYS A 137 18.042 16.719 -29.136 1.00 39.76 C ATOM 1106 CG LYS A 137 18.396 16.321 -30.619 1.00 45.74 C ATOM 1107 CD LYS A 137 19.187 17.467 -31.376 1.00 53.78 C ATOM 1108 CE LYS A 137 19.745 17.067 -32.748 1.00 56.55 C ATOM 1109 NZ LYS A 137 20.238 15.621 -32.685 1.00 58.60 N ATOM 0 H LYS A 137 17.861 19.078 -30.037 1.00 36.98 H new ATOM 0 HA LYS A 137 16.048 17.156 -29.478 1.00 38.62 H new ATOM 0 HB2 LYS A 137 18.796 17.166 -28.720 1.00 39.76 H new ATOM 0 HB3 LYS A 137 17.857 15.925 -28.611 1.00 39.76 H new ATOM 0 HG2 LYS A 137 18.929 15.511 -30.616 1.00 45.74 H new ATOM 0 HG3 LYS A 137 17.579 16.121 -31.102 1.00 45.74 H new ATOM 0 HD2 LYS A 137 18.597 18.228 -31.491 1.00 53.78 H new ATOM 0 HD3 LYS A 137 19.922 17.760 -30.815 1.00 53.78 H new ATOM 0 HE2 LYS A 137 19.059 17.157 -33.428 1.00 56.55 H new ATOM 0 HE3 LYS A 137 20.472 17.658 -32.999 1.00 56.55 H new ATOM 0 HZ1 LYS A 137 20.728 15.443 -33.406 1.00 58.60 H new ATOM 0 HZ2 LYS A 137 20.733 15.508 -31.954 1.00 58.60 H new ATOM 0 HZ3 LYS A 137 19.540 15.070 -32.658 1.00 58.60 H new ATOM 1110 N LYS A 138 17.209 18.980 -27.163 1.00 33.17 N ATOM 1111 CA LYS A 138 16.910 19.467 -25.827 1.00 32.32 C ATOM 1112 C LYS A 138 17.351 20.906 -25.652 1.00 29.20 C ATOM 1113 O LYS A 138 18.129 21.462 -26.458 1.00 27.31 O ATOM 1114 CB LYS A 138 17.589 18.651 -24.743 1.00 33.67 C ATOM 1115 CG LYS A 138 19.002 18.380 -24.914 1.00 39.72 C ATOM 1116 CD LYS A 138 19.255 17.210 -23.982 1.00 44.29 C ATOM 1117 CE LYS A 138 20.626 16.701 -24.089 1.00 52.55 C ATOM 1118 NZ LYS A 138 20.722 15.672 -23.007 1.00 54.54 N ATOM 0 H LYS A 138 17.914 19.316 -27.523 1.00 33.17 H new ATOM 0 HA LYS A 138 15.947 19.389 -25.736 1.00 32.32 H new ATOM 0 HB2 LYS A 138 17.470 19.113 -23.898 1.00 33.67 H new ATOM 0 HB3 LYS A 138 17.126 17.802 -24.669 1.00 33.67 H new ATOM 0 HG2 LYS A 138 19.214 18.156 -25.834 1.00 39.72 H new ATOM 0 HG3 LYS A 138 19.544 19.149 -24.677 1.00 39.72 H new ATOM 0 HD2 LYS A 138 19.084 17.485 -23.067 1.00 44.29 H new ATOM 0 HD3 LYS A 138 18.630 16.496 -24.185 1.00 44.29 H new ATOM 0 HE2 LYS A 138 20.793 16.313 -24.962 1.00 52.55 H new ATOM 0 HE3 LYS A 138 21.277 17.409 -23.964 1.00 52.55 H new ATOM 0 HZ1 LYS A 138 21.537 15.314 -23.009 1.00 54.54 H new ATOM 0 HZ2 LYS A 138 20.569 16.055 -22.218 1.00 54.54 H new ATOM 0 HZ3 LYS A 138 20.118 15.034 -23.149 1.00 54.54 H new ATOM 1119 N VAL A 139 16.801 21.493 -24.609 1.00 26.77 N ATOM 1120 CA VAL A 139 17.095 22.863 -24.301 1.00 23.30 C ATOM 1121 C VAL A 139 17.439 22.861 -22.853 1.00 22.35 C ATOM 1122 O VAL A 139 16.759 22.199 -22.028 1.00 25.11 O ATOM 1123 CB VAL A 139 15.865 23.781 -24.531 1.00 22.87 C ATOM 1124 CG1 VAL A 139 16.323 25.241 -24.224 1.00 20.64 C ATOM 1125 CG2 VAL A 139 15.327 23.604 -25.963 1.00 23.32 C ATOM 0 H VAL A 139 16.253 21.110 -24.068 1.00 26.77 H new ATOM 0 HA VAL A 139 17.806 23.202 -24.867 1.00 23.30 H new ATOM 0 HB VAL A 139 15.127 23.552 -23.945 1.00 22.87 H new ATOM 0 HG11 VAL A 139 15.579 25.849 -24.357 1.00 20.64 H new ATOM 0 HG12 VAL A 139 16.627 25.299 -23.305 1.00 20.64 H new ATOM 0 HG13 VAL A 139 17.049 25.485 -24.820 1.00 20.64 H new ATOM 0 HG21 VAL A 139 14.559 24.182 -26.094 1.00 23.32 H new ATOM 0 HG22 VAL A 139 16.020 23.837 -26.600 1.00 23.32 H new ATOM 0 HG23 VAL A 139 15.062 22.681 -26.098 1.00 23.32 H new ATOM 1126 N TYR A 140 18.507 23.558 -22.479 1.00 20.80 N ATOM 1127 CA TYR A 140 18.890 23.612 -21.117 1.00 19.38 C ATOM 1128 C TYR A 140 18.624 25.018 -20.568 1.00 20.22 C ATOM 1129 O TYR A 140 18.945 25.994 -21.256 1.00 20.32 O ATOM 1130 CB TYR A 140 20.391 23.492 -20.987 1.00 21.57 C ATOM 1131 CG TYR A 140 20.926 22.107 -21.386 1.00 23.32 C ATOM 1132 CD1 TYR A 140 21.161 21.793 -22.729 1.00 29.24 C ATOM 1133 CD2 TYR A 140 21.255 21.185 -20.396 1.00 29.91 C ATOM 1134 CE1 TYR A 140 21.720 20.513 -23.098 1.00 32.07 C ATOM 1135 CE2 TYR A 140 21.853 19.883 -20.746 1.00 36.18 C ATOM 1136 CZ TYR A 140 22.031 19.581 -22.084 1.00 37.95 C ATOM 1137 OH TYR A 140 22.598 18.352 -22.398 1.00 41.78 O ATOM 0 H TYR A 140 19.012 24.001 -23.016 1.00 20.80 H new ATOM 0 HA TYR A 140 18.406 22.906 -20.660 1.00 19.38 H new ATOM 0 HB2 TYR A 140 20.813 24.167 -21.542 1.00 21.57 H new ATOM 0 HB3 TYR A 140 20.646 23.679 -20.070 1.00 21.57 H new ATOM 0 HD1 TYR A 140 20.955 22.414 -23.390 1.00 29.24 H new ATOM 0 HD2 TYR A 140 21.096 21.393 -19.504 1.00 29.91 H new ATOM 0 HE1 TYR A 140 21.873 20.306 -23.992 1.00 32.07 H new ATOM 0 HE2 TYR A 140 22.104 19.280 -20.084 1.00 36.18 H new ATOM 0 HH TYR A 140 22.724 17.913 -21.693 1.00 41.78 H new ATOM 1138 N ILE A 141 18.085 25.090 -19.351 1.00 18.59 N ATOM 1139 CA ILE A 141 17.872 26.448 -18.770 1.00 19.06 C ATOM 1140 C ILE A 141 18.545 26.563 -17.442 1.00 18.31 C ATOM 1141 O ILE A 141 18.297 25.711 -16.548 1.00 19.58 O ATOM 1142 CB ILE A 141 16.305 26.799 -18.623 1.00 19.09 C ATOM 1143 CG1 ILE A 141 15.509 26.552 -19.884 1.00 17.14 C ATOM 1144 CG2 ILE A 141 16.141 28.241 -18.164 1.00 18.48 C ATOM 1145 CD1 ILE A 141 15.789 27.514 -21.104 1.00 20.53 C ATOM 0 H ILE A 141 17.846 24.424 -18.863 1.00 18.59 H new ATOM 0 HA ILE A 141 18.265 27.087 -19.384 1.00 19.06 H new ATOM 0 HB ILE A 141 15.944 26.194 -17.956 1.00 19.09 H new ATOM 0 HG12 ILE A 141 15.676 25.641 -20.173 1.00 17.14 H new ATOM 0 HG13 ILE A 141 14.566 26.611 -19.663 1.00 17.14 H new ATOM 0 HG21 ILE A 141 15.197 28.448 -18.077 1.00 18.48 H new ATOM 0 HG22 ILE A 141 16.578 28.359 -17.306 1.00 18.48 H new ATOM 0 HG23 ILE A 141 16.543 28.836 -18.816 1.00 18.48 H new ATOM 0 HD11 ILE A 141 15.225 27.262 -21.851 1.00 20.53 H new ATOM 0 HD12 ILE A 141 15.594 28.429 -20.846 1.00 20.53 H new ATOM 0 HD13 ILE A 141 16.721 27.444 -21.365 1.00 20.53 H new ATOM 1146 N CYS A 142 19.330 27.650 -17.209 1.00 16.69 N ATOM 1147 CA CYS A 142 19.875 27.836 -15.909 1.00 16.77 C ATOM 1148 C CYS A 142 18.762 28.291 -14.910 1.00 20.05 C ATOM 1149 O CYS A 142 18.126 29.303 -15.144 1.00 18.79 O ATOM 1150 CB CYS A 142 21.059 28.834 -15.967 1.00 16.84 C ATOM 1151 SG CYS A 142 21.780 29.221 -14.336 1.00 20.34 S ATOM 0 H CYS A 142 19.533 28.251 -17.789 1.00 16.69 H new ATOM 0 HA CYS A 142 20.223 26.992 -15.581 1.00 16.77 H new ATOM 0 HB2 CYS A 142 21.752 28.467 -16.538 1.00 16.84 H new ATOM 0 HB3 CYS A 142 20.756 29.658 -16.381 1.00 16.84 H new ATOM 1152 N PRO A 143 18.611 27.567 -13.783 1.00 21.53 N ATOM 1153 CA PRO A 143 17.568 27.944 -12.806 1.00 21.30 C ATOM 1154 C PRO A 143 17.956 29.139 -11.941 1.00 22.32 C ATOM 1155 O PRO A 143 17.096 29.645 -11.187 1.00 20.74 O ATOM 1156 CB PRO A 143 17.393 26.647 -11.988 1.00 22.56 C ATOM 1157 CG PRO A 143 18.851 26.123 -11.851 1.00 22.43 C ATOM 1158 CD PRO A 143 19.372 26.371 -13.333 1.00 21.60 C ATOM 0 HA PRO A 143 16.749 28.246 -13.228 1.00 21.30 H new ATOM 0 HB2 PRO A 143 16.990 26.819 -11.123 1.00 22.56 H new ATOM 0 HB3 PRO A 143 16.823 26.008 -12.444 1.00 22.56 H new ATOM 0 HG2 PRO A 143 19.362 26.616 -11.191 1.00 22.43 H new ATOM 0 HG3 PRO A 143 18.887 25.188 -11.597 1.00 22.43 H new ATOM 0 HD2 PRO A 143 20.329 26.530 -13.352 1.00 21.60 H new ATOM 0 HD3 PRO A 143 19.201 25.605 -13.903 1.00 21.60 H new ATOM 1159 N ILE A 144 19.189 29.680 -12.051 1.00 19.88 N ATOM 1160 CA ILE A 144 19.556 30.882 -11.305 1.00 20.93 C ATOM 1161 C ILE A 144 19.333 32.176 -12.133 1.00 21.04 C ATOM 1162 O ILE A 144 18.764 33.156 -11.644 1.00 22.17 O ATOM 1163 CB ILE A 144 21.052 30.796 -10.842 1.00 22.13 C ATOM 1164 CG1 ILE A 144 21.317 29.486 -10.009 1.00 24.49 C ATOM 1165 CG2 ILE A 144 21.511 32.051 -10.148 1.00 24.55 C ATOM 1166 CD1 ILE A 144 20.397 29.250 -8.922 1.00 33.98 C ATOM 0 H ILE A 144 19.814 29.362 -12.549 1.00 19.88 H new ATOM 0 HA ILE A 144 18.976 30.927 -10.529 1.00 20.93 H new ATOM 0 HB ILE A 144 21.603 30.731 -11.638 1.00 22.13 H new ATOM 0 HG12 ILE A 144 21.286 28.726 -10.611 1.00 24.49 H new ATOM 0 HG13 ILE A 144 22.217 29.526 -9.649 1.00 24.49 H new ATOM 0 HG21 ILE A 144 22.438 31.952 -9.881 1.00 24.55 H new ATOM 0 HG22 ILE A 144 21.428 32.805 -10.753 1.00 24.55 H new ATOM 0 HG23 ILE A 144 20.963 32.206 -9.363 1.00 24.55 H new ATOM 0 HD11 ILE A 144 20.636 28.427 -8.469 1.00 33.98 H new ATOM 0 HD12 ILE A 144 20.441 29.989 -8.295 1.00 33.98 H new ATOM 0 HD13 ILE A 144 19.495 29.176 -9.271 1.00 33.98 H new ATOM 1167 N CYS A 145 19.672 32.174 -13.411 1.00 19.47 N ATOM 1168 CA CYS A 145 19.622 33.411 -14.197 1.00 19.70 C ATOM 1169 C CYS A 145 18.881 33.230 -15.509 1.00 19.85 C ATOM 1170 O CYS A 145 18.679 34.208 -16.223 1.00 20.13 O ATOM 1171 CB CYS A 145 21.098 33.905 -14.492 1.00 22.43 C ATOM 1172 SG CYS A 145 21.946 32.750 -15.723 1.00 21.28 S ATOM 0 H CYS A 145 19.932 31.479 -13.845 1.00 19.47 H new ATOM 0 HA CYS A 145 19.138 34.070 -13.676 1.00 19.70 H new ATOM 0 HB2 CYS A 145 21.078 34.807 -14.847 1.00 22.43 H new ATOM 0 HB3 CYS A 145 21.606 33.936 -13.666 1.00 22.43 H new ATOM 1173 N GLY A 146 18.425 32.017 -15.844 1.00 16.77 N ATOM 1174 CA GLY A 146 17.664 31.845 -17.084 1.00 18.00 C ATOM 1175 C GLY A 146 18.480 31.766 -18.363 1.00 17.47 C ATOM 1176 O GLY A 146 17.945 31.693 -19.529 1.00 18.67 O ATOM 0 H GLY A 146 18.542 31.302 -15.381 1.00 16.77 H new ATOM 0 HA2 GLY A 146 17.136 31.035 -17.008 1.00 18.00 H new ATOM 0 HA3 GLY A 146 17.041 32.584 -17.165 1.00 18.00 H new ATOM 1177 N TYR A 147 19.808 31.714 -18.180 1.00 18.78 N ATOM 1178 CA TYR A 147 20.669 31.407 -19.354 1.00 17.16 C ATOM 1179 C TYR A 147 20.108 30.187 -20.126 1.00 18.33 C ATOM 1180 O TYR A 147 19.744 29.204 -19.470 1.00 19.91 O ATOM 1181 CB TYR A 147 22.088 31.082 -18.870 1.00 18.74 C ATOM 1182 CG TYR A 147 22.934 30.527 -20.009 1.00 17.08 C ATOM 1183 CD1 TYR A 147 23.242 29.154 -19.986 1.00 21.20 C ATOM 1184 CD2 TYR A 147 23.406 31.372 -21.086 1.00 20.19 C ATOM 1185 CE1 TYR A 147 24.039 28.578 -20.999 1.00 19.38 C ATOM 1186 CE2 TYR A 147 24.218 30.791 -22.137 1.00 21.42 C ATOM 1187 CZ TYR A 147 24.496 29.373 -22.025 1.00 22.03 C ATOM 1188 OH TYR A 147 25.246 28.704 -22.994 1.00 21.30 O ATOM 0 H TYR A 147 20.218 31.844 -17.435 1.00 18.78 H new ATOM 0 HA TYR A 147 20.684 32.178 -19.943 1.00 17.16 H new ATOM 0 HB2 TYR A 147 22.504 31.882 -18.513 1.00 18.74 H new ATOM 0 HB3 TYR A 147 22.048 30.437 -18.147 1.00 18.74 H new ATOM 0 HD1 TYR A 147 22.917 28.621 -19.297 1.00 21.20 H new ATOM 0 HD2 TYR A 147 23.191 32.277 -21.103 1.00 20.19 H new ATOM 0 HE1 TYR A 147 24.252 27.673 -20.973 1.00 19.38 H new ATOM 0 HE2 TYR A 147 24.543 31.300 -22.844 1.00 21.42 H new ATOM 0 HH TYR A 147 25.489 29.248 -23.586 1.00 21.30 H new ATOM 1189 N THR A 148 20.097 30.214 -21.472 1.00 18.23 N ATOM 1190 CA THR A 148 19.380 29.181 -22.275 1.00 18.20 C ATOM 1191 C THR A 148 20.372 28.643 -23.299 1.00 19.05 C ATOM 1192 O THR A 148 21.097 29.453 -23.934 1.00 20.63 O ATOM 1193 CB THR A 148 18.262 29.902 -23.022 1.00 18.98 C ATOM 1194 OG1 THR A 148 17.347 30.430 -22.021 1.00 16.94 O ATOM 1195 CG2 THR A 148 17.471 28.986 -23.982 1.00 18.58 C ATOM 0 H THR A 148 20.494 30.815 -21.942 1.00 18.23 H new ATOM 0 HA THR A 148 19.028 28.464 -21.725 1.00 18.20 H new ATOM 0 HB THR A 148 18.664 30.594 -23.570 1.00 18.98 H new ATOM 0 HG1 THR A 148 17.779 30.867 -21.449 1.00 16.94 H new ATOM 0 HG21 THR A 148 16.778 29.501 -24.424 1.00 18.58 H new ATOM 0 HG22 THR A 148 18.073 28.617 -24.647 1.00 18.58 H new ATOM 0 HG23 THR A 148 17.064 28.264 -23.479 1.00 18.58 H new ATOM 1196 N ALA A 149 20.405 27.346 -23.483 1.00 20.15 N ATOM 1197 CA ALA A 149 21.348 26.724 -24.457 1.00 21.99 C ATOM 1198 C ALA A 149 20.596 25.562 -25.126 1.00 24.16 C ATOM 1199 O ALA A 149 19.941 24.774 -24.431 1.00 24.41 O ATOM 1200 CB ALA A 149 22.569 26.127 -23.731 1.00 22.02 C ATOM 0 H ALA A 149 19.901 26.787 -23.067 1.00 20.15 H new ATOM 0 HA ALA A 149 21.651 27.393 -25.091 1.00 21.99 H new ATOM 0 HB1 ALA A 149 23.169 25.728 -24.381 1.00 22.02 H new ATOM 0 HB2 ALA A 149 23.035 26.829 -23.250 1.00 22.02 H new ATOM 0 HB3 ALA A 149 22.273 25.448 -23.105 1.00 22.02 H new ATOM 1201 N VAL A 150 20.734 25.447 -26.435 1.00 25.63 N ATOM 1202 CA VAL A 150 20.026 24.404 -27.219 1.00 27.85 C ATOM 1203 C VAL A 150 21.049 23.310 -27.563 1.00 29.02 C ATOM 1204 O VAL A 150 22.134 23.689 -28.012 1.00 29.65 O ATOM 1205 CB VAL A 150 19.440 24.995 -28.469 1.00 27.61 C ATOM 1206 CG1 VAL A 150 18.765 23.919 -29.251 1.00 32.00 C ATOM 1207 CG2 VAL A 150 18.398 26.122 -28.076 1.00 30.80 C ATOM 0 H VAL A 150 21.235 25.962 -26.908 1.00 25.63 H new ATOM 0 HA VAL A 150 19.293 24.030 -26.705 1.00 27.85 H new ATOM 0 HB VAL A 150 20.142 25.388 -29.011 1.00 27.61 H new ATOM 0 HG11 VAL A 150 18.385 24.296 -30.060 1.00 32.00 H new ATOM 0 HG12 VAL A 150 19.412 23.236 -29.487 1.00 32.00 H new ATOM 0 HG13 VAL A 150 18.059 23.524 -28.716 1.00 32.00 H new ATOM 0 HG21 VAL A 150 18.017 26.506 -28.881 1.00 30.80 H new ATOM 0 HG22 VAL A 150 17.690 25.735 -27.537 1.00 30.80 H new ATOM 0 HG23 VAL A 150 18.847 26.816 -27.569 1.00 30.80 H new ATOM 1208 N ASP A 151 20.735 22.057 -27.249 1.00 29.83 N ATOM 1209 CA ASP A 151 21.443 20.820 -27.717 1.00 32.50 C ATOM 1210 C ASP A 151 22.733 20.554 -26.923 1.00 33.99 C ATOM 1211 O ASP A 151 22.943 19.441 -26.380 1.00 34.88 O ATOM 1212 CB ASP A 151 21.685 20.910 -29.219 1.00 32.81 C ATOM 1213 CG ASP A 151 20.445 20.597 -29.991 1.00 37.42 C ATOM 1214 OD1 ASP A 151 19.580 20.011 -29.360 1.00 39.19 O ATOM 1215 OD2 ASP A 151 20.310 20.940 -31.195 1.00 45.17 O ATOM 0 H ASP A 151 20.072 21.876 -26.732 1.00 29.83 H new ATOM 0 HA ASP A 151 20.875 20.052 -27.547 1.00 32.50 H new ATOM 0 HB2 ASP A 151 21.993 21.801 -29.446 1.00 32.81 H new ATOM 0 HB3 ASP A 151 22.390 20.294 -29.472 1.00 32.81 H new ATOM 1216 N GLU A 152 23.560 21.591 -26.804 1.00 33.38 N ATOM 1217 CA GLU A 152 24.784 21.433 -26.038 1.00 35.33 C ATOM 1218 C GLU A 152 24.965 22.600 -25.079 1.00 33.87 C ATOM 1219 O GLU A 152 24.740 23.757 -25.449 1.00 35.18 O ATOM 1220 CB GLU A 152 25.995 21.390 -26.946 1.00 37.63 C ATOM 1221 CG GLU A 152 27.256 20.755 -26.200 1.00 44.90 C ATOM 1222 CD GLU A 152 28.558 20.671 -27.083 1.00 55.77 C ATOM 1223 OE1 GLU A 152 28.656 21.377 -28.125 1.00 60.94 O ATOM 1224 OE2 GLU A 152 29.497 19.922 -26.725 1.00 56.14 O ATOM 0 H GLU A 152 23.434 22.369 -27.148 1.00 33.38 H new ATOM 0 HA GLU A 152 24.709 20.599 -25.549 1.00 35.33 H new ATOM 0 HB2 GLU A 152 25.790 20.870 -27.739 1.00 37.63 H new ATOM 0 HB3 GLU A 152 26.211 22.288 -27.244 1.00 37.63 H new ATOM 0 HG2 GLU A 152 27.449 21.281 -25.408 1.00 44.90 H new ATOM 0 HG3 GLU A 152 27.024 19.863 -25.898 1.00 44.90 H new ATOM 1225 N ALA A 153 25.417 22.298 -23.884 1.00 32.60 N ATOM 1226 CA ALA A 153 25.487 23.323 -22.845 1.00 30.27 C ATOM 1227 C ALA A 153 26.954 23.544 -22.492 1.00 28.55 C ATOM 1228 O ALA A 153 27.746 22.581 -22.541 1.00 25.51 O ATOM 1229 CB ALA A 153 24.764 22.809 -21.630 1.00 30.76 C ATOM 0 H ALA A 153 25.688 21.517 -23.646 1.00 32.60 H new ATOM 0 HA ALA A 153 25.087 24.153 -23.148 1.00 30.27 H new ATOM 0 HB1 ALA A 153 24.799 23.476 -20.926 1.00 30.76 H new ATOM 0 HB2 ALA A 153 23.839 22.627 -21.857 1.00 30.76 H new ATOM 0 HB3 ALA A 153 25.188 21.993 -21.322 1.00 30.76 H new ATOM 1230 N PRO A 154 27.322 24.769 -22.106 1.00 25.97 N ATOM 1231 CA PRO A 154 28.663 24.993 -21.548 1.00 23.83 C ATOM 1232 C PRO A 154 28.735 24.283 -20.162 1.00 23.45 C ATOM 1233 O PRO A 154 27.696 23.997 -19.534 1.00 22.62 O ATOM 1234 CB PRO A 154 28.758 26.548 -21.400 1.00 24.58 C ATOM 1235 CG PRO A 154 27.298 26.958 -21.212 1.00 26.90 C ATOM 1236 CD PRO A 154 26.491 25.988 -22.101 1.00 25.28 C ATOM 0 HA PRO A 154 29.388 24.646 -22.091 1.00 23.83 H new ATOM 0 HB2 PRO A 154 29.305 26.805 -20.641 1.00 24.58 H new ATOM 0 HB3 PRO A 154 29.150 26.961 -22.185 1.00 24.58 H new ATOM 0 HG2 PRO A 154 27.030 26.887 -20.282 1.00 26.90 H new ATOM 0 HG3 PRO A 154 27.155 27.880 -21.479 1.00 26.90 H new ATOM 0 HD2 PRO A 154 25.608 25.819 -21.737 1.00 25.28 H new ATOM 0 HD3 PRO A 154 26.366 26.341 -22.996 1.00 25.28 H new ATOM 1237 N GLU A 155 29.949 23.911 -19.702 1.00 20.02 N ATOM 1238 CA GLU A 155 30.032 23.146 -18.476 1.00 21.33 C ATOM 1239 C GLU A 155 29.625 23.956 -17.204 1.00 20.67 C ATOM 1240 O GLU A 155 29.240 23.402 -16.156 1.00 21.19 O ATOM 1241 CB GLU A 155 31.511 22.781 -18.336 1.00 22.53 C ATOM 1242 CG GLU A 155 31.753 21.783 -17.163 1.00 26.62 C ATOM 1243 CD GLU A 155 31.293 20.357 -17.528 1.00 31.15 C ATOM 1244 OE1 GLU A 155 30.992 20.059 -18.726 1.00 31.85 O ATOM 1245 OE2 GLU A 155 31.229 19.582 -16.579 1.00 34.74 O ATOM 0 H GLU A 155 30.700 24.091 -20.080 1.00 20.02 H new ATOM 0 HA GLU A 155 29.426 22.391 -18.531 1.00 21.33 H new ATOM 0 HB2 GLU A 155 31.827 22.389 -19.165 1.00 22.53 H new ATOM 0 HB3 GLU A 155 32.030 23.587 -18.187 1.00 22.53 H new ATOM 0 HG2 GLU A 155 32.696 21.772 -16.936 1.00 26.62 H new ATOM 0 HG3 GLU A 155 31.275 22.086 -16.375 1.00 26.62 H new ATOM 1246 N TYR A 156 29.775 25.268 -17.294 1.00 20.33 N ATOM 1247 CA TYR A 156 29.308 26.236 -16.272 1.00 19.79 C ATOM 1248 C TYR A 156 28.520 27.363 -16.994 1.00 19.01 C ATOM 1249 O TYR A 156 28.849 27.755 -18.104 1.00 21.50 O ATOM 1250 CB TYR A 156 30.492 26.946 -15.535 1.00 19.50 C ATOM 1251 CG TYR A 156 31.251 25.896 -14.757 1.00 23.05 C ATOM 1252 CD1 TYR A 156 30.808 25.503 -13.501 1.00 23.74 C ATOM 1253 CD2 TYR A 156 32.305 25.184 -15.356 1.00 26.88 C ATOM 1254 CE1 TYR A 156 31.441 24.474 -12.851 1.00 30.68 C ATOM 1255 CE2 TYR A 156 32.979 24.153 -14.637 1.00 30.61 C ATOM 1256 CZ TYR A 156 32.534 23.824 -13.415 1.00 33.13 C ATOM 1257 OH TYR A 156 33.204 22.815 -12.692 1.00 37.77 O ATOM 0 H TYR A 156 30.160 25.645 -17.964 1.00 20.33 H new ATOM 0 HA TYR A 156 28.777 25.740 -15.629 1.00 19.79 H new ATOM 0 HB2 TYR A 156 31.076 27.384 -16.174 1.00 19.50 H new ATOM 0 HB3 TYR A 156 30.157 27.634 -14.939 1.00 19.50 H new ATOM 0 HD1 TYR A 156 30.087 25.935 -13.103 1.00 23.74 H new ATOM 0 HD2 TYR A 156 32.564 25.386 -16.226 1.00 26.88 H new ATOM 0 HE1 TYR A 156 31.133 24.205 -12.016 1.00 30.68 H new ATOM 0 HE2 TYR A 156 33.712 23.718 -15.008 1.00 30.61 H new ATOM 0 HH TYR A 156 33.838 22.513 -13.153 1.00 37.77 H new ATOM 1258 N CYS A 157 27.462 27.838 -16.350 1.00 19.60 N ATOM 1259 CA CYS A 157 26.653 28.972 -16.892 1.00 15.60 C ATOM 1260 C CYS A 157 27.583 30.155 -17.118 1.00 16.82 C ATOM 1261 O CYS A 157 28.289 30.535 -16.171 1.00 19.47 O ATOM 1262 CB CYS A 157 25.659 29.413 -15.764 1.00 17.07 C ATOM 1263 SG CYS A 157 24.664 30.764 -16.459 1.00 20.32 S ATOM 0 H CYS A 157 27.181 27.531 -15.597 1.00 19.60 H new ATOM 0 HA CYS A 157 26.200 28.710 -17.709 1.00 15.60 H new ATOM 0 HB2 CYS A 157 25.095 28.673 -15.492 1.00 17.07 H new ATOM 0 HB3 CYS A 157 26.140 29.708 -14.975 1.00 17.07 H new ATOM 1264 N PRO A 158 27.623 30.760 -18.321 1.00 18.54 N ATOM 1265 CA PRO A 158 28.584 31.920 -18.505 1.00 19.74 C ATOM 1266 C PRO A 158 28.168 33.212 -17.756 1.00 22.58 C ATOM 1267 O PRO A 158 29.002 34.158 -17.553 1.00 22.00 O ATOM 1268 CB PRO A 158 28.554 32.187 -19.994 1.00 20.12 C ATOM 1269 CG PRO A 158 27.149 31.664 -20.446 1.00 21.66 C ATOM 1270 CD PRO A 158 26.836 30.479 -19.519 1.00 17.09 C ATOM 0 HA PRO A 158 29.455 31.688 -18.146 1.00 19.74 H new ATOM 0 HB2 PRO A 158 28.660 33.132 -20.187 1.00 20.12 H new ATOM 0 HB3 PRO A 158 29.271 31.721 -20.453 1.00 20.12 H new ATOM 0 HG2 PRO A 158 26.476 32.358 -20.366 1.00 21.66 H new ATOM 0 HG3 PRO A 158 27.162 31.387 -21.375 1.00 21.66 H new ATOM 0 HD2 PRO A 158 25.889 30.424 -19.318 1.00 17.09 H new ATOM 0 HD3 PRO A 158 27.090 29.634 -19.922 1.00 17.09 H new ATOM 1271 N VAL A 159 26.924 33.232 -17.265 1.00 21.32 N ATOM 1272 CA VAL A 159 26.453 34.485 -16.596 1.00 21.48 C ATOM 1273 C VAL A 159 26.622 34.381 -15.087 1.00 22.24 C ATOM 1274 O VAL A 159 27.175 35.308 -14.462 1.00 24.67 O ATOM 1275 CB VAL A 159 24.934 34.713 -16.955 1.00 22.02 C ATOM 1276 CG1 VAL A 159 24.358 35.949 -16.145 1.00 20.14 C ATOM 1277 CG2 VAL A 159 24.757 34.873 -18.419 1.00 20.78 C ATOM 0 H VAL A 159 26.359 32.584 -17.297 1.00 21.32 H new ATOM 0 HA VAL A 159 26.983 35.235 -16.908 1.00 21.48 H new ATOM 0 HB VAL A 159 24.427 33.929 -16.692 1.00 22.02 H new ATOM 0 HG11 VAL A 159 23.424 36.079 -16.374 1.00 20.14 H new ATOM 0 HG12 VAL A 159 24.436 35.778 -15.194 1.00 20.14 H new ATOM 0 HG13 VAL A 159 24.860 36.747 -16.372 1.00 20.14 H new ATOM 0 HG21 VAL A 159 23.818 35.012 -18.618 1.00 20.78 H new ATOM 0 HG22 VAL A 159 25.269 35.638 -18.725 1.00 20.78 H new ATOM 0 HG23 VAL A 159 25.069 34.074 -18.872 1.00 20.78 H new ATOM 1278 N CYS A 160 26.202 33.286 -14.459 1.00 21.86 N ATOM 1279 CA CYS A 160 26.300 33.191 -13.004 1.00 22.28 C ATOM 1280 C CYS A 160 27.286 32.126 -12.505 1.00 25.29 C ATOM 1281 O CYS A 160 27.427 31.947 -11.280 1.00 21.97 O ATOM 1282 CB CYS A 160 24.935 32.867 -12.351 1.00 21.56 C ATOM 1283 SG CYS A 160 24.200 31.248 -12.718 1.00 24.03 S ATOM 0 H CYS A 160 25.863 32.598 -14.848 1.00 21.86 H new ATOM 0 HA CYS A 160 26.621 34.069 -12.744 1.00 22.28 H new ATOM 0 HB2 CYS A 160 25.038 32.939 -11.389 1.00 21.56 H new ATOM 0 HB3 CYS A 160 24.303 33.552 -12.621 1.00 21.56 H new ATOM 1284 N GLY A 161 27.803 31.320 -13.426 1.00 23.46 N ATOM 1285 CA GLY A 161 28.740 30.273 -13.017 1.00 24.20 C ATOM 1286 C GLY A 161 28.155 28.951 -12.495 1.00 24.07 C ATOM 1287 O GLY A 161 28.932 28.044 -12.096 1.00 24.54 O ATOM 0 H GLY A 161 27.633 31.357 -14.268 1.00 23.46 H new ATOM 0 HA2 GLY A 161 29.308 30.068 -13.776 1.00 24.20 H new ATOM 0 HA3 GLY A 161 29.313 30.639 -12.325 1.00 24.20 H new ATOM 1288 N ALA A 162 26.845 28.779 -12.522 1.00 23.62 N ATOM 1289 CA ALA A 162 26.176 27.531 -12.024 1.00 24.80 C ATOM 1290 C ALA A 162 26.647 26.321 -12.849 1.00 24.42 C ATOM 1291 O ALA A 162 26.765 26.411 -14.084 1.00 24.04 O ATOM 1292 CB ALA A 162 24.686 27.598 -12.190 1.00 21.97 C ATOM 0 H ALA A 162 26.298 29.369 -12.825 1.00 23.62 H new ATOM 0 HA ALA A 162 26.407 27.445 -11.086 1.00 24.80 H new ATOM 0 HB1 ALA A 162 24.286 26.778 -11.859 1.00 21.97 H new ATOM 0 HB2 ALA A 162 24.338 28.352 -11.689 1.00 21.97 H new ATOM 0 HB3 ALA A 162 24.469 27.707 -13.129 1.00 21.97 H new ATOM 1293 N PRO A 163 26.862 25.173 -12.185 1.00 26.93 N ATOM 1294 CA PRO A 163 27.316 24.012 -13.017 1.00 26.50 C ATOM 1295 C PRO A 163 26.173 23.452 -13.873 1.00 25.61 C ATOM 1296 O PRO A 163 25.005 23.544 -13.485 1.00 26.12 O ATOM 1297 CB PRO A 163 27.718 22.932 -11.971 1.00 25.81 C ATOM 1298 CG PRO A 163 27.210 23.410 -10.671 1.00 29.59 C ATOM 1299 CD PRO A 163 26.955 24.917 -10.733 1.00 27.44 C ATOM 0 HA PRO A 163 28.030 24.269 -13.622 1.00 26.50 H new ATOM 0 HB2 PRO A 163 27.334 22.070 -12.197 1.00 25.81 H new ATOM 0 HB3 PRO A 163 28.681 22.816 -11.945 1.00 25.81 H new ATOM 0 HG2 PRO A 163 26.390 22.944 -10.444 1.00 29.59 H new ATOM 0 HG3 PRO A 163 27.852 23.211 -9.971 1.00 29.59 H new ATOM 0 HD2 PRO A 163 26.138 25.163 -10.271 1.00 27.44 H new ATOM 0 HD3 PRO A 163 27.676 25.421 -10.324 1.00 27.44 H new ATOM 1300 N LYS A 164 26.532 22.865 -15.015 1.00 24.38 N ATOM 1301 CA LYS A 164 25.612 22.289 -15.979 1.00 27.45 C ATOM 1302 C LYS A 164 24.640 21.262 -15.302 1.00 27.93 C ATOM 1303 O LYS A 164 23.465 21.131 -15.709 1.00 26.52 O ATOM 1304 CB LYS A 164 26.459 21.559 -17.032 1.00 28.52 C ATOM 1305 CG LYS A 164 25.783 21.032 -18.236 1.00 37.02 C ATOM 1306 CD LYS A 164 26.846 20.269 -19.078 1.00 40.58 C ATOM 1307 CE LYS A 164 26.258 19.715 -20.469 1.00 44.72 C ATOM 1308 NZ LYS A 164 27.317 19.578 -21.625 1.00 44.40 N ATOM 0 H LYS A 164 27.355 22.791 -15.254 1.00 24.38 H new ATOM 0 HA LYS A 164 25.071 22.992 -16.372 1.00 27.45 H new ATOM 0 HB2 LYS A 164 27.154 22.168 -17.326 1.00 28.52 H new ATOM 0 HB3 LYS A 164 26.901 20.816 -16.592 1.00 28.52 H new ATOM 0 HG2 LYS A 164 25.057 20.439 -17.987 1.00 37.02 H new ATOM 0 HG3 LYS A 164 25.395 21.755 -18.753 1.00 37.02 H new ATOM 0 HD2 LYS A 164 27.593 20.860 -19.260 1.00 40.58 H new ATOM 0 HD3 LYS A 164 27.192 19.526 -18.559 1.00 40.58 H new ATOM 0 HE2 LYS A 164 25.855 18.847 -20.312 1.00 44.72 H new ATOM 0 HE3 LYS A 164 25.549 20.308 -20.765 1.00 44.72 H new ATOM 0 HZ1 LYS A 164 26.976 19.086 -22.284 1.00 44.40 H new ATOM 0 HZ2 LYS A 164 27.524 20.386 -21.935 1.00 44.40 H new ATOM 0 HZ3 LYS A 164 28.051 19.184 -21.311 1.00 44.40 H new ATOM 1309 N GLU A 165 25.128 20.539 -14.297 1.00 29.09 N ATOM 1310 CA GLU A 165 24.233 19.630 -13.542 1.00 32.37 C ATOM 1311 C GLU A 165 22.998 20.276 -12.924 1.00 32.60 C ATOM 1312 O GLU A 165 22.019 19.591 -12.659 1.00 33.72 O ATOM 1313 CB GLU A 165 24.988 19.009 -12.382 1.00 34.38 C ATOM 1314 CG GLU A 165 25.867 17.863 -12.824 1.00 42.99 C ATOM 1315 CD GLU A 165 26.580 17.220 -11.622 1.00 58.31 C ATOM 1316 OE1 GLU A 165 27.020 18.034 -10.746 1.00 65.94 O ATOM 1317 OE2 GLU A 165 26.672 15.938 -11.527 1.00 61.05 O ATOM 0 H GLU A 165 25.947 20.551 -14.034 1.00 29.09 H new ATOM 0 HA GLU A 165 23.938 18.994 -14.212 1.00 32.37 H new ATOM 0 HB2 GLU A 165 25.534 19.687 -11.953 1.00 34.38 H new ATOM 0 HB3 GLU A 165 24.355 18.692 -11.718 1.00 34.38 H new ATOM 0 HG2 GLU A 165 25.330 17.196 -13.280 1.00 42.99 H new ATOM 0 HG3 GLU A 165 26.525 18.182 -13.461 1.00 42.99 H new ATOM 1318 N LYS A 166 23.041 21.563 -12.659 1.00 30.26 N ATOM 1319 CA LYS A 166 21.870 22.262 -12.124 1.00 30.31 C ATOM 1320 C LYS A 166 20.878 22.703 -13.221 1.00 27.55 C ATOM 1321 O LYS A 166 19.756 23.147 -12.881 1.00 26.31 O ATOM 1322 CB LYS A 166 22.326 23.443 -11.236 1.00 32.01 C ATOM 1323 CG LYS A 166 22.692 22.985 -9.787 1.00 40.10 C ATOM 1324 CD LYS A 166 23.441 24.042 -8.885 1.00 48.70 C ATOM 1325 CE LYS A 166 22.635 25.290 -8.403 1.00 57.85 C ATOM 1326 NZ LYS A 166 21.365 25.086 -7.542 1.00 61.68 N ATOM 0 H LYS A 166 23.733 22.059 -12.778 1.00 30.26 H new ATOM 0 HA LYS A 166 21.375 21.635 -11.574 1.00 30.31 H new ATOM 0 HB2 LYS A 166 23.095 23.872 -11.642 1.00 32.01 H new ATOM 0 HB3 LYS A 166 21.620 24.106 -11.195 1.00 32.01 H new ATOM 0 HG2 LYS A 166 21.874 22.725 -9.335 1.00 40.10 H new ATOM 0 HG3 LYS A 166 23.247 22.192 -9.850 1.00 40.10 H new ATOM 0 HD2 LYS A 166 23.774 23.581 -8.099 1.00 48.70 H new ATOM 0 HD3 LYS A 166 24.215 24.359 -9.377 1.00 48.70 H new ATOM 0 HE2 LYS A 166 23.243 25.852 -7.897 1.00 57.85 H new ATOM 0 HE3 LYS A 166 22.375 25.791 -9.192 1.00 57.85 H new ATOM 0 HZ1 LYS A 166 21.011 25.878 -7.342 1.00 61.68 H new ATOM 0 HZ2 LYS A 166 20.772 24.603 -7.997 1.00 61.68 H new ATOM 0 HZ3 LYS A 166 21.580 24.660 -6.791 1.00 61.68 H new ATOM 1327 N PHE A 167 21.263 22.628 -14.507 1.00 25.46 N ATOM 1328 CA PHE A 167 20.384 23.141 -15.524 1.00 24.69 C ATOM 1329 C PHE A 167 19.135 22.281 -15.665 1.00 25.04 C ATOM 1330 O PHE A 167 19.215 21.045 -15.611 1.00 23.81 O ATOM 1331 CB PHE A 167 21.003 23.257 -16.950 1.00 24.00 C ATOM 1332 CG PHE A 167 22.208 24.139 -17.034 1.00 24.33 C ATOM 1333 CD1 PHE A 167 22.499 25.049 -16.023 1.00 19.97 C ATOM 1334 CD2 PHE A 167 23.081 24.014 -18.186 1.00 24.75 C ATOM 1335 CE1 PHE A 167 23.655 25.905 -16.126 1.00 20.49 C ATOM 1336 CE2 PHE A 167 24.207 24.823 -18.328 1.00 24.78 C ATOM 1337 CZ PHE A 167 24.515 25.784 -17.311 1.00 23.88 C ATOM 0 H PHE A 167 22.004 22.294 -14.787 1.00 25.46 H new ATOM 0 HA PHE A 167 20.185 24.036 -15.206 1.00 24.69 H new ATOM 0 HB2 PHE A 167 21.244 22.370 -17.259 1.00 24.00 H new ATOM 0 HB3 PHE A 167 20.326 23.595 -17.557 1.00 24.00 H new ATOM 0 HD1 PHE A 167 21.946 25.106 -15.278 1.00 19.97 H new ATOM 0 HD2 PHE A 167 22.886 23.383 -18.841 1.00 24.75 H new ATOM 0 HE1 PHE A 167 23.852 26.520 -15.457 1.00 20.49 H new ATOM 0 HE2 PHE A 167 24.753 24.740 -19.076 1.00 24.78 H new ATOM 0 HZ PHE A 167 25.261 26.332 -17.401 1.00 23.88 H new ATOM 1338 N VAL A 168 17.999 22.920 -15.955 1.00 22.89 N ATOM 1339 CA VAL A 168 16.741 22.252 -16.161 1.00 23.99 C ATOM 1340 C VAL A 168 16.678 21.846 -17.604 1.00 25.35 C ATOM 1341 O VAL A 168 16.939 22.656 -18.490 1.00 24.84 O ATOM 1342 CB VAL A 168 15.545 23.234 -15.770 1.00 22.72 C ATOM 1343 CG1 VAL A 168 14.221 22.502 -15.957 1.00 24.29 C ATOM 1344 CG2 VAL A 168 15.782 23.619 -14.357 1.00 25.03 C ATOM 0 H VAL A 168 17.951 23.775 -16.037 1.00 22.89 H new ATOM 0 HA VAL A 168 16.660 21.464 -15.602 1.00 23.99 H new ATOM 0 HB VAL A 168 15.507 24.028 -16.326 1.00 22.72 H new ATOM 0 HG11 VAL A 168 13.488 23.092 -15.721 1.00 24.29 H new ATOM 0 HG12 VAL A 168 14.130 22.229 -16.883 1.00 24.29 H new ATOM 0 HG13 VAL A 168 14.201 21.718 -15.386 1.00 24.29 H new ATOM 0 HG21 VAL A 168 15.080 24.220 -14.063 1.00 25.03 H new ATOM 0 HG22 VAL A 168 15.781 22.825 -13.800 1.00 25.03 H new ATOM 0 HG23 VAL A 168 16.641 24.064 -14.282 1.00 25.03 H new ATOM 1345 N VAL A 169 16.329 20.571 -17.865 1.00 25.19 N ATOM 1346 CA VAL A 169 16.369 20.064 -19.227 1.00 27.25 C ATOM 1347 C VAL A 169 14.991 19.874 -19.836 1.00 28.25 C ATOM 1348 O VAL A 169 14.118 19.249 -19.199 1.00 28.01 O ATOM 1349 CB VAL A 169 17.163 18.659 -19.288 1.00 29.52 C ATOM 1350 CG1 VAL A 169 17.193 18.110 -20.744 1.00 29.74 C ATOM 1351 CG2 VAL A 169 18.573 18.829 -18.745 1.00 31.14 C ATOM 0 H VAL A 169 16.073 20.003 -17.272 1.00 25.19 H new ATOM 0 HA VAL A 169 16.832 20.739 -19.747 1.00 27.25 H new ATOM 0 HB VAL A 169 16.696 18.014 -18.734 1.00 29.52 H new ATOM 0 HG11 VAL A 169 17.673 17.267 -20.762 1.00 29.74 H new ATOM 0 HG12 VAL A 169 16.285 17.972 -21.057 1.00 29.74 H new ATOM 0 HG13 VAL A 169 17.640 18.749 -21.322 1.00 29.74 H new ATOM 0 HG21 VAL A 169 19.040 17.980 -18.786 1.00 31.14 H new ATOM 0 HG22 VAL A 169 19.048 19.486 -19.278 1.00 31.14 H new ATOM 0 HG23 VAL A 169 18.531 19.130 -17.824 1.00 31.14 H new ATOM 1352 N PHE A 170 14.779 20.410 -21.027 1.00 26.99 N ATOM 1353 CA PHE A 170 13.509 20.234 -21.730 1.00 29.75 C ATOM 1354 C PHE A 170 13.824 19.332 -22.845 1.00 33.04 C ATOM 1355 O PHE A 170 14.559 19.716 -23.748 1.00 31.61 O ATOM 1356 CB PHE A 170 12.956 21.574 -22.248 1.00 27.81 C ATOM 1357 CG PHE A 170 12.443 22.424 -21.116 1.00 25.89 C ATOM 1358 CD1 PHE A 170 13.363 23.039 -20.281 1.00 26.60 C ATOM 1359 CD2 PHE A 170 11.062 22.523 -20.817 1.00 26.33 C ATOM 1360 CE1 PHE A 170 12.944 23.787 -19.167 1.00 25.71 C ATOM 1361 CE2 PHE A 170 10.648 23.218 -19.703 1.00 27.26 C ATOM 1362 CZ PHE A 170 11.606 23.865 -18.881 1.00 26.11 C ATOM 0 H PHE A 170 15.358 20.883 -21.452 1.00 26.99 H new ATOM 0 HA PHE A 170 12.822 19.877 -21.146 1.00 29.75 H new ATOM 0 HB2 PHE A 170 13.653 22.052 -22.725 1.00 27.81 H new ATOM 0 HB3 PHE A 170 12.241 21.408 -22.882 1.00 27.81 H new ATOM 0 HD1 PHE A 170 14.272 22.955 -20.461 1.00 26.60 H new ATOM 0 HD2 PHE A 170 10.435 22.119 -21.373 1.00 26.33 H new ATOM 0 HE1 PHE A 170 13.567 24.223 -18.631 1.00 25.71 H new ATOM 0 HE2 PHE A 170 9.744 23.263 -19.490 1.00 27.26 H new ATOM 0 HZ PHE A 170 11.323 24.348 -18.139 1.00 26.11 H new ATOM 1363 N GLU A 171 13.244 18.139 -22.806 1.00 37.38 N ATOM 1364 CA GLU A 171 13.445 17.176 -23.913 1.00 42.80 C ATOM 1365 C GLU A 171 12.145 16.554 -24.390 1.00 44.47 C ATOM 1366 O GLU A 171 11.140 16.605 -23.669 1.00 45.87 O ATOM 1367 CB GLU A 171 14.457 16.088 -23.544 1.00 43.18 C ATOM 1368 CG GLU A 171 14.118 15.246 -22.296 1.00 51.92 C ATOM 1369 CD GLU A 171 15.273 14.287 -21.949 1.00 60.40 C ATOM 1370 OE1 GLU A 171 15.026 13.312 -21.200 1.00 63.20 O ATOM 1371 OE2 GLU A 171 16.425 14.518 -22.445 1.00 63.13 O ATOM 1372 OXT GLU A 171 12.084 16.029 -25.514 1.00 45.78 O ATOM 0 H GLU A 171 12.739 17.861 -22.168 1.00 37.38 H new ATOM 0 HA GLU A 171 13.807 17.691 -24.651 1.00 42.80 H new ATOM 0 HB2 GLU A 171 14.552 15.489 -24.301 1.00 43.18 H new ATOM 0 HB3 GLU A 171 15.320 16.508 -23.405 1.00 43.18 H new ATOM 0 HG2 GLU A 171 13.942 15.832 -21.544 1.00 51.92 H new ATOM 0 HG3 GLU A 171 13.307 14.738 -22.455 1.00 51.92 H new TER 1373 GLU A 171 ATOM 1374 N VAL B 2 16.633 43.700 -0.065 1.00 30.34 N ATOM 1375 CA VAL B 2 15.331 44.099 -0.712 1.00 30.45 C ATOM 1376 C VAL B 2 15.514 45.516 -1.347 1.00 29.10 C ATOM 1377 O VAL B 2 16.115 46.383 -0.729 1.00 27.12 O ATOM 1378 CB VAL B 2 14.152 44.206 0.323 1.00 33.32 C ATOM 1379 CG1 VAL B 2 12.892 44.579 -0.417 1.00 29.09 C ATOM 1380 CG2 VAL B 2 13.910 42.872 1.051 1.00 32.98 C ATOM 0 HA VAL B 2 15.109 43.418 -1.366 1.00 30.45 H new ATOM 0 HB VAL B 2 14.389 44.877 0.982 1.00 33.32 H new ATOM 0 HG11 VAL B 2 12.156 44.648 0.211 1.00 29.09 H new ATOM 0 HG12 VAL B 2 13.018 45.432 -0.862 1.00 29.09 H new ATOM 0 HG13 VAL B 2 12.690 43.897 -1.077 1.00 29.09 H new ATOM 0 HG21 VAL B 2 13.178 42.974 1.680 1.00 32.98 H new ATOM 0 HG22 VAL B 2 13.686 42.186 0.403 1.00 32.98 H new ATOM 0 HG23 VAL B 2 14.713 42.614 1.530 1.00 32.98 H new ATOM 1381 N VAL B 3 15.022 45.724 -2.572 1.00 28.08 N ATOM 1382 CA VAL B 3 15.137 47.013 -3.250 1.00 25.80 C ATOM 1383 C VAL B 3 14.252 48.021 -2.575 1.00 27.73 C ATOM 1384 O VAL B 3 13.067 47.716 -2.365 1.00 27.14 O ATOM 1385 CB VAL B 3 14.785 46.831 -4.712 1.00 27.34 C ATOM 1386 CG1 VAL B 3 14.628 48.247 -5.433 1.00 28.17 C ATOM 1387 CG2 VAL B 3 15.894 45.912 -5.395 1.00 27.39 C ATOM 0 H VAL B 3 14.614 45.121 -3.030 1.00 28.08 H new ATOM 0 HA VAL B 3 16.046 47.347 -3.198 1.00 25.80 H new ATOM 0 HB VAL B 3 13.928 46.386 -4.800 1.00 27.34 H new ATOM 0 HG11 VAL B 3 14.403 48.112 -6.367 1.00 28.17 H new ATOM 0 HG12 VAL B 3 13.923 48.754 -5.001 1.00 28.17 H new ATOM 0 HG13 VAL B 3 15.463 48.737 -5.370 1.00 28.17 H new ATOM 0 HG21 VAL B 3 15.679 45.788 -6.333 1.00 27.39 H new ATOM 0 HG22 VAL B 3 16.762 46.339 -5.316 1.00 27.39 H new ATOM 0 HG23 VAL B 3 15.917 45.049 -4.952 1.00 27.39 H new ATOM 1388 N LYS B 4 14.771 49.237 -2.290 1.00 24.92 N ATOM 1389 CA LYS B 4 14.004 50.289 -1.582 1.00 25.91 C ATOM 1390 C LYS B 4 13.758 51.597 -2.406 1.00 25.76 C ATOM 1391 O LYS B 4 12.773 52.296 -2.216 1.00 26.15 O ATOM 1392 CB LYS B 4 14.738 50.617 -0.288 1.00 28.32 C ATOM 1393 CG LYS B 4 14.937 49.344 0.628 1.00 30.20 C ATOM 1394 CD LYS B 4 16.099 49.522 1.676 1.00 42.33 C ATOM 1395 CE LYS B 4 17.570 50.010 1.115 1.00 44.30 C ATOM 1396 NZ LYS B 4 18.030 51.308 1.848 1.00 34.48 N ATOM 0 H LYS B 4 15.571 49.471 -2.501 1.00 24.92 H new ATOM 0 HA LYS B 4 13.118 49.930 -1.419 1.00 25.91 H new ATOM 0 HB2 LYS B 4 15.604 51.000 -0.498 1.00 28.32 H new ATOM 0 HB3 LYS B 4 14.241 51.291 0.202 1.00 28.32 H new ATOM 0 HG2 LYS B 4 14.109 49.156 1.098 1.00 30.20 H new ATOM 0 HG3 LYS B 4 15.127 48.575 0.069 1.00 30.20 H new ATOM 0 HD2 LYS B 4 15.805 50.164 2.341 1.00 42.33 H new ATOM 0 HD3 LYS B 4 16.220 48.675 2.134 1.00 42.33 H new ATOM 0 HE2 LYS B 4 18.224 49.306 1.251 1.00 44.30 H new ATOM 0 HE3 LYS B 4 17.521 50.171 0.160 1.00 44.30 H new ATOM 0 HZ1 LYS B 4 18.824 51.560 1.536 1.00 34.48 H new ATOM 0 HZ2 LYS B 4 17.437 51.956 1.705 1.00 34.48 H new ATOM 0 HZ3 LYS B 4 18.092 51.150 2.722 1.00 34.48 H new ATOM 1397 N ARG B 5 14.647 51.913 -3.336 1.00 22.16 N ATOM 1398 CA ARG B 5 14.522 53.204 -4.035 1.00 22.79 C ATOM 1399 C ARG B 5 13.288 53.132 -4.959 1.00 22.16 C ATOM 1400 O ARG B 5 12.981 52.107 -5.618 1.00 22.81 O ATOM 1401 CB ARG B 5 15.777 53.492 -4.834 1.00 22.68 C ATOM 1402 CG ARG B 5 17.124 53.754 -4.034 1.00 27.10 C ATOM 1403 CD ARG B 5 17.089 55.054 -3.238 1.00 33.93 C ATOM 1404 NE ARG B 5 17.442 56.068 -4.165 1.00 33.89 N ATOM 1405 CZ ARG B 5 18.693 56.427 -4.472 1.00 36.66 C ATOM 1406 NH1 ARG B 5 18.847 57.358 -5.370 1.00 37.49 N ATOM 1407 NH2 ARG B 5 19.778 55.924 -3.844 1.00 37.25 N ATOM 0 H ARG B 5 15.310 51.421 -3.578 1.00 22.16 H new ATOM 0 HA ARG B 5 14.411 53.924 -3.395 1.00 22.79 H new ATOM 0 HB2 ARG B 5 15.927 52.743 -5.432 1.00 22.68 H new ATOM 0 HB3 ARG B 5 15.605 54.269 -5.389 1.00 22.68 H new ATOM 0 HG2 ARG B 5 17.287 53.013 -3.430 1.00 27.10 H new ATOM 0 HG3 ARG B 5 17.867 53.780 -4.657 1.00 27.10 H new ATOM 0 HD2 ARG B 5 16.208 55.212 -2.864 1.00 33.93 H new ATOM 0 HD3 ARG B 5 17.712 55.027 -2.495 1.00 33.93 H new ATOM 0 HE ARG B 5 16.802 56.484 -4.560 1.00 33.89 H new ATOM 0 HH11 ARG B 5 18.158 57.716 -5.740 1.00 37.49 H new ATOM 0 HH12 ARG B 5 19.637 57.614 -5.593 1.00 37.49 H new ATOM 0 HH21 ARG B 5 19.681 55.345 -3.215 1.00 37.25 H new ATOM 0 HH22 ARG B 5 20.566 56.182 -4.073 1.00 37.25 H new ATOM 1408 N THR B 6 12.533 54.219 -4.985 1.00 21.63 N ATOM 1409 CA THR B 6 11.260 54.237 -5.662 1.00 22.79 C ATOM 1410 C THR B 6 11.322 53.883 -7.142 1.00 20.02 C ATOM 1411 O THR B 6 10.483 53.090 -7.591 1.00 18.45 O ATOM 1412 CB THR B 6 10.532 55.607 -5.487 1.00 26.39 C ATOM 1413 OG1 THR B 6 10.412 55.781 -4.093 1.00 25.31 O ATOM 1414 CG2 THR B 6 9.059 55.520 -5.967 1.00 27.46 C ATOM 0 H THR B 6 12.748 54.963 -4.610 1.00 21.63 H new ATOM 0 HA THR B 6 10.752 53.534 -5.228 1.00 22.79 H new ATOM 0 HB THR B 6 11.015 56.296 -5.969 1.00 26.39 H new ATOM 0 HG1 THR B 6 10.025 56.509 -3.934 1.00 25.31 H new ATOM 0 HG21 THR B 6 8.628 56.381 -5.849 1.00 27.46 H new ATOM 0 HG22 THR B 6 9.038 55.275 -6.905 1.00 27.46 H new ATOM 0 HG23 THR B 6 8.588 54.850 -5.448 1.00 27.46 H new ATOM 1415 N MET B 7 12.214 54.534 -7.879 1.00 16.84 N ATOM 1416 CA MET B 7 12.224 54.281 -9.345 1.00 18.30 C ATOM 1417 C MET B 7 12.648 52.845 -9.617 1.00 17.20 C ATOM 1418 O MET B 7 12.037 52.170 -10.460 1.00 17.79 O ATOM 1419 CB MET B 7 13.161 55.301 -9.996 1.00 17.03 C ATOM 1420 CG MET B 7 12.716 56.778 -9.850 1.00 21.22 C ATOM 1421 SD MET B 7 10.974 57.014 -10.478 1.00 22.04 S ATOM 1422 CE MET B 7 11.140 56.614 -12.271 1.00 23.95 C ATOM 0 H MET B 7 12.795 55.096 -7.587 1.00 16.84 H new ATOM 0 HA MET B 7 11.339 54.388 -9.727 1.00 18.30 H new ATOM 0 HB2 MET B 7 14.045 55.203 -9.608 1.00 17.03 H new ATOM 0 HB3 MET B 7 13.240 55.092 -10.940 1.00 17.03 H new ATOM 0 HG2 MET B 7 12.767 57.045 -8.919 1.00 21.22 H new ATOM 0 HG3 MET B 7 13.322 57.353 -10.343 1.00 21.22 H new ATOM 0 HE1 MET B 7 10.301 56.797 -12.723 1.00 23.95 H new ATOM 0 HE2 MET B 7 11.842 57.158 -12.661 1.00 23.95 H new ATOM 0 HE3 MET B 7 11.364 55.676 -12.374 1.00 23.95 H new ATOM 1423 N THR B 8 13.714 52.334 -8.958 1.00 16.09 N ATOM 1424 CA THR B 8 14.131 50.960 -9.235 1.00 16.55 C ATOM 1425 C THR B 8 13.055 49.943 -8.832 1.00 16.49 C ATOM 1426 O THR B 8 12.807 48.939 -9.513 1.00 16.57 O ATOM 1427 CB THR B 8 15.494 50.664 -8.564 1.00 19.77 C ATOM 1428 OG1 THR B 8 16.510 51.509 -9.168 1.00 23.57 O ATOM 1429 CG2 THR B 8 15.894 49.174 -8.766 1.00 20.66 C ATOM 0 H THR B 8 14.184 52.754 -8.373 1.00 16.09 H new ATOM 0 HA THR B 8 14.246 50.867 -10.194 1.00 16.55 H new ATOM 0 HB THR B 8 15.420 50.843 -7.614 1.00 19.77 H new ATOM 0 HG1 THR B 8 16.402 52.303 -8.915 1.00 23.57 H new ATOM 0 HG21 THR B 8 16.749 49.008 -8.340 1.00 20.66 H new ATOM 0 HG22 THR B 8 15.219 48.601 -8.370 1.00 20.66 H new ATOM 0 HG23 THR B 8 15.964 48.983 -9.714 1.00 20.66 H new ATOM 1430 N LYS B 9 12.333 50.193 -7.750 1.00 16.58 N ATOM 1431 CA LYS B 9 11.240 49.365 -7.413 1.00 17.53 C ATOM 1432 C LYS B 9 10.127 49.330 -8.462 1.00 18.40 C ATOM 1433 O LYS B 9 9.596 48.288 -8.825 1.00 17.45 O ATOM 1434 CB LYS B 9 10.713 49.854 -6.015 1.00 21.35 C ATOM 1435 CG LYS B 9 9.539 49.125 -5.491 1.00 28.78 C ATOM 1436 CD LYS B 9 9.351 49.543 -3.982 1.00 37.94 C ATOM 1437 CE LYS B 9 7.983 49.017 -3.640 1.00 46.09 C ATOM 1438 NZ LYS B 9 7.502 49.582 -2.343 1.00 53.24 N ATOM 0 H LYS B 9 12.476 50.845 -7.208 1.00 16.58 H new ATOM 0 HA LYS B 9 11.544 48.445 -7.376 1.00 17.53 H new ATOM 0 HB2 LYS B 9 11.434 49.781 -5.371 1.00 21.35 H new ATOM 0 HB3 LYS B 9 10.487 50.795 -6.082 1.00 21.35 H new ATOM 0 HG2 LYS B 9 8.746 49.342 -6.006 1.00 28.78 H new ATOM 0 HG3 LYS B 9 9.672 48.167 -5.565 1.00 28.78 H new ATOM 0 HD2 LYS B 9 10.035 49.154 -3.416 1.00 37.94 H new ATOM 0 HD3 LYS B 9 9.402 50.505 -3.869 1.00 37.94 H new ATOM 0 HE2 LYS B 9 7.359 49.244 -4.347 1.00 46.09 H new ATOM 0 HE3 LYS B 9 8.009 48.049 -3.585 1.00 46.09 H new ATOM 0 HZ1 LYS B 9 6.693 49.259 -2.160 1.00 53.24 H new ATOM 0 HZ2 LYS B 9 8.066 49.355 -1.693 1.00 53.24 H new ATOM 0 HZ3 LYS B 9 7.460 50.469 -2.403 1.00 53.24 H new ATOM 1439 N LYS B 10 9.728 50.499 -8.956 1.00 18.05 N ATOM 1440 CA LYS B 10 8.743 50.565 -10.000 1.00 19.35 C ATOM 1441 C LYS B 10 9.269 49.800 -11.246 1.00 17.23 C ATOM 1442 O LYS B 10 8.472 49.080 -11.862 1.00 18.14 O ATOM 1443 CB LYS B 10 8.581 52.033 -10.454 1.00 20.24 C ATOM 1444 CG LYS B 10 7.450 52.137 -11.557 1.00 28.97 C ATOM 1445 CD LYS B 10 7.279 53.459 -12.277 1.00 39.51 C ATOM 1446 CE LYS B 10 5.920 53.376 -13.080 1.00 45.45 C ATOM 1447 NZ LYS B 10 5.676 54.646 -13.757 1.00 50.08 N ATOM 0 H LYS B 10 10.023 51.262 -8.692 1.00 18.05 H new ATOM 0 HA LYS B 10 7.912 50.193 -9.666 1.00 19.35 H new ATOM 0 HB2 LYS B 10 8.354 52.591 -9.694 1.00 20.24 H new ATOM 0 HB3 LYS B 10 9.421 52.364 -10.809 1.00 20.24 H new ATOM 0 HG2 LYS B 10 7.622 51.455 -12.225 1.00 28.97 H new ATOM 0 HG3 LYS B 10 6.604 51.916 -11.137 1.00 28.97 H new ATOM 0 HD2 LYS B 10 7.259 54.194 -11.644 1.00 39.51 H new ATOM 0 HD3 LYS B 10 8.023 53.621 -12.878 1.00 39.51 H new ATOM 0 HE2 LYS B 10 5.960 52.655 -13.728 1.00 45.45 H new ATOM 0 HE3 LYS B 10 5.188 53.175 -12.476 1.00 45.45 H new ATOM 0 HZ1 LYS B 10 4.911 54.599 -14.209 1.00 50.08 H new ATOM 0 HZ2 LYS B 10 5.625 55.299 -13.154 1.00 50.08 H new ATOM 0 HZ3 LYS B 10 6.343 54.815 -14.321 1.00 50.08 H new ATOM 1448 N PHE B 11 10.522 50.003 -11.636 1.00 15.55 N ATOM 1449 CA PHE B 11 11.073 49.316 -12.823 1.00 18.47 C ATOM 1450 C PHE B 11 11.041 47.805 -12.620 1.00 18.02 C ATOM 1451 O PHE B 11 10.695 47.079 -13.529 1.00 18.12 O ATOM 1452 CB PHE B 11 12.509 49.795 -13.124 1.00 18.20 C ATOM 1453 CG PHE B 11 12.554 51.200 -13.591 1.00 19.68 C ATOM 1454 CD1 PHE B 11 13.782 51.901 -13.588 1.00 19.63 C ATOM 1455 CD2 PHE B 11 11.357 51.890 -13.995 1.00 23.31 C ATOM 1456 CE1 PHE B 11 13.861 53.196 -14.069 1.00 20.38 C ATOM 1457 CE2 PHE B 11 11.430 53.287 -14.426 1.00 21.34 C ATOM 1458 CZ PHE B 11 12.680 53.914 -14.451 1.00 22.63 C ATOM 0 H PHE B 11 11.074 50.529 -11.237 1.00 15.55 H new ATOM 0 HA PHE B 11 10.519 49.539 -13.588 1.00 18.47 H new ATOM 0 HB2 PHE B 11 13.050 49.706 -12.324 1.00 18.20 H new ATOM 0 HB3 PHE B 11 12.903 49.221 -13.799 1.00 18.20 H new ATOM 0 HD1 PHE B 11 14.546 51.486 -13.258 1.00 19.63 H new ATOM 0 HD2 PHE B 11 10.538 51.449 -13.982 1.00 23.31 H new ATOM 0 HE1 PHE B 11 14.692 53.607 -14.146 1.00 20.38 H new ATOM 0 HE2 PHE B 11 10.662 53.747 -14.678 1.00 21.34 H new ATOM 0 HZ PHE B 11 12.746 54.803 -14.717 1.00 22.63 H new ATOM 1459 N LEU B 12 11.369 47.322 -11.428 1.00 15.62 N ATOM 1460 CA LEU B 12 11.288 45.872 -11.216 1.00 17.28 C ATOM 1461 C LEU B 12 9.853 45.364 -11.189 1.00 17.02 C ATOM 1462 O LEU B 12 9.621 44.228 -11.596 1.00 15.92 O ATOM 1463 CB LEU B 12 11.975 45.426 -9.873 1.00 17.32 C ATOM 1464 CG LEU B 12 13.522 45.421 -9.801 1.00 24.44 C ATOM 1465 CD1 LEU B 12 14.088 44.763 -8.494 1.00 27.99 C ATOM 1466 CD2 LEU B 12 14.199 44.782 -10.999 1.00 27.91 C ATOM 0 H LEU B 12 11.630 47.787 -10.753 1.00 15.62 H new ATOM 0 HA LEU B 12 11.757 45.486 -11.972 1.00 17.28 H new ATOM 0 HB2 LEU B 12 11.649 46.006 -9.168 1.00 17.32 H new ATOM 0 HB3 LEU B 12 11.667 44.529 -9.668 1.00 17.32 H new ATOM 0 HG LEU B 12 13.739 46.366 -9.798 1.00 24.44 H new ATOM 0 HD11 LEU B 12 15.057 44.792 -8.511 1.00 27.99 H new ATOM 0 HD12 LEU B 12 13.764 45.250 -7.720 1.00 27.99 H new ATOM 0 HD13 LEU B 12 13.793 43.840 -8.442 1.00 27.99 H new ATOM 0 HD21 LEU B 12 15.161 44.816 -10.883 1.00 27.91 H new ATOM 0 HD22 LEU B 12 13.915 43.858 -11.076 1.00 27.91 H new ATOM 0 HD23 LEU B 12 13.954 45.264 -11.805 1.00 27.91 H new ATOM 1467 N AGLU B 13 8.901 46.132 -10.724 0.50 15.51 N ATOM 1468 N BGLU B 13 8.883 46.131 -10.722 0.50 16.38 N ATOM 1469 CA AGLU B 13 7.547 45.669 -10.786 0.50 15.37 C ATOM 1470 CA BGLU B 13 7.497 45.698 -10.805 0.50 17.97 C ATOM 1471 C AGLU B 13 7.059 45.591 -12.259 0.50 9.29 C ATOM 1472 C BGLU B 13 7.054 45.587 -12.271 0.50 22.27 C ATOM 1473 O AGLU B 13 6.351 44.742 -12.632 0.50 4.93 O ATOM 1474 O BGLU B 13 6.355 44.733 -12.646 0.50 29.15 O ATOM 1475 CB AGLU B 13 6.695 46.543 -9.908 0.50 23.01 C ATOM 1476 CB BGLU B 13 6.605 46.653 -10.033 0.50 14.36 C ATOM 1477 CG AGLU B 13 7.047 46.381 -8.515 0.50 29.82 C ATOM 1478 CG BGLU B 13 6.869 46.575 -8.581 0.50 14.13 C ATOM 1479 CD AGLU B 13 6.201 45.352 -7.722 0.50 40.01 C ATOM 1480 CD BGLU B 13 6.262 47.661 -7.739 0.50 30.11 C ATOM 1481 OE1AGLU B 13 5.833 45.648 -6.571 0.50 44.47 O ATOM 1482 OE1BGLU B 13 5.853 48.703 -8.259 0.50 32.44 O ATOM 1483 OE2AGLU B 13 5.933 44.263 -8.224 0.50 42.99 O ATOM 1484 OE2BGLU B 13 6.227 47.481 -6.509 0.50 37.73 O ATOM 0 H AGLU B 13 9.014 46.910 -10.375 0.50 16.38 H new ATOM 0 H BGLU B 13 9.002 46.900 -10.356 0.50 16.38 H new ATOM 0 HA AGLU B 13 7.479 44.763 -10.446 0.50 17.97 H new ATOM 0 HA BGLU B 13 7.418 44.818 -10.404 0.50 17.97 H new ATOM 0 HB2AGLU B 13 6.805 47.471 -10.167 0.50 14.36 H new ATOM 0 HB2BGLU B 13 6.753 47.560 -10.343 0.50 14.36 H new ATOM 0 HB3AGLU B 13 5.759 46.321 -10.036 0.50 14.36 H new ATOM 0 HB3BGLU B 13 5.674 46.442 -10.207 0.50 14.36 H new ATOM 0 HG2AGLU B 13 7.979 46.117 -8.463 0.50 14.13 H new ATOM 0 HG2BGLU B 13 6.544 45.720 -8.257 0.50 14.13 H new ATOM 0 HG3AGLU B 13 6.971 47.243 -8.077 0.50 14.13 H new ATOM 0 HG3BGLU B 13 7.829 46.584 -8.444 0.50 14.13 H new ATOM 1485 N GLU B 14 7.569 46.471 -13.077 1.00 16.34 N ATOM 1486 CA GLU B 14 7.214 46.599 -14.511 1.00 15.68 C ATOM 1487 C GLU B 14 7.916 45.390 -15.143 1.00 15.45 C ATOM 1488 O GLU B 14 7.340 44.703 -16.053 1.00 16.90 O ATOM 1489 CB GLU B 14 7.688 47.874 -15.213 1.00 16.60 C ATOM 1490 CG GLU B 14 6.849 49.060 -14.791 1.00 25.57 C ATOM 1491 CD GLU B 14 7.179 50.309 -15.653 1.00 41.53 C ATOM 1492 OE1 GLU B 14 8.267 50.900 -15.414 1.00 42.97 O ATOM 1493 OE2 GLU B 14 6.374 50.628 -16.588 1.00 44.85 O ATOM 0 H AGLU B 14 8.158 47.045 -12.826 0.50 16.34 H new ATOM 0 H BGLU B 14 8.157 47.044 -12.821 0.50 16.34 H new ATOM 0 HA GLU B 14 6.249 46.639 -14.604 1.00 15.68 H new ATOM 0 HB2 GLU B 14 8.620 48.039 -15.000 1.00 16.60 H new ATOM 0 HB3 GLU B 14 7.633 47.759 -16.175 1.00 16.60 H new ATOM 0 HG2 GLU B 14 5.908 48.842 -14.878 1.00 25.57 H new ATOM 0 HG3 GLU B 14 7.009 49.257 -13.855 1.00 25.57 H new ATOM 1494 N ALA B 15 9.141 45.109 -14.678 1.00 15.92 N ATOM 1495 CA ALA B 15 9.849 43.994 -15.374 1.00 14.65 C ATOM 1496 C ALA B 15 9.172 42.659 -14.959 1.00 14.34 C ATOM 1497 O ALA B 15 9.093 41.722 -15.724 1.00 15.67 O ATOM 1498 CB ALA B 15 11.312 44.001 -14.983 1.00 16.82 C ATOM 0 H ALA B 15 9.554 45.498 -14.032 1.00 15.92 H new ATOM 0 HA ALA B 15 9.795 44.099 -16.337 1.00 14.65 H new ATOM 0 HB1 ALA B 15 11.772 43.276 -15.435 1.00 16.82 H new ATOM 0 HB2 ALA B 15 11.712 44.847 -15.239 1.00 16.82 H new ATOM 0 HB3 ALA B 15 11.391 43.884 -14.023 1.00 16.82 H new ATOM 1499 N PHE B 16 8.746 42.555 -13.687 1.00 16.17 N ATOM 1500 CA PHE B 16 7.969 41.383 -13.232 1.00 14.66 C ATOM 1501 C PHE B 16 6.729 41.157 -14.114 1.00 14.71 C ATOM 1502 O PHE B 16 6.424 40.030 -14.502 1.00 16.16 O ATOM 1503 CB PHE B 16 7.497 41.567 -11.748 1.00 14.78 C ATOM 1504 CG PHE B 16 6.732 40.331 -11.225 1.00 16.76 C ATOM 1505 CD1 PHE B 16 7.427 39.126 -10.990 1.00 16.67 C ATOM 1506 CD2 PHE B 16 5.355 40.369 -11.107 1.00 22.78 C ATOM 1507 CE1 PHE B 16 6.740 37.957 -10.582 1.00 16.04 C ATOM 1508 CE2 PHE B 16 4.615 39.229 -10.703 1.00 17.58 C ATOM 1509 CZ PHE B 16 5.309 38.027 -10.423 1.00 19.24 C ATOM 0 H PHE B 16 8.894 43.144 -13.079 1.00 16.17 H new ATOM 0 HA PHE B 16 8.555 40.613 -13.298 1.00 14.66 H new ATOM 0 HB2 PHE B 16 8.268 41.732 -11.183 1.00 14.78 H new ATOM 0 HB3 PHE B 16 6.927 42.349 -11.686 1.00 14.78 H new ATOM 0 HD1 PHE B 16 8.350 39.099 -11.105 1.00 16.67 H new ATOM 0 HD2 PHE B 16 4.904 41.160 -11.297 1.00 22.78 H new ATOM 0 HE1 PHE B 16 7.200 37.165 -10.421 1.00 16.04 H new ATOM 0 HE2 PHE B 16 3.689 39.270 -10.623 1.00 17.58 H new ATOM 0 HZ PHE B 16 4.839 37.278 -10.135 1.00 19.24 H new ATOM 1510 N ALA B 17 5.943 42.217 -14.299 1.00 16.12 N ATOM 1511 CA ALA B 17 4.784 42.132 -15.196 1.00 15.53 C ATOM 1512 C ALA B 17 5.169 41.709 -16.605 1.00 16.95 C ATOM 1513 O ALA B 17 4.524 40.866 -17.208 1.00 14.85 O ATOM 1514 CB ALA B 17 4.047 43.468 -15.215 1.00 17.18 C ATOM 0 H ALA B 17 6.058 42.982 -13.924 1.00 16.12 H new ATOM 0 HA ALA B 17 4.195 41.443 -14.851 1.00 15.53 H new ATOM 0 HB1 ALA B 17 3.282 43.408 -15.809 1.00 17.18 H new ATOM 0 HB2 ALA B 17 3.744 43.683 -14.319 1.00 17.18 H new ATOM 0 HB3 ALA B 17 4.646 44.164 -15.529 1.00 17.18 H new ATOM 1515 N GLY B 18 6.264 42.267 -17.115 1.00 16.03 N ATOM 1516 CA GLY B 18 6.740 41.924 -18.470 1.00 17.43 C ATOM 1517 C GLY B 18 7.202 40.500 -18.630 1.00 16.86 C ATOM 1518 O GLY B 18 6.852 39.807 -19.639 1.00 17.25 O ATOM 0 H GLY B 18 6.749 42.844 -16.701 1.00 16.03 H new ATOM 0 HA2 GLY B 18 6.025 42.093 -19.104 1.00 17.43 H new ATOM 0 HA3 GLY B 18 7.471 42.517 -18.703 1.00 17.43 H new ATOM 1519 N GLU B 19 7.968 40.007 -17.640 1.00 15.12 N ATOM 1520 CA GLU B 19 8.396 38.649 -17.675 1.00 15.52 C ATOM 1521 C GLU B 19 7.191 37.691 -17.490 1.00 15.77 C ATOM 1522 O GLU B 19 7.151 36.665 -18.086 1.00 15.72 O ATOM 1523 CB GLU B 19 9.309 38.370 -16.454 1.00 16.80 C ATOM 1524 CG GLU B 19 10.719 39.117 -16.641 1.00 18.12 C ATOM 1525 CD GLU B 19 11.583 38.414 -17.695 1.00 19.91 C ATOM 1526 OE1 GLU B 19 11.338 37.273 -18.227 1.00 20.95 O ATOM 1527 OE2 GLU B 19 12.591 38.950 -18.203 1.00 18.33 O ATOM 0 H GLU B 19 8.235 40.456 -16.957 1.00 15.12 H new ATOM 0 HA GLU B 19 8.842 38.507 -18.525 1.00 15.52 H new ATOM 0 HB2 GLU B 19 8.877 38.676 -15.641 1.00 16.80 H new ATOM 0 HB3 GLU B 19 9.450 37.415 -16.358 1.00 16.80 H new ATOM 0 HG2 GLU B 19 10.568 40.038 -16.905 1.00 18.12 H new ATOM 0 HG3 GLU B 19 11.191 39.139 -15.794 1.00 18.12 H new ATOM 1528 N SER B 20 6.231 38.065 -16.630 1.00 15.14 N ATOM 1529 CA SER B 20 5.042 37.153 -16.448 1.00 14.69 C ATOM 1530 C SER B 20 4.285 37.016 -17.751 1.00 14.29 C ATOM 1531 O SER B 20 3.722 35.957 -18.059 1.00 16.85 O ATOM 1532 CB SER B 20 4.115 37.855 -15.414 1.00 16.78 C ATOM 1533 OG SER B 20 4.770 37.781 -14.124 1.00 16.74 O ATOM 0 H SER B 20 6.228 38.788 -16.164 1.00 15.14 H new ATOM 0 HA SER B 20 5.324 36.271 -16.158 1.00 14.69 H new ATOM 0 HB2 SER B 20 3.960 38.779 -15.666 1.00 16.78 H new ATOM 0 HB3 SER B 20 3.248 37.421 -15.382 1.00 16.78 H new ATOM 0 HG SER B 20 5.327 38.406 -14.056 1.00 16.74 H new ATOM 1534 N MET B 21 4.073 38.151 -18.424 1.00 15.91 N ATOM 1535 CA MET B 21 3.310 38.180 -19.709 1.00 16.89 C ATOM 1536 C MET B 21 4.107 37.472 -20.822 1.00 18.38 C ATOM 1537 O MET B 21 3.531 36.714 -21.592 1.00 16.31 O ATOM 1538 CB MET B 21 2.978 39.595 -20.203 1.00 16.93 C ATOM 1539 CG MET B 21 1.848 40.175 -19.333 1.00 15.70 C ATOM 1540 SD MET B 21 1.253 41.750 -19.907 1.00 23.74 S ATOM 1541 CE MET B 21 2.426 42.757 -19.204 1.00 22.75 C ATOM 0 H MET B 21 4.357 38.920 -18.165 1.00 15.91 H new ATOM 0 HA MET B 21 2.475 37.724 -19.519 1.00 16.89 H new ATOM 0 HB2 MET B 21 3.764 40.161 -20.153 1.00 16.93 H new ATOM 0 HB3 MET B 21 2.706 39.570 -21.134 1.00 16.93 H new ATOM 0 HG2 MET B 21 1.110 39.546 -19.312 1.00 15.70 H new ATOM 0 HG3 MET B 21 2.166 40.270 -18.422 1.00 15.70 H new ATOM 0 HE1 MET B 21 2.237 43.681 -19.430 1.00 22.75 H new ATOM 0 HE2 MET B 21 2.408 42.651 -18.240 1.00 22.75 H new ATOM 0 HE3 MET B 21 3.303 42.515 -19.540 1.00 22.75 H new ATOM 1542 N ALA B 22 5.442 37.622 -20.811 1.00 15.29 N ATOM 1543 CA ALA B 22 6.285 36.826 -21.816 1.00 17.62 C ATOM 1544 C ALA B 22 6.154 35.313 -21.556 1.00 16.96 C ATOM 1545 O ALA B 22 5.891 34.489 -22.460 1.00 16.04 O ATOM 1546 CB ALA B 22 7.775 37.309 -21.750 1.00 17.18 C ATOM 0 H ALA B 22 5.881 38.136 -20.279 1.00 15.29 H new ATOM 0 HA ALA B 22 5.957 36.987 -22.715 1.00 17.62 H new ATOM 0 HB1 ALA B 22 8.307 36.805 -22.386 1.00 17.18 H new ATOM 0 HB2 ALA B 22 7.819 38.253 -21.968 1.00 17.18 H new ATOM 0 HB3 ALA B 22 8.122 37.168 -20.855 1.00 17.18 H new ATOM 1547 N HIS B 23 6.312 34.907 -20.298 1.00 16.56 N ATOM 1548 CA HIS B 23 6.069 33.505 -19.899 1.00 15.94 C ATOM 1549 C HIS B 23 4.735 33.025 -20.352 1.00 16.26 C ATOM 1550 O HIS B 23 4.616 31.963 -20.922 1.00 15.89 O ATOM 1551 CB HIS B 23 6.192 33.409 -18.354 1.00 17.09 C ATOM 1552 CG HIS B 23 5.779 32.078 -17.799 1.00 18.46 C ATOM 1553 ND1 HIS B 23 6.689 31.055 -17.596 1.00 18.60 N ATOM 1554 CD2 HIS B 23 4.578 31.612 -17.340 1.00 18.65 C ATOM 1555 CE1 HIS B 23 6.061 29.990 -17.077 1.00 20.15 C ATOM 1556 NE2 HIS B 23 4.781 30.304 -16.921 1.00 20.42 N ATOM 0 H HIS B 23 6.559 35.422 -19.655 1.00 16.56 H new ATOM 0 HA HIS B 23 6.729 32.935 -20.324 1.00 15.94 H new ATOM 0 HB2 HIS B 23 7.111 33.586 -18.099 1.00 17.09 H new ATOM 0 HB3 HIS B 23 5.647 34.102 -17.950 1.00 17.09 H new ATOM 0 HD1 HIS B 23 7.529 31.096 -17.775 1.00 18.60 H new ATOM 0 HD2 HIS B 23 3.776 32.083 -17.314 1.00 18.65 H new ATOM 0 HE1 HIS B 23 6.454 29.174 -16.864 1.00 20.15 H new ATOM 1557 N MET B 24 3.685 33.807 -20.106 1.00 14.25 N ATOM 1558 CA MET B 24 2.344 33.345 -20.474 1.00 14.96 C ATOM 1559 C MET B 24 2.138 33.267 -22.017 1.00 16.49 C ATOM 1560 O MET B 24 1.601 32.290 -22.555 1.00 15.40 O ATOM 1561 CB MET B 24 1.356 34.367 -19.891 1.00 14.16 C ATOM 1562 CG MET B 24 -0.131 33.961 -20.120 1.00 17.91 C ATOM 1563 SD MET B 24 -0.605 32.385 -19.385 1.00 18.41 S ATOM 1564 CE MET B 24 -0.543 32.798 -17.587 1.00 17.04 C ATOM 0 H MET B 24 3.721 34.584 -19.739 1.00 14.25 H new ATOM 0 HA MET B 24 2.209 32.449 -20.128 1.00 14.96 H new ATOM 0 HB2 MET B 24 1.519 34.463 -18.940 1.00 14.16 H new ATOM 0 HB3 MET B 24 1.517 35.234 -20.295 1.00 14.16 H new ATOM 0 HG2 MET B 24 -0.702 34.657 -19.759 1.00 17.91 H new ATOM 0 HG3 MET B 24 -0.299 33.922 -21.074 1.00 17.91 H new ATOM 0 HE1 MET B 24 -0.814 32.025 -17.068 1.00 17.04 H new ATOM 0 HE2 MET B 24 0.362 33.050 -17.344 1.00 17.04 H new ATOM 0 HE3 MET B 24 -1.144 33.537 -17.404 1.00 17.04 H new ATOM 1565 N ARG B 25 2.600 34.277 -22.759 1.00 14.09 N ATOM 1566 CA ARG B 25 2.475 34.186 -24.234 1.00 16.68 C ATOM 1567 C ARG B 25 3.191 32.951 -24.692 1.00 16.66 C ATOM 1568 O ARG B 25 2.712 32.287 -25.627 1.00 17.19 O ATOM 1569 CB ARG B 25 3.103 35.453 -24.878 1.00 16.34 C ATOM 1570 CG ARG B 25 2.209 36.714 -24.759 1.00 20.65 C ATOM 1571 CD ARG B 25 2.739 37.922 -25.635 1.00 26.44 C ATOM 1572 NE ARG B 25 4.094 38.260 -25.288 1.00 31.99 N ATOM 1573 CZ ARG B 25 4.389 39.201 -24.378 1.00 32.49 C ATOM 1574 NH1 ARG B 25 5.638 39.450 -24.099 1.00 36.01 N ATOM 1575 NH2 ARG B 25 3.427 39.923 -23.805 1.00 25.30 N ATOM 0 H ARG B 25 2.971 34.991 -22.456 1.00 14.09 H new ATOM 0 HA ARG B 25 1.543 34.135 -24.499 1.00 16.68 H new ATOM 0 HB2 ARG B 25 3.959 35.631 -24.457 1.00 16.34 H new ATOM 0 HB3 ARG B 25 3.279 35.277 -25.816 1.00 16.34 H new ATOM 0 HG2 ARG B 25 1.305 36.492 -25.033 1.00 20.65 H new ATOM 0 HG3 ARG B 25 2.165 36.988 -23.830 1.00 20.65 H new ATOM 0 HD2 ARG B 25 2.692 37.688 -26.575 1.00 26.44 H new ATOM 0 HD3 ARG B 25 2.167 38.694 -25.506 1.00 26.44 H new ATOM 0 HE ARG B 25 4.738 37.844 -25.678 1.00 31.99 H new ATOM 0 HH11 ARG B 25 6.263 39.013 -24.497 1.00 36.01 H new ATOM 0 HH12 ARG B 25 5.837 40.051 -23.517 1.00 36.01 H new ATOM 0 HH21 ARG B 25 2.604 39.789 -24.017 1.00 25.30 H new ATOM 0 HH22 ARG B 25 3.629 40.523 -23.223 1.00 25.30 H new ATOM 1576 N TYR B 26 4.361 32.659 -24.093 1.00 16.52 N ATOM 1577 CA TYR B 26 5.168 31.480 -24.596 1.00 15.34 C ATOM 1578 C TYR B 26 4.477 30.156 -24.310 1.00 17.44 C ATOM 1579 O TYR B 26 4.496 29.269 -25.120 1.00 17.95 O ATOM 1580 CB TYR B 26 6.590 31.452 -24.004 1.00 14.66 C ATOM 1581 CG TYR B 26 7.389 32.698 -24.510 1.00 16.78 C ATOM 1582 CD1 TYR B 26 8.529 33.108 -23.827 1.00 18.48 C ATOM 1583 CD2 TYR B 26 6.949 33.470 -25.626 1.00 17.57 C ATOM 1584 CE1 TYR B 26 9.250 34.283 -24.266 1.00 17.62 C ATOM 1585 CE2 TYR B 26 7.649 34.671 -26.058 1.00 19.16 C ATOM 1586 CZ TYR B 26 8.799 35.015 -25.396 1.00 16.94 C ATOM 1587 OH TYR B 26 9.454 36.158 -25.783 1.00 21.45 O ATOM 0 H TYR B 26 4.703 33.091 -23.433 1.00 16.52 H new ATOM 0 HA TYR B 26 5.236 31.597 -25.556 1.00 15.34 H new ATOM 0 HB2 TYR B 26 6.548 31.454 -23.035 1.00 14.66 H new ATOM 0 HB3 TYR B 26 7.044 30.636 -24.266 1.00 14.66 H new ATOM 0 HD1 TYR B 26 8.828 32.627 -23.089 1.00 18.48 H new ATOM 0 HD2 TYR B 26 6.192 33.198 -26.092 1.00 17.57 H new ATOM 0 HE1 TYR B 26 10.010 34.559 -23.807 1.00 17.62 H new ATOM 0 HE2 TYR B 26 7.326 35.188 -26.760 1.00 19.16 H new ATOM 0 HH TYR B 26 10.228 36.162 -25.456 1.00 21.45 H new ATOM 1588 N LEU B 27 3.785 30.070 -23.176 1.00 16.42 N ATOM 1589 CA LEU B 27 2.961 28.878 -22.944 1.00 17.70 C ATOM 1590 C LEU B 27 1.798 28.735 -23.936 1.00 16.33 C ATOM 1591 O LEU B 27 1.478 27.583 -24.338 1.00 17.55 O ATOM 1592 CB LEU B 27 2.439 28.895 -21.469 1.00 16.65 C ATOM 1593 CG LEU B 27 3.488 28.638 -20.371 1.00 21.24 C ATOM 1594 CD1 LEU B 27 2.678 28.540 -18.956 1.00 22.25 C ATOM 1595 CD2 LEU B 27 4.320 27.331 -20.621 1.00 24.07 C ATOM 0 H LEU B 27 3.774 30.661 -22.551 1.00 16.42 H new ATOM 0 HA LEU B 27 3.524 28.102 -23.091 1.00 17.70 H new ATOM 0 HB2 LEU B 27 2.028 29.757 -21.301 1.00 16.65 H new ATOM 0 HB3 LEU B 27 1.741 28.227 -21.385 1.00 16.65 H new ATOM 0 HG LEU B 27 4.133 29.362 -20.365 1.00 21.24 H new ATOM 0 HD11 LEU B 27 3.305 28.378 -18.234 1.00 22.25 H new ATOM 0 HD12 LEU B 27 2.208 29.373 -18.794 1.00 22.25 H new ATOM 0 HD13 LEU B 27 2.039 27.811 -18.998 1.00 22.25 H new ATOM 0 HD21 LEU B 27 4.964 27.215 -19.905 1.00 24.07 H new ATOM 0 HD22 LEU B 27 3.723 26.567 -20.645 1.00 24.07 H new ATOM 0 HD23 LEU B 27 4.788 27.402 -21.468 1.00 24.07 H new ATOM 1596 N ILE B 28 1.122 29.843 -24.236 1.00 15.80 N ATOM 1597 CA ILE B 28 0.033 29.864 -25.151 1.00 17.12 C ATOM 1598 C ILE B 28 0.592 29.473 -26.555 1.00 18.28 C ATOM 1599 O ILE B 28 -0.007 28.626 -27.267 1.00 16.66 O ATOM 1600 CB ILE B 28 -0.595 31.248 -25.185 1.00 17.37 C ATOM 1601 CG1 ILE B 28 -1.294 31.514 -23.802 1.00 15.06 C ATOM 1602 CG2 ILE B 28 -1.663 31.417 -26.330 1.00 17.71 C ATOM 1603 CD1 ILE B 28 -1.725 33.011 -23.693 1.00 15.93 C ATOM 0 H ILE B 28 1.303 30.612 -23.895 1.00 15.80 H new ATOM 0 HA ILE B 28 -0.657 29.238 -24.881 1.00 17.12 H new ATOM 0 HB ILE B 28 0.116 31.884 -25.360 1.00 17.37 H new ATOM 0 HG12 ILE B 28 -2.070 30.940 -23.709 1.00 15.06 H new ATOM 0 HG13 ILE B 28 -0.688 31.292 -23.078 1.00 15.06 H new ATOM 0 HG21 ILE B 28 -2.028 32.315 -26.303 1.00 17.71 H new ATOM 0 HG22 ILE B 28 -1.242 31.266 -27.191 1.00 17.71 H new ATOM 0 HG23 ILE B 28 -2.378 30.774 -26.203 1.00 17.71 H new ATOM 0 HD11 ILE B 28 -2.155 33.163 -22.837 1.00 15.93 H new ATOM 0 HD12 ILE B 28 -0.943 33.579 -23.767 1.00 15.93 H new ATOM 0 HD13 ILE B 28 -2.346 33.222 -24.408 1.00 15.93 H new ATOM 1604 N PHE B 29 1.722 30.078 -26.910 1.00 16.73 N ATOM 1605 CA PHE B 29 2.309 29.763 -28.248 1.00 18.08 C ATOM 1606 C PHE B 29 2.814 28.286 -28.310 1.00 18.94 C ATOM 1607 O PHE B 29 2.810 27.712 -29.444 1.00 21.92 O ATOM 1608 CB PHE B 29 3.516 30.674 -28.549 1.00 16.25 C ATOM 1609 CG PHE B 29 3.215 32.134 -28.659 1.00 16.52 C ATOM 1610 CD1 PHE B 29 4.281 33.081 -28.514 1.00 18.52 C ATOM 1611 CD2 PHE B 29 1.930 32.595 -28.901 1.00 17.63 C ATOM 1612 CE1 PHE B 29 3.999 34.436 -28.625 1.00 18.45 C ATOM 1613 CE2 PHE B 29 1.658 33.928 -29.046 1.00 18.58 C ATOM 1614 CZ PHE B 29 2.676 34.856 -28.907 1.00 18.73 C ATOM 0 H PHE B 29 2.157 30.646 -26.433 1.00 16.73 H new ATOM 0 HA PHE B 29 1.605 29.905 -28.900 1.00 18.08 H new ATOM 0 HB2 PHE B 29 4.177 30.549 -27.850 1.00 16.25 H new ATOM 0 HB3 PHE B 29 3.922 30.381 -29.380 1.00 16.25 H new ATOM 0 HD1 PHE B 29 5.149 32.792 -28.348 1.00 18.52 H new ATOM 0 HD2 PHE B 29 1.234 31.982 -28.967 1.00 17.63 H new ATOM 0 HE1 PHE B 29 4.675 35.065 -28.515 1.00 18.45 H new ATOM 0 HE2 PHE B 29 0.793 34.210 -29.237 1.00 18.58 H new ATOM 0 HZ PHE B 29 2.490 35.762 -29.000 1.00 18.73 H new ATOM 1615 N ALA B 30 3.273 27.709 -27.192 1.00 18.66 N ATOM 1616 CA ALA B 30 3.796 26.346 -27.185 1.00 20.46 C ATOM 1617 C ALA B 30 2.622 25.417 -27.520 1.00 23.45 C ATOM 1618 O ALA B 30 2.762 24.450 -28.292 1.00 22.40 O ATOM 1619 CB ALA B 30 4.370 25.947 -25.767 1.00 20.92 C ATOM 0 H ALA B 30 3.288 28.097 -26.425 1.00 18.66 H new ATOM 0 HA ALA B 30 4.520 26.274 -27.827 1.00 20.46 H new ATOM 0 HB1 ALA B 30 4.708 25.038 -25.798 1.00 20.92 H new ATOM 0 HB2 ALA B 30 5.090 26.551 -25.527 1.00 20.92 H new ATOM 0 HB3 ALA B 30 3.665 26.006 -25.104 1.00 20.92 H new ATOM 1620 N GLU B 31 1.468 25.688 -26.926 1.00 23.80 N ATOM 1621 CA GLU B 31 0.282 24.847 -27.215 1.00 24.30 C ATOM 1622 C GLU B 31 -0.163 24.979 -28.672 1.00 23.05 C ATOM 1623 O GLU B 31 -0.459 23.976 -29.319 1.00 25.49 O ATOM 1624 CB GLU B 31 -0.843 25.247 -26.200 1.00 24.70 C ATOM 1625 CG GLU B 31 -2.090 24.357 -26.265 1.00 29.01 C ATOM 1626 CD GLU B 31 -3.099 24.860 -25.202 1.00 35.79 C ATOM 1627 OE1 GLU B 31 -3.659 24.022 -24.474 1.00 43.03 O ATOM 1628 OE2 GLU B 31 -3.318 26.101 -25.156 1.00 28.76 O ATOM 0 H GLU B 31 1.338 26.330 -26.368 1.00 23.80 H new ATOM 0 HA GLU B 31 0.498 23.908 -27.101 1.00 24.30 H new ATOM 0 HB2 GLU B 31 -0.481 25.214 -25.301 1.00 24.70 H new ATOM 0 HB3 GLU B 31 -1.104 26.166 -26.367 1.00 24.70 H new ATOM 0 HG2 GLU B 31 -2.485 24.392 -27.150 1.00 29.01 H new ATOM 0 HG3 GLU B 31 -1.854 23.431 -26.096 1.00 29.01 H new ATOM 1629 N LYS B 32 -0.100 26.165 -29.238 1.00 22.28 N ATOM 1630 CA LYS B 32 -0.490 26.372 -30.617 1.00 23.95 C ATOM 1631 C LYS B 32 0.518 25.679 -31.545 1.00 24.72 C ATOM 1632 O LYS B 32 0.131 25.098 -32.519 1.00 25.41 O ATOM 1633 CB LYS B 32 -0.504 27.845 -30.969 1.00 22.84 C ATOM 1634 CG LYS B 32 -0.921 28.242 -32.362 1.00 26.10 C ATOM 1635 CD LYS B 32 -2.215 27.574 -32.854 1.00 29.75 C ATOM 1636 CE LYS B 32 -3.410 28.373 -32.475 1.00 31.95 C ATOM 1637 NZ LYS B 32 -4.537 28.140 -33.530 1.00 36.79 N ATOM 0 H LYS B 32 0.170 26.875 -28.835 1.00 22.28 H new ATOM 0 HA LYS B 32 -1.381 26.004 -30.729 1.00 23.95 H new ATOM 0 HB2 LYS B 32 -1.095 28.293 -30.344 1.00 22.84 H new ATOM 0 HB3 LYS B 32 0.388 28.194 -30.816 1.00 22.84 H new ATOM 0 HG2 LYS B 32 -1.036 29.205 -32.391 1.00 26.10 H new ATOM 0 HG3 LYS B 32 -0.203 28.023 -32.977 1.00 26.10 H new ATOM 0 HD2 LYS B 32 -2.183 27.472 -33.818 1.00 29.75 H new ATOM 0 HD3 LYS B 32 -2.286 26.683 -32.477 1.00 29.75 H new ATOM 0 HE2 LYS B 32 -3.719 28.114 -31.593 1.00 31.95 H new ATOM 0 HE3 LYS B 32 -3.182 29.315 -32.431 1.00 31.95 H new ATOM 0 HZ1 LYS B 32 -5.255 28.616 -33.308 1.00 36.79 H new ATOM 0 HZ2 LYS B 32 -4.250 28.395 -34.333 1.00 36.79 H new ATOM 0 HZ3 LYS B 32 -4.750 27.276 -33.552 1.00 36.79 H new ATOM 1638 N ALA B 33 1.803 25.723 -31.213 1.00 23.38 N ATOM 1639 CA ALA B 33 2.813 25.103 -32.103 1.00 24.09 C ATOM 1640 C ALA B 33 2.584 23.589 -32.095 1.00 24.16 C ATOM 1641 O ALA B 33 2.755 22.922 -33.138 1.00 27.42 O ATOM 1642 CB ALA B 33 4.206 25.406 -31.559 1.00 19.18 C ATOM 0 H ALA B 33 2.116 26.092 -30.502 1.00 23.38 H new ATOM 0 HA ALA B 33 2.736 25.452 -33.005 1.00 24.09 H new ATOM 0 HB1 ALA B 33 4.874 25.003 -32.136 1.00 19.18 H new ATOM 0 HB2 ALA B 33 4.341 26.366 -31.530 1.00 19.18 H new ATOM 0 HB3 ALA B 33 4.291 25.041 -30.664 1.00 19.18 H new ATOM 1643 N GLU B 34 2.279 23.036 -30.944 1.00 26.40 N ATOM 1644 CA GLU B 34 2.040 21.592 -30.767 1.00 30.53 C ATOM 1645 C GLU B 34 0.817 21.228 -31.641 1.00 32.09 C ATOM 1646 O GLU B 34 0.879 20.245 -32.408 1.00 31.01 O ATOM 1647 CB GLU B 34 1.823 21.253 -29.267 1.00 32.54 C ATOM 1648 CG GLU B 34 1.817 19.763 -28.866 1.00 41.44 C ATOM 1649 CD GLU B 34 3.236 19.134 -28.730 1.00 52.54 C ATOM 1650 OE1 GLU B 34 4.012 19.479 -27.801 1.00 54.65 O ATOM 1651 OE2 GLU B 34 3.566 18.241 -29.557 1.00 55.52 O ATOM 0 H GLU B 34 2.199 23.487 -30.216 1.00 26.40 H new ATOM 0 HA GLU B 34 2.806 21.068 -31.047 1.00 30.53 H new ATOM 0 HB2 GLU B 34 2.518 21.697 -28.756 1.00 32.54 H new ATOM 0 HB3 GLU B 34 0.977 21.640 -28.992 1.00 32.54 H new ATOM 0 HG2 GLU B 34 1.349 19.667 -28.022 1.00 41.44 H new ATOM 0 HG3 GLU B 34 1.314 19.262 -29.527 1.00 41.44 H new ATOM 1652 N GLN B 35 -0.240 22.062 -31.606 1.00 31.03 N ATOM 1653 CA GLN B 35 -1.465 21.804 -32.398 1.00 31.87 C ATOM 1654 C GLN B 35 -1.204 21.902 -33.927 1.00 32.31 C ATOM 1655 O GLN B 35 -1.850 21.184 -34.715 1.00 31.47 O ATOM 1656 CB GLN B 35 -2.658 22.720 -31.955 1.00 30.93 C ATOM 1657 CG GLN B 35 -3.059 22.488 -30.496 1.00 35.50 C ATOM 1658 CD GLN B 35 -3.887 23.642 -29.842 1.00 40.44 C ATOM 1659 OE1 GLN B 35 -3.800 24.829 -30.217 1.00 41.20 O ATOM 1660 NE2 GLN B 35 -4.633 23.291 -28.815 1.00 42.61 N ATOM 0 H GLN B 35 -0.269 22.779 -31.133 1.00 31.03 H new ATOM 0 HA GLN B 35 -1.726 20.888 -32.212 1.00 31.87 H new ATOM 0 HB2 GLN B 35 -2.411 23.650 -32.076 1.00 30.93 H new ATOM 0 HB3 GLN B 35 -3.422 22.552 -32.529 1.00 30.93 H new ATOM 0 HG2 GLN B 35 -3.576 21.669 -30.444 1.00 35.50 H new ATOM 0 HG3 GLN B 35 -2.254 22.350 -29.972 1.00 35.50 H new ATOM 0 HE21 GLN B 35 -4.676 22.466 -28.577 1.00 42.61 H new ATOM 0 HE22 GLN B 35 -5.077 23.887 -28.383 1.00 42.61 H new ATOM 1661 N GLU B 36 -0.287 22.781 -34.359 1.00 30.39 N ATOM 1662 CA GLU B 36 0.048 22.982 -35.745 1.00 30.64 C ATOM 1663 C GLU B 36 1.069 21.976 -36.296 1.00 30.77 C ATOM 1664 O GLU B 36 1.359 22.003 -37.478 1.00 32.86 O ATOM 1665 CB GLU B 36 0.571 24.407 -36.009 1.00 29.07 C ATOM 1666 CG GLU B 36 -0.556 25.419 -36.001 1.00 32.51 C ATOM 1667 CD GLU B 36 -0.092 26.839 -36.437 1.00 39.88 C ATOM 1668 OE1 GLU B 36 0.997 27.297 -36.037 1.00 38.80 O ATOM 1669 OE2 GLU B 36 -0.828 27.516 -37.179 1.00 45.55 O ATOM 0 H GLU B 36 0.162 23.284 -33.825 1.00 30.39 H new ATOM 0 HA GLU B 36 -0.789 22.841 -36.214 1.00 30.64 H new ATOM 0 HB2 GLU B 36 1.225 24.644 -35.333 1.00 29.07 H new ATOM 0 HB3 GLU B 36 1.026 24.433 -36.866 1.00 29.07 H new ATOM 0 HG2 GLU B 36 -1.261 25.117 -36.595 1.00 32.51 H new ATOM 0 HG3 GLU B 36 -0.936 25.467 -35.110 1.00 32.51 H new ATOM 1670 N GLY B 37 1.671 21.160 -35.452 1.00 31.20 N ATOM 1671 CA GLY B 37 2.603 20.139 -35.980 1.00 31.85 C ATOM 1672 C GLY B 37 4.075 20.552 -35.885 1.00 31.32 C ATOM 1673 O GLY B 37 4.890 20.032 -36.645 1.00 30.99 O ATOM 0 H GLY B 37 1.570 21.166 -34.598 1.00 31.20 H new ATOM 0 HA2 GLY B 37 2.474 19.310 -35.492 1.00 31.85 H new ATOM 0 HA3 GLY B 37 2.384 19.959 -36.908 1.00 31.85 H new ATOM 1674 N PHE B 38 4.416 21.449 -34.937 1.00 28.68 N ATOM 1675 CA PHE B 38 5.785 21.848 -34.667 1.00 27.23 C ATOM 1676 C PHE B 38 6.174 21.508 -33.226 1.00 27.63 C ATOM 1677 O PHE B 38 6.347 22.418 -32.375 1.00 26.08 O ATOM 1678 CB PHE B 38 6.024 23.344 -34.894 1.00 27.13 C ATOM 1679 CG PHE B 38 5.590 23.861 -36.247 1.00 29.70 C ATOM 1680 CD1 PHE B 38 4.477 24.650 -36.379 1.00 32.70 C ATOM 1681 CD2 PHE B 38 6.351 23.586 -37.406 1.00 34.51 C ATOM 1682 CE1 PHE B 38 4.112 25.227 -37.650 1.00 35.31 C ATOM 1683 CE2 PHE B 38 5.986 24.124 -38.657 1.00 35.92 C ATOM 1684 CZ PHE B 38 4.869 24.943 -38.784 1.00 37.21 C ATOM 0 H PHE B 38 3.839 21.840 -34.433 1.00 28.68 H new ATOM 0 HA PHE B 38 6.335 21.353 -35.294 1.00 27.23 H new ATOM 0 HB2 PHE B 38 5.554 23.841 -34.207 1.00 27.13 H new ATOM 0 HB3 PHE B 38 6.970 23.528 -34.780 1.00 27.13 H new ATOM 0 HD1 PHE B 38 3.946 24.817 -35.634 1.00 32.70 H new ATOM 0 HD2 PHE B 38 7.103 23.043 -37.342 1.00 34.51 H new ATOM 0 HE1 PHE B 38 3.373 25.788 -37.712 1.00 35.31 H new ATOM 0 HE2 PHE B 38 6.499 23.929 -39.408 1.00 35.92 H new ATOM 0 HZ PHE B 38 4.632 25.295 -39.612 1.00 37.21 H new ATOM 1685 N PRO B 39 6.369 20.219 -32.946 1.00 27.29 N ATOM 1686 CA PRO B 39 6.639 19.846 -31.561 1.00 27.07 C ATOM 1687 C PRO B 39 8.014 20.380 -31.017 1.00 26.64 C ATOM 1688 O PRO B 39 8.157 20.569 -29.813 1.00 27.53 O ATOM 1689 CB PRO B 39 6.580 18.320 -31.574 1.00 28.51 C ATOM 1690 CG PRO B 39 7.028 17.922 -33.008 1.00 29.70 C ATOM 1691 CD PRO B 39 6.439 19.076 -33.894 1.00 29.19 C ATOM 0 HA PRO B 39 5.995 20.246 -30.956 1.00 27.07 H new ATOM 0 HB2 PRO B 39 7.167 17.939 -30.903 1.00 28.51 H new ATOM 0 HB3 PRO B 39 5.685 18.000 -31.383 1.00 28.51 H new ATOM 0 HG2 PRO B 39 7.994 17.870 -33.081 1.00 29.70 H new ATOM 0 HG3 PRO B 39 6.677 17.056 -33.267 1.00 29.70 H new ATOM 0 HD2 PRO B 39 7.009 19.273 -34.653 1.00 29.19 H new ATOM 0 HD3 PRO B 39 5.565 18.848 -34.247 1.00 29.19 H new ATOM 1692 N ASN B 40 9.017 20.605 -31.887 1.00 25.91 N ATOM 1693 CA ASN B 40 10.323 21.090 -31.393 1.00 25.45 C ATOM 1694 C ASN B 40 10.228 22.581 -31.124 1.00 24.57 C ATOM 1695 O ASN B 40 10.820 23.001 -30.125 1.00 27.26 O ATOM 1696 CB ASN B 40 11.476 20.774 -32.353 1.00 25.63 C ATOM 1697 CG ASN B 40 11.763 19.300 -32.404 1.00 30.23 C ATOM 1698 OD1 ASN B 40 11.542 18.583 -31.416 1.00 35.26 O ATOM 1699 ND2 ASN B 40 12.342 18.844 -33.514 1.00 38.16 N ATOM 0 H ASN B 40 8.966 20.488 -32.737 1.00 25.91 H new ATOM 0 HA ASN B 40 10.527 20.619 -30.570 1.00 25.45 H new ATOM 0 HB2 ASN B 40 11.255 21.092 -33.242 1.00 25.63 H new ATOM 0 HB3 ASN B 40 12.273 21.250 -32.071 1.00 25.63 H new ATOM 0 HD21 ASN B 40 12.580 18.019 -33.567 1.00 38.16 H new ATOM 0 HD22 ASN B 40 12.478 19.374 -34.177 1.00 38.16 H new ATOM 1700 N ILE B 41 9.551 23.327 -32.006 1.00 24.43 N ATOM 1701 CA ILE B 41 9.179 24.723 -31.722 1.00 24.20 C ATOM 1702 C ILE B 41 8.382 24.841 -30.384 1.00 24.68 C ATOM 1703 O ILE B 41 8.649 25.767 -29.589 1.00 21.08 O ATOM 1704 CB ILE B 41 8.471 25.387 -32.878 1.00 24.79 C ATOM 1705 CG1 ILE B 41 9.506 25.590 -34.020 1.00 23.94 C ATOM 1706 CG2 ILE B 41 8.044 26.798 -32.486 1.00 25.71 C ATOM 1707 CD1 ILE B 41 8.951 26.234 -35.156 1.00 24.96 C ATOM 0 H ILE B 41 9.297 23.043 -32.777 1.00 24.43 H new ATOM 0 HA ILE B 41 10.006 25.216 -31.606 1.00 24.20 H new ATOM 0 HB ILE B 41 7.712 24.840 -33.134 1.00 24.79 H new ATOM 0 HG12 ILE B 41 10.250 26.115 -33.687 1.00 23.94 H new ATOM 0 HG13 ILE B 41 9.863 24.728 -34.284 1.00 23.94 H new ATOM 0 HG21 ILE B 41 7.590 27.218 -33.233 1.00 25.71 H new ATOM 0 HG22 ILE B 41 7.443 26.755 -31.726 1.00 25.71 H new ATOM 0 HG23 ILE B 41 8.827 27.319 -32.249 1.00 25.71 H new ATOM 0 HD11 ILE B 41 9.635 26.336 -35.836 1.00 24.96 H new ATOM 0 HD12 ILE B 41 8.223 25.699 -35.508 1.00 24.96 H new ATOM 0 HD13 ILE B 41 8.616 27.108 -34.901 1.00 24.96 H new ATOM 1708 N ALA B 42 7.454 23.912 -30.141 1.00 22.20 N ATOM 1709 CA ALA B 42 6.727 23.919 -28.828 1.00 22.71 C ATOM 1710 C ALA B 42 7.683 23.734 -27.661 1.00 23.71 C ATOM 1711 O ALA B 42 7.582 24.431 -26.628 1.00 23.30 O ATOM 1712 CB ALA B 42 5.657 22.816 -28.832 1.00 21.77 C ATOM 0 H ALA B 42 7.226 23.287 -30.686 1.00 22.20 H new ATOM 0 HA ALA B 42 6.300 24.783 -28.716 1.00 22.71 H new ATOM 0 HB1 ALA B 42 5.186 22.819 -27.984 1.00 21.77 H new ATOM 0 HB2 ALA B 42 5.027 22.978 -29.552 1.00 21.77 H new ATOM 0 HB3 ALA B 42 6.081 21.954 -28.963 1.00 21.77 H new ATOM 1713 N LYS B 43 8.653 22.799 -27.809 1.00 22.06 N ATOM 1714 CA LYS B 43 9.601 22.506 -26.768 1.00 22.00 C ATOM 1715 C LYS B 43 10.435 23.765 -26.482 1.00 20.00 C ATOM 1716 O LYS B 43 10.673 24.110 -25.267 1.00 20.61 O ATOM 1717 CB LYS B 43 10.487 21.304 -27.239 1.00 22.79 C ATOM 1718 CG LYS B 43 11.533 20.908 -26.182 1.00 33.27 C ATOM 1719 CD LYS B 43 12.716 20.060 -26.792 1.00 44.81 C ATOM 1720 CE LYS B 43 12.323 19.121 -27.911 1.00 50.15 C ATOM 1721 NZ LYS B 43 11.585 17.949 -27.406 1.00 56.91 N ATOM 0 H LYS B 43 8.759 22.331 -28.523 1.00 22.06 H new ATOM 0 HA LYS B 43 9.159 22.255 -25.942 1.00 22.00 H new ATOM 0 HB2 LYS B 43 9.919 20.542 -27.432 1.00 22.79 H new ATOM 0 HB3 LYS B 43 10.937 21.540 -28.065 1.00 22.79 H new ATOM 0 HG2 LYS B 43 11.892 21.710 -25.770 1.00 33.27 H new ATOM 0 HG3 LYS B 43 11.101 20.397 -25.479 1.00 33.27 H new ATOM 0 HD2 LYS B 43 13.395 20.669 -27.123 1.00 44.81 H new ATOM 0 HD3 LYS B 43 13.123 19.541 -26.081 1.00 44.81 H new ATOM 0 HE2 LYS B 43 11.775 19.596 -28.555 1.00 50.15 H new ATOM 0 HE3 LYS B 43 13.119 18.825 -28.380 1.00 50.15 H new ATOM 0 HZ1 LYS B 43 11.382 17.411 -28.085 1.00 56.91 H new ATOM 0 HZ2 LYS B 43 12.091 17.509 -26.820 1.00 56.91 H new ATOM 0 HZ3 LYS B 43 10.836 18.219 -27.007 1.00 56.91 H new ATOM 1722 N LEU B 44 10.814 24.483 -27.537 1.00 18.40 N ATOM 1723 CA LEU B 44 11.620 25.732 -27.355 1.00 20.29 C ATOM 1724 C LEU B 44 10.805 26.813 -26.590 1.00 20.00 C ATOM 1725 O LEU B 44 11.308 27.472 -25.666 1.00 19.03 O ATOM 1726 CB LEU B 44 11.968 26.337 -28.713 1.00 20.52 C ATOM 1727 CG LEU B 44 12.749 27.662 -28.808 1.00 23.24 C ATOM 1728 CD1 LEU B 44 14.123 27.450 -28.053 1.00 27.19 C ATOM 1729 CD2 LEU B 44 12.977 28.114 -30.235 1.00 23.73 C ATOM 0 H LEU B 44 10.629 24.286 -28.353 1.00 18.40 H new ATOM 0 HA LEU B 44 12.417 25.486 -26.859 1.00 20.29 H new ATOM 0 HB2 LEU B 44 12.477 25.670 -29.200 1.00 20.52 H new ATOM 0 HB3 LEU B 44 11.134 26.463 -29.192 1.00 20.52 H new ATOM 0 HG LEU B 44 12.228 28.370 -28.397 1.00 23.24 H new ATOM 0 HD11 LEU B 44 14.644 28.267 -28.092 1.00 27.19 H new ATOM 0 HD12 LEU B 44 13.951 27.221 -27.126 1.00 27.19 H new ATOM 0 HD13 LEU B 44 14.618 26.731 -28.477 1.00 27.19 H new ATOM 0 HD21 LEU B 44 13.471 28.949 -30.235 1.00 23.73 H new ATOM 0 HD22 LEU B 44 13.485 27.439 -30.711 1.00 23.73 H new ATOM 0 HD23 LEU B 44 12.122 28.245 -30.674 1.00 23.73 H new ATOM 1730 N PHE B 45 9.547 26.977 -27.000 1.00 18.95 N ATOM 1731 CA PHE B 45 8.645 27.929 -26.281 1.00 19.45 C ATOM 1732 C PHE B 45 8.476 27.562 -24.810 1.00 18.76 C ATOM 1733 O PHE B 45 8.593 28.467 -23.944 1.00 18.93 O ATOM 1734 CB PHE B 45 7.270 28.000 -26.936 1.00 18.26 C ATOM 1735 CG PHE B 45 7.152 28.951 -28.089 1.00 19.16 C ATOM 1736 CD1 PHE B 45 7.480 30.293 -27.955 1.00 17.67 C ATOM 1737 CD2 PHE B 45 6.597 28.486 -29.315 1.00 20.67 C ATOM 1738 CE1 PHE B 45 7.312 31.204 -29.017 1.00 16.11 C ATOM 1739 CE2 PHE B 45 6.352 29.355 -30.351 1.00 17.81 C ATOM 1740 CZ PHE B 45 6.735 30.714 -30.242 1.00 17.01 C ATOM 0 H PHE B 45 9.191 26.569 -27.668 1.00 18.95 H new ATOM 0 HA PHE B 45 9.073 28.798 -26.337 1.00 19.45 H new ATOM 0 HB2 PHE B 45 7.029 27.112 -27.244 1.00 18.26 H new ATOM 0 HB3 PHE B 45 6.620 28.252 -26.261 1.00 18.26 H new ATOM 0 HD1 PHE B 45 7.819 30.598 -27.145 1.00 17.67 H new ATOM 0 HD2 PHE B 45 6.398 27.583 -29.416 1.00 20.67 H new ATOM 0 HE1 PHE B 45 7.566 32.094 -28.929 1.00 16.11 H new ATOM 0 HE2 PHE B 45 5.934 29.050 -31.124 1.00 17.81 H new ATOM 0 HZ PHE B 45 6.614 31.290 -30.962 1.00 17.01 H new ATOM 1741 N ARG B 46 8.276 26.280 -24.499 1.00 20.22 N ATOM 1742 CA ARG B 46 8.120 25.854 -23.073 1.00 19.68 C ATOM 1743 C ARG B 46 9.391 26.134 -22.308 1.00 20.84 C ATOM 1744 O ARG B 46 9.398 26.555 -21.143 1.00 18.13 O ATOM 1745 CB ARG B 46 7.743 24.368 -22.990 1.00 21.68 C ATOM 1746 CG ARG B 46 6.254 24.169 -23.404 1.00 25.15 C ATOM 1747 CD ARG B 46 5.744 22.711 -23.039 1.00 34.16 C ATOM 1748 NE ARG B 46 6.601 21.672 -23.550 1.00 42.32 N ATOM 1749 CZ ARG B 46 6.370 21.047 -24.709 1.00 45.71 C ATOM 1750 NH1 ARG B 46 5.287 21.363 -25.449 1.00 47.37 N ATOM 1751 NH2 ARG B 46 7.226 20.146 -25.136 1.00 42.16 N ATOM 0 H ARG B 46 8.226 25.642 -25.074 1.00 20.22 H new ATOM 0 HA ARG B 46 7.401 26.365 -22.670 1.00 19.68 H new ATOM 0 HB2 ARG B 46 8.320 23.848 -23.571 1.00 21.68 H new ATOM 0 HB3 ARG B 46 7.881 24.042 -22.087 1.00 21.68 H new ATOM 0 HG2 ARG B 46 5.701 24.829 -22.957 1.00 25.15 H new ATOM 0 HG3 ARG B 46 6.159 24.318 -24.358 1.00 25.15 H new ATOM 0 HD2 ARG B 46 5.682 22.627 -22.075 1.00 34.16 H new ATOM 0 HD3 ARG B 46 4.849 22.589 -23.393 1.00 34.16 H new ATOM 0 HE ARG B 46 7.291 21.444 -23.090 1.00 42.32 H new ATOM 0 HH11 ARG B 46 4.741 21.969 -25.176 1.00 47.37 H new ATOM 0 HH12 ARG B 46 5.142 20.958 -26.194 1.00 47.37 H new ATOM 0 HH21 ARG B 46 7.926 19.964 -24.671 1.00 42.16 H new ATOM 0 HH22 ARG B 46 7.086 19.739 -25.880 1.00 42.16 H new ATOM 1752 N ALA B 47 10.507 25.833 -22.943 1.00 19.83 N ATOM 1753 CA ALA B 47 11.758 26.000 -22.258 1.00 19.55 C ATOM 1754 C ALA B 47 12.037 27.487 -21.984 1.00 19.43 C ATOM 1755 O ALA B 47 12.462 27.839 -20.874 1.00 16.49 O ATOM 1756 CB ALA B 47 12.965 25.307 -23.067 1.00 20.13 C ATOM 0 H ALA B 47 10.558 25.539 -23.749 1.00 19.83 H new ATOM 0 HA ALA B 47 11.694 25.550 -21.401 1.00 19.55 H new ATOM 0 HB1 ALA B 47 13.795 25.435 -22.582 1.00 20.13 H new ATOM 0 HB2 ALA B 47 12.789 24.358 -23.161 1.00 20.13 H new ATOM 0 HB3 ALA B 47 13.039 25.710 -23.946 1.00 20.13 H new ATOM 1757 N ILE B 48 11.850 28.346 -22.992 1.00 17.40 N ATOM 1758 CA ILE B 48 12.100 29.783 -22.796 1.00 18.64 C ATOM 1759 C ILE B 48 11.068 30.347 -21.777 1.00 18.88 C ATOM 1760 O ILE B 48 11.407 31.192 -20.983 1.00 17.61 O ATOM 1761 CB ILE B 48 12.023 30.535 -24.132 1.00 18.14 C ATOM 1762 CG1 ILE B 48 13.309 30.199 -24.923 1.00 24.63 C ATOM 1763 CG2 ILE B 48 12.088 32.020 -23.942 1.00 16.38 C ATOM 1764 CD1 ILE B 48 13.726 28.889 -24.607 1.00 36.97 C ATOM 0 H ILE B 48 11.585 28.126 -23.780 1.00 17.40 H new ATOM 0 HA ILE B 48 12.995 29.909 -22.443 1.00 18.64 H new ATOM 0 HB ILE B 48 11.194 30.281 -24.567 1.00 18.14 H new ATOM 0 HG12 ILE B 48 13.144 30.275 -25.876 1.00 24.63 H new ATOM 0 HG13 ILE B 48 14.010 30.833 -24.705 1.00 24.63 H new ATOM 0 HG21 ILE B 48 12.037 32.459 -24.805 1.00 16.38 H new ATOM 0 HG22 ILE B 48 11.346 32.308 -23.388 1.00 16.38 H new ATOM 0 HG23 ILE B 48 12.924 32.255 -23.509 1.00 16.38 H new ATOM 0 HD11 ILE B 48 14.532 28.677 -25.103 1.00 36.97 H new ATOM 0 HD12 ILE B 48 13.906 28.827 -23.656 1.00 36.97 H new ATOM 0 HD13 ILE B 48 13.027 28.260 -24.845 1.00 36.97 H new ATOM 1765 N ALA B 49 9.849 29.817 -21.810 1.00 17.44 N ATOM 1766 CA ALA B 49 8.863 30.181 -20.740 1.00 17.26 C ATOM 1767 C ALA B 49 9.441 29.938 -19.349 1.00 17.61 C ATOM 1768 O ALA B 49 9.268 30.757 -18.458 1.00 18.71 O ATOM 1769 CB ALA B 49 7.568 29.342 -20.933 1.00 15.90 C ATOM 0 H ALA B 49 9.563 29.267 -22.406 1.00 17.44 H new ATOM 0 HA ALA B 49 8.659 31.126 -20.814 1.00 17.26 H new ATOM 0 HB1 ALA B 49 6.926 29.573 -20.243 1.00 15.90 H new ATOM 0 HB2 ALA B 49 7.187 29.531 -21.805 1.00 15.90 H new ATOM 0 HB3 ALA B 49 7.782 28.398 -20.871 1.00 15.90 H new ATOM 1770 N TYR B 50 10.108 28.803 -19.128 1.00 17.44 N ATOM 1771 CA TYR B 50 10.746 28.519 -17.863 1.00 17.41 C ATOM 1772 C TYR B 50 11.841 29.565 -17.555 1.00 17.38 C ATOM 1773 O TYR B 50 11.961 30.040 -16.436 1.00 16.91 O ATOM 1774 CB TYR B 50 11.331 27.094 -17.839 1.00 18.00 C ATOM 1775 CG TYR B 50 11.955 26.809 -16.490 1.00 20.17 C ATOM 1776 CD1 TYR B 50 11.154 26.594 -15.322 1.00 26.30 C ATOM 1777 CD2 TYR B 50 13.326 26.905 -16.326 1.00 23.69 C ATOM 1778 CE1 TYR B 50 11.797 26.450 -14.056 1.00 29.62 C ATOM 1779 CE2 TYR B 50 13.924 26.773 -15.118 1.00 26.70 C ATOM 1780 CZ TYR B 50 13.178 26.551 -14.014 1.00 28.01 C ATOM 1781 OH TYR B 50 13.878 26.393 -12.868 1.00 32.65 O ATOM 0 H TYR B 50 10.198 28.181 -19.715 1.00 17.44 H new ATOM 0 HA TYR B 50 10.068 28.573 -17.171 1.00 17.41 H new ATOM 0 HB2 TYR B 50 10.632 26.447 -18.023 1.00 18.00 H new ATOM 0 HB3 TYR B 50 11.997 26.999 -18.538 1.00 18.00 H new ATOM 0 HD1 TYR B 50 10.227 26.549 -15.388 1.00 26.30 H new ATOM 0 HD2 TYR B 50 13.856 27.066 -17.073 1.00 23.69 H new ATOM 0 HE1 TYR B 50 11.304 26.293 -13.283 1.00 29.62 H new ATOM 0 HE2 TYR B 50 14.849 26.835 -15.049 1.00 26.70 H new ATOM 0 HH TYR B 50 13.469 25.863 -12.360 1.00 32.65 H new ATOM 1782 N ALA B 51 12.639 29.942 -18.547 1.00 16.34 N ATOM 1783 CA ALA B 51 13.668 30.983 -18.295 1.00 16.42 C ATOM 1784 C ALA B 51 12.981 32.271 -17.858 1.00 15.61 C ATOM 1785 O ALA B 51 13.503 33.030 -17.057 1.00 16.52 O ATOM 1786 CB ALA B 51 14.439 31.277 -19.596 1.00 16.11 C ATOM 0 H ALA B 51 12.615 29.630 -19.348 1.00 16.34 H new ATOM 0 HA ALA B 51 14.275 30.666 -17.608 1.00 16.42 H new ATOM 0 HB1 ALA B 51 15.110 31.957 -19.428 1.00 16.11 H new ATOM 0 HB2 ALA B 51 14.872 30.466 -19.906 1.00 16.11 H new ATOM 0 HB3 ALA B 51 13.821 31.593 -20.274 1.00 16.11 H new ATOM 1787 N GLU B 52 11.830 32.569 -18.386 1.00 14.64 N ATOM 1788 CA GLU B 52 11.223 33.887 -17.986 1.00 15.42 C ATOM 1789 C GLU B 52 10.586 33.756 -16.587 1.00 16.84 C ATOM 1790 O GLU B 52 10.487 34.749 -15.869 1.00 17.93 O ATOM 1791 CB GLU B 52 10.116 34.256 -18.978 1.00 16.15 C ATOM 1792 CG GLU B 52 10.422 34.202 -20.462 1.00 16.91 C ATOM 1793 CD GLU B 52 11.670 35.012 -20.894 1.00 16.52 C ATOM 1794 OE1 GLU B 52 12.354 35.657 -20.046 1.00 20.69 O ATOM 1795 OE2 GLU B 52 11.806 35.170 -22.183 1.00 16.98 O ATOM 0 H GLU B 52 11.382 32.088 -18.940 1.00 14.64 H new ATOM 0 HA GLU B 52 11.915 34.567 -17.980 1.00 15.42 H new ATOM 0 HB2 GLU B 52 9.363 33.668 -18.811 1.00 16.15 H new ATOM 0 HB3 GLU B 52 9.823 35.157 -18.770 1.00 16.15 H new ATOM 0 HG2 GLU B 52 10.547 33.276 -20.721 1.00 16.91 H new ATOM 0 HG3 GLU B 52 9.652 34.532 -20.951 1.00 16.91 H new ATOM 1796 N PHE B 53 10.159 32.541 -16.219 1.00 16.80 N ATOM 1797 CA PHE B 53 9.851 32.292 -14.767 1.00 17.32 C ATOM 1798 C PHE B 53 11.068 32.584 -13.822 1.00 16.83 C ATOM 1799 O PHE B 53 10.918 33.210 -12.738 1.00 17.17 O ATOM 1800 CB PHE B 53 9.227 30.875 -14.611 1.00 17.66 C ATOM 1801 CG PHE B 53 9.428 30.265 -13.214 1.00 20.35 C ATOM 1802 CD1 PHE B 53 8.453 30.480 -12.229 1.00 23.01 C ATOM 1803 CD2 PHE B 53 10.597 29.551 -12.857 1.00 19.15 C ATOM 1804 CE1 PHE B 53 8.581 29.953 -10.897 1.00 19.09 C ATOM 1805 CE2 PHE B 53 10.781 29.076 -11.509 1.00 24.16 C ATOM 1806 CZ PHE B 53 9.753 29.291 -10.507 1.00 20.97 C ATOM 0 H PHE B 53 10.041 31.872 -16.747 1.00 16.80 H new ATOM 0 HA PHE B 53 9.187 32.932 -14.467 1.00 17.32 H new ATOM 0 HB2 PHE B 53 8.277 30.926 -14.800 1.00 17.66 H new ATOM 0 HB3 PHE B 53 9.617 30.283 -15.273 1.00 17.66 H new ATOM 0 HD1 PHE B 53 7.699 30.980 -12.444 1.00 23.01 H new ATOM 0 HD2 PHE B 53 11.251 29.387 -13.497 1.00 19.15 H new ATOM 0 HE1 PHE B 53 7.882 30.052 -10.291 1.00 19.09 H new ATOM 0 HE2 PHE B 53 11.563 28.629 -11.280 1.00 24.16 H new ATOM 0 HZ PHE B 53 9.869 28.998 -9.632 1.00 20.97 H new ATOM 1807 N VAL B 54 12.248 32.078 -14.208 1.00 14.92 N ATOM 1808 CA VAL B 54 13.441 32.370 -13.456 1.00 15.64 C ATOM 1809 C VAL B 54 13.639 33.890 -13.372 1.00 15.89 C ATOM 1810 O VAL B 54 13.877 34.441 -12.234 1.00 16.19 O ATOM 1811 CB VAL B 54 14.657 31.686 -14.116 1.00 16.75 C ATOM 1812 CG1 VAL B 54 15.958 32.113 -13.323 1.00 19.05 C ATOM 1813 CG2 VAL B 54 14.542 30.200 -14.003 1.00 16.34 C ATOM 0 H VAL B 54 12.363 31.572 -14.894 1.00 14.92 H new ATOM 0 HA VAL B 54 13.352 32.023 -12.554 1.00 15.64 H new ATOM 0 HB VAL B 54 14.697 31.947 -15.049 1.00 16.75 H new ATOM 0 HG11 VAL B 54 16.734 31.692 -13.724 1.00 19.05 H new ATOM 0 HG12 VAL B 54 16.058 33.077 -13.360 1.00 19.05 H new ATOM 0 HG13 VAL B 54 15.880 31.832 -12.398 1.00 19.05 H new ATOM 0 HG21 VAL B 54 15.311 29.783 -14.421 1.00 16.34 H new ATOM 0 HG22 VAL B 54 14.507 29.948 -13.067 1.00 16.34 H new ATOM 0 HG23 VAL B 54 13.733 29.903 -14.448 1.00 16.34 H new ATOM 1814 N HIS B 55 13.482 34.626 -14.486 1.00 15.98 N ATOM 1815 CA HIS B 55 13.716 36.051 -14.392 1.00 16.64 C ATOM 1816 C HIS B 55 12.655 36.767 -13.498 1.00 16.30 C ATOM 1817 O HIS B 55 12.995 37.673 -12.719 1.00 16.03 O ATOM 1818 CB HIS B 55 13.603 36.718 -15.822 1.00 15.56 C ATOM 1819 CG HIS B 55 14.625 36.215 -16.800 1.00 14.92 C ATOM 1820 ND1 HIS B 55 14.470 36.336 -18.184 1.00 17.33 N ATOM 1821 CD2 HIS B 55 15.822 35.609 -16.563 1.00 18.04 C ATOM 1822 CE1 HIS B 55 15.538 35.751 -18.745 1.00 19.58 C ATOM 1823 NE2 HIS B 55 16.371 35.328 -17.794 1.00 18.81 N ATOM 0 H HIS B 55 13.253 34.328 -15.260 1.00 15.98 H new ATOM 0 HA HIS B 55 14.601 36.152 -14.008 1.00 16.64 H new ATOM 0 HB2 HIS B 55 12.716 36.553 -16.179 1.00 15.56 H new ATOM 0 HB3 HIS B 55 13.698 37.679 -15.731 1.00 15.56 H new ATOM 0 HD2 HIS B 55 16.195 35.422 -15.732 1.00 18.04 H new ATOM 0 HE1 HIS B 55 15.677 35.655 -19.660 1.00 19.58 H new ATOM 0 HE2 HIS B 55 17.128 34.942 -17.928 1.00 18.81 H new ATOM 1824 N ALA B 56 11.388 36.378 -13.629 1.00 15.59 N ATOM 1825 CA ALA B 56 10.337 37.084 -12.855 1.00 15.77 C ATOM 1826 C ALA B 56 10.544 36.686 -11.372 1.00 15.83 C ATOM 1827 O ALA B 56 10.393 37.535 -10.479 1.00 15.68 O ATOM 1828 CB ALA B 56 8.945 36.550 -13.333 1.00 16.33 C ATOM 0 H ALA B 56 11.113 35.738 -14.134 1.00 15.59 H new ATOM 0 HA ALA B 56 10.379 38.046 -12.972 1.00 15.77 H new ATOM 0 HB1 ALA B 56 8.240 36.998 -12.840 1.00 16.33 H new ATOM 0 HB2 ALA B 56 8.839 36.726 -14.281 1.00 16.33 H new ATOM 0 HB3 ALA B 56 8.893 35.594 -13.175 1.00 16.33 H new ATOM 1829 N LYS B 57 10.862 35.411 -11.121 1.00 15.75 N ATOM 1830 CA LYS B 57 11.099 34.995 -9.702 1.00 16.12 C ATOM 1831 C LYS B 57 12.240 35.864 -9.130 1.00 17.81 C ATOM 1832 O LYS B 57 12.171 36.311 -7.977 1.00 17.21 O ATOM 1833 CB LYS B 57 11.494 33.505 -9.641 1.00 17.56 C ATOM 1834 CG LYS B 57 11.752 33.140 -8.175 1.00 16.94 C ATOM 1835 CD LYS B 57 11.732 31.604 -8.102 1.00 25.93 C ATOM 1836 CE LYS B 57 13.114 31.112 -8.431 1.00 32.20 C ATOM 1837 NZ LYS B 57 13.299 29.574 -8.118 1.00 32.30 N ATOM 0 H LYS B 57 10.945 34.792 -11.712 1.00 15.75 H new ATOM 0 HA LYS B 57 10.289 35.116 -9.182 1.00 16.12 H new ATOM 0 HB2 LYS B 57 10.787 32.952 -10.008 1.00 17.56 H new ATOM 0 HB3 LYS B 57 12.287 33.343 -10.175 1.00 17.56 H new ATOM 0 HG2 LYS B 57 12.606 33.489 -7.877 1.00 16.94 H new ATOM 0 HG3 LYS B 57 11.072 33.523 -7.598 1.00 16.94 H new ATOM 0 HD2 LYS B 57 11.468 31.309 -7.217 1.00 25.93 H new ATOM 0 HD3 LYS B 57 11.084 31.242 -8.727 1.00 25.93 H new ATOM 0 HE2 LYS B 57 13.296 31.272 -9.370 1.00 32.20 H new ATOM 0 HE3 LYS B 57 13.765 31.623 -7.925 1.00 32.20 H new ATOM 0 HZ1 LYS B 57 13.887 29.474 -7.458 1.00 32.30 H new ATOM 0 HZ2 LYS B 57 12.518 29.224 -7.874 1.00 32.30 H new ATOM 0 HZ3 LYS B 57 13.597 29.156 -8.845 1.00 32.30 H new ATOM 1838 N ASN B 58 13.319 36.019 -9.887 1.00 16.90 N ATOM 1839 CA ASN B 58 14.426 36.898 -9.417 1.00 17.59 C ATOM 1840 C ASN B 58 13.968 38.319 -9.075 1.00 16.36 C ATOM 1841 O ASN B 58 14.274 38.824 -7.985 1.00 16.58 O ATOM 1842 CB ASN B 58 15.530 36.927 -10.467 1.00 14.57 C ATOM 1843 CG ASN B 58 16.246 35.612 -10.563 1.00 21.89 C ATOM 1844 OD1 ASN B 58 16.244 34.779 -9.633 1.00 22.41 O ATOM 1845 ND2 ASN B 58 16.933 35.458 -11.654 1.00 21.25 N ATOM 0 H ASN B 58 13.443 35.646 -10.652 1.00 16.90 H new ATOM 0 HA ASN B 58 14.763 36.520 -8.589 1.00 17.59 H new ATOM 0 HB2 ASN B 58 15.149 37.151 -11.330 1.00 14.57 H new ATOM 0 HB3 ASN B 58 16.166 37.626 -10.248 1.00 14.57 H new ATOM 0 HD21 ASN B 58 17.417 34.755 -11.762 1.00 21.25 H new ATOM 0 HD22 ASN B 58 16.904 36.059 -12.269 1.00 21.25 H new ATOM 1846 N HIS B 59 13.167 38.939 -9.963 1.00 16.62 N ATOM 1847 CA HIS B 59 12.695 40.297 -9.676 1.00 16.38 C ATOM 1848 C HIS B 59 11.805 40.254 -8.441 1.00 18.10 C ATOM 1849 O HIS B 59 11.835 41.173 -7.620 1.00 17.71 O ATOM 1850 CB HIS B 59 11.879 40.850 -10.878 1.00 15.72 C ATOM 1851 CG HIS B 59 12.674 40.952 -12.171 1.00 17.18 C ATOM 1852 ND1 HIS B 59 14.016 41.281 -12.190 1.00 20.41 N ATOM 1853 CD2 HIS B 59 12.302 40.794 -13.454 1.00 16.98 C ATOM 1854 CE1 HIS B 59 14.438 41.356 -13.445 1.00 16.91 C ATOM 1855 NE2 HIS B 59 13.426 41.033 -14.241 1.00 16.55 N ATOM 0 H HIS B 59 12.898 38.602 -10.707 1.00 16.62 H new ATOM 0 HA HIS B 59 13.457 40.877 -9.523 1.00 16.38 H new ATOM 0 HB2 HIS B 59 11.110 40.277 -11.026 1.00 15.72 H new ATOM 0 HB3 HIS B 59 11.538 41.729 -10.649 1.00 15.72 H new ATOM 0 HD2 HIS B 59 11.453 40.568 -13.759 1.00 16.98 H new ATOM 0 HE1 HIS B 59 15.294 41.594 -13.720 1.00 16.91 H new ATOM 0 HE2 HIS B 59 13.459 40.980 -15.099 1.00 16.55 H new ATOM 1856 N PHE B 60 10.924 39.265 -8.396 1.00 15.99 N ATOM 1857 CA PHE B 60 9.944 39.235 -7.307 1.00 18.21 C ATOM 1858 C PHE B 60 10.646 39.120 -5.888 1.00 18.34 C ATOM 1859 O PHE B 60 10.256 39.773 -4.914 1.00 19.80 O ATOM 1860 CB PHE B 60 9.047 38.010 -7.610 1.00 16.65 C ATOM 1861 CG PHE B 60 7.822 37.856 -6.679 1.00 20.40 C ATOM 1862 CD1 PHE B 60 7.778 36.860 -5.690 1.00 22.80 C ATOM 1863 CD2 PHE B 60 6.701 38.607 -6.907 1.00 17.56 C ATOM 1864 CE1 PHE B 60 6.612 36.652 -4.902 1.00 22.83 C ATOM 1865 CE2 PHE B 60 5.545 38.420 -6.160 1.00 24.03 C ATOM 1866 CZ PHE B 60 5.510 37.441 -5.164 1.00 20.73 C ATOM 0 H PHE B 60 10.871 38.620 -8.962 1.00 15.99 H new ATOM 0 HA PHE B 60 9.427 40.055 -7.263 1.00 18.21 H new ATOM 0 HB2 PHE B 60 8.735 38.072 -8.526 1.00 16.65 H new ATOM 0 HB3 PHE B 60 9.587 37.207 -7.548 1.00 16.65 H new ATOM 0 HD1 PHE B 60 8.526 36.326 -5.547 1.00 22.80 H new ATOM 0 HD2 PHE B 60 6.713 39.255 -7.574 1.00 17.56 H new ATOM 0 HE1 PHE B 60 6.593 36.006 -4.233 1.00 22.83 H new ATOM 0 HE2 PHE B 60 4.795 38.946 -6.323 1.00 24.03 H new ATOM 0 HZ PHE B 60 4.732 37.319 -4.670 1.00 20.73 H new ATOM 1867 N ILE B 61 11.674 38.277 -5.814 1.00 18.87 N ATOM 1868 CA ILE B 61 12.490 38.154 -4.610 1.00 18.70 C ATOM 1869 C ILE B 61 13.303 39.394 -4.341 1.00 18.36 C ATOM 1870 O ILE B 61 13.349 39.837 -3.203 1.00 18.98 O ATOM 1871 CB ILE B 61 13.421 36.895 -4.745 1.00 20.05 C ATOM 1872 CG1 ILE B 61 12.518 35.650 -4.710 1.00 21.75 C ATOM 1873 CG2 ILE B 61 14.404 36.903 -3.657 1.00 22.45 C ATOM 1874 CD1 ILE B 61 13.338 34.302 -4.898 1.00 22.17 C ATOM 0 H ILE B 61 11.917 37.762 -6.459 1.00 18.87 H new ATOM 0 HA ILE B 61 11.896 38.044 -3.851 1.00 18.70 H new ATOM 0 HB ILE B 61 13.919 36.898 -5.577 1.00 20.05 H new ATOM 0 HG12 ILE B 61 12.043 35.622 -3.865 1.00 21.75 H new ATOM 0 HG13 ILE B 61 11.849 35.719 -5.409 1.00 21.75 H new ATOM 0 HG21 ILE B 61 14.981 36.127 -3.736 1.00 22.45 H new ATOM 0 HG22 ILE B 61 14.939 37.710 -3.710 1.00 22.45 H new ATOM 0 HG23 ILE B 61 13.943 36.877 -2.804 1.00 22.45 H new ATOM 0 HD11 ILE B 61 12.730 33.547 -4.869 1.00 22.17 H new ATOM 0 HD12 ILE B 61 13.794 34.317 -5.754 1.00 22.17 H new ATOM 0 HD13 ILE B 61 13.991 34.218 -4.186 1.00 22.17 H new ATOM 1875 N ALA B 62 13.805 40.070 -5.361 1.00 17.50 N ATOM 1876 CA ALA B 62 14.533 41.328 -5.178 1.00 21.10 C ATOM 1877 C ALA B 62 13.606 42.434 -4.586 1.00 21.21 C ATOM 1878 O ALA B 62 14.027 43.231 -3.773 1.00 22.59 O ATOM 1879 CB ALA B 62 15.118 41.788 -6.536 1.00 17.81 C ATOM 0 H ALA B 62 13.737 39.818 -6.180 1.00 17.50 H new ATOM 0 HA ALA B 62 15.255 41.179 -4.548 1.00 21.10 H new ATOM 0 HB1 ALA B 62 15.600 42.621 -6.415 1.00 17.81 H new ATOM 0 HB2 ALA B 62 15.724 41.110 -6.874 1.00 17.81 H new ATOM 0 HB3 ALA B 62 14.397 41.921 -7.171 1.00 17.81 H new ATOM 1880 N LEU B 63 12.341 42.385 -4.947 1.00 21.17 N ATOM 1881 CA LEU B 63 11.318 43.288 -4.373 1.00 20.45 C ATOM 1882 C LEU B 63 10.852 42.871 -2.962 1.00 23.30 C ATOM 1883 O LEU B 63 10.025 43.595 -2.355 1.00 21.79 O ATOM 1884 CB LEU B 63 10.099 43.290 -5.262 1.00 20.22 C ATOM 1885 CG LEU B 63 10.329 44.085 -6.570 1.00 21.21 C ATOM 1886 CD1 LEU B 63 9.217 43.627 -7.618 1.00 23.23 C ATOM 1887 CD2 LEU B 63 10.347 45.598 -6.311 1.00 25.22 C ATOM 0 H LEU B 63 12.034 41.833 -5.531 1.00 21.17 H new ATOM 0 HA LEU B 63 11.734 44.162 -4.311 1.00 20.45 H new ATOM 0 HB2 LEU B 63 9.858 42.376 -5.479 1.00 20.22 H new ATOM 0 HB3 LEU B 63 9.350 43.674 -4.780 1.00 20.22 H new ATOM 0 HG LEU B 63 11.203 43.891 -6.944 1.00 21.21 H new ATOM 0 HD11 LEU B 63 9.337 44.111 -8.450 1.00 23.23 H new ATOM 0 HD12 LEU B 63 9.300 42.675 -7.783 1.00 23.23 H new ATOM 0 HD13 LEU B 63 8.336 43.816 -7.259 1.00 23.23 H new ATOM 0 HD21 LEU B 63 10.493 46.068 -7.147 1.00 25.22 H new ATOM 0 HD22 LEU B 63 9.498 45.871 -5.930 1.00 25.22 H new ATOM 0 HD23 LEU B 63 11.062 45.812 -5.692 1.00 25.22 H new ATOM 1888 N GLY B 64 11.311 41.709 -2.474 1.00 22.74 N ATOM 1889 CA GLY B 64 10.943 41.308 -1.081 1.00 22.79 C ATOM 1890 C GLY B 64 9.596 40.617 -0.972 1.00 23.99 C ATOM 1891 O GLY B 64 9.040 40.479 0.140 1.00 22.90 O ATOM 0 H GLY B 64 11.813 41.155 -2.900 1.00 22.74 H new ATOM 0 HA2 GLY B 64 11.628 40.716 -0.733 1.00 22.79 H new ATOM 0 HA3 GLY B 64 10.937 42.098 -0.518 1.00 22.79 H new ATOM 1892 N LYS B 65 9.000 40.220 -2.098 1.00 22.12 N ATOM 1893 CA LYS B 65 7.595 39.798 -2.085 1.00 24.09 C ATOM 1894 C LYS B 65 7.324 38.335 -1.743 1.00 24.26 C ATOM 1895 O LYS B 65 6.166 37.916 -1.641 1.00 26.38 O ATOM 1896 CB LYS B 65 6.924 40.102 -3.448 1.00 23.94 C ATOM 1897 CG LYS B 65 6.944 41.561 -3.747 1.00 31.42 C ATOM 1898 CD LYS B 65 6.045 42.225 -2.903 1.00 40.32 C ATOM 1899 CE LYS B 65 4.770 42.634 -3.673 1.00 46.93 C ATOM 1900 NZ LYS B 65 5.024 43.802 -4.567 1.00 43.55 N ATOM 0 H LYS B 65 9.382 40.187 -2.868 1.00 22.12 H new ATOM 0 HA LYS B 65 7.216 40.317 -1.358 1.00 24.09 H new ATOM 0 HB2 LYS B 65 7.384 39.619 -4.152 1.00 23.94 H new ATOM 0 HB3 LYS B 65 6.008 39.784 -3.438 1.00 23.94 H new ATOM 0 HG2 LYS B 65 7.839 41.914 -3.623 1.00 31.42 H new ATOM 0 HG3 LYS B 65 6.705 41.714 -4.674 1.00 31.42 H new ATOM 0 HD2 LYS B 65 5.808 41.649 -2.159 1.00 40.32 H new ATOM 0 HD3 LYS B 65 6.468 43.013 -2.528 1.00 40.32 H new ATOM 0 HE2 LYS B 65 4.454 41.884 -4.200 1.00 46.93 H new ATOM 0 HE3 LYS B 65 4.066 42.854 -3.043 1.00 46.93 H new ATOM 0 HZ1 LYS B 65 4.251 44.106 -4.885 1.00 43.55 H new ATOM 0 HZ2 LYS B 65 5.429 44.447 -4.106 1.00 43.55 H new ATOM 0 HZ3 LYS B 65 5.544 43.550 -5.244 1.00 43.55 H new ATOM 1901 N LEU B 66 8.360 37.532 -1.660 1.00 21.42 N ATOM 1902 CA LEU B 66 8.136 36.159 -1.422 1.00 21.65 C ATOM 1903 C LEU B 66 8.333 35.972 0.095 1.00 24.26 C ATOM 1904 O LEU B 66 9.349 36.365 0.652 1.00 25.60 O ATOM 1905 CB LEU B 66 9.153 35.295 -2.152 1.00 21.23 C ATOM 1906 CG LEU B 66 9.083 33.762 -2.022 1.00 23.66 C ATOM 1907 CD1 LEU B 66 7.656 33.274 -2.394 1.00 21.84 C ATOM 1908 CD2 LEU B 66 10.200 33.057 -2.873 1.00 24.00 C ATOM 0 H LEU B 66 9.183 37.769 -1.739 1.00 21.42 H new ATOM 0 HA LEU B 66 7.255 35.897 -1.732 1.00 21.65 H new ATOM 0 HB2 LEU B 66 9.091 35.509 -3.096 1.00 21.23 H new ATOM 0 HB3 LEU B 66 10.034 35.571 -1.856 1.00 21.23 H new ATOM 0 HG LEU B 66 9.256 33.514 -1.100 1.00 23.66 H new ATOM 0 HD11 LEU B 66 7.612 32.308 -2.312 1.00 21.84 H new ATOM 0 HD12 LEU B 66 7.009 33.679 -1.795 1.00 21.84 H new ATOM 0 HD13 LEU B 66 7.454 33.530 -3.308 1.00 21.84 H new ATOM 0 HD21 LEU B 66 10.128 32.095 -2.769 1.00 24.00 H new ATOM 0 HD22 LEU B 66 10.090 33.290 -3.808 1.00 24.00 H new ATOM 0 HD23 LEU B 66 11.073 33.350 -2.568 1.00 24.00 H new ATOM 1909 N GLY B 67 7.374 35.324 0.714 1.00 24.04 N ATOM 1910 CA GLY B 67 7.525 34.959 2.147 1.00 25.12 C ATOM 1911 C GLY B 67 7.343 33.437 2.344 1.00 25.27 C ATOM 1912 O GLY B 67 7.578 32.574 1.458 1.00 24.34 O ATOM 0 H GLY B 67 6.633 35.080 0.351 1.00 24.04 H new ATOM 0 HA2 GLY B 67 8.401 35.228 2.464 1.00 25.12 H new ATOM 0 HA3 GLY B 67 6.871 35.439 2.679 1.00 25.12 H new ATOM 1913 N LYS B 68 6.988 33.075 3.582 1.00 24.61 N ATOM 1914 CA LYS B 68 6.599 31.720 3.909 1.00 25.21 C ATOM 1915 C LYS B 68 5.197 31.411 3.416 1.00 24.38 C ATOM 1916 O LYS B 68 4.457 32.324 3.087 1.00 25.02 O ATOM 1917 CB LYS B 68 6.609 31.563 5.446 1.00 23.66 C ATOM 1918 CG LYS B 68 7.977 31.861 5.970 1.00 26.57 C ATOM 1919 CD LYS B 68 7.895 31.626 7.539 1.00 28.79 C ATOM 1920 CE LYS B 68 9.038 32.378 8.111 1.00 36.68 C ATOM 1921 NZ LYS B 68 8.986 32.444 9.600 1.00 38.31 N ATOM 0 H LYS B 68 6.969 33.617 4.250 1.00 24.61 H new ATOM 0 HA LYS B 68 7.223 31.113 3.482 1.00 25.21 H new ATOM 0 HB2 LYS B 68 5.961 32.164 5.846 1.00 23.66 H new ATOM 0 HB3 LYS B 68 6.348 30.661 5.690 1.00 23.66 H new ATOM 0 HG2 LYS B 68 8.640 31.280 5.565 1.00 26.57 H new ATOM 0 HG3 LYS B 68 8.237 32.773 5.767 1.00 26.57 H new ATOM 0 HD2 LYS B 68 7.052 31.946 7.897 1.00 28.79 H new ATOM 0 HD3 LYS B 68 7.955 30.682 7.755 1.00 28.79 H new ATOM 0 HE2 LYS B 68 9.868 31.958 7.837 1.00 36.68 H new ATOM 0 HE3 LYS B 68 9.043 33.278 7.750 1.00 36.68 H new ATOM 0 HZ1 LYS B 68 9.687 32.902 9.902 1.00 38.31 H new ATOM 0 HZ2 LYS B 68 8.236 32.850 9.853 1.00 38.31 H new ATOM 0 HZ3 LYS B 68 9.004 31.620 9.935 1.00 38.31 H new ATOM 1922 N THR B 69 4.862 30.139 3.346 1.00 24.91 N ATOM 1923 CA THR B 69 3.603 29.688 2.744 1.00 24.80 C ATOM 1924 C THR B 69 2.308 30.415 3.250 1.00 26.15 C ATOM 1925 O THR B 69 1.454 30.858 2.454 1.00 26.15 O ATOM 1926 CB THR B 69 3.512 28.163 2.788 1.00 27.11 C ATOM 1927 OG1 THR B 69 4.544 27.593 1.977 1.00 25.88 O ATOM 1928 CG2 THR B 69 2.241 27.643 2.181 1.00 25.99 C ATOM 0 H THR B 69 5.355 29.501 3.645 1.00 24.91 H new ATOM 0 HA THR B 69 3.635 29.965 1.815 1.00 24.80 H new ATOM 0 HB THR B 69 3.574 27.925 3.726 1.00 27.11 H new ATOM 0 HG1 THR B 69 5.196 27.380 2.462 1.00 25.88 H new ATOM 0 HG21 THR B 69 2.230 26.674 2.232 1.00 25.99 H new ATOM 0 HG22 THR B 69 1.481 28.001 2.666 1.00 25.99 H new ATOM 0 HG23 THR B 69 2.190 27.918 1.252 1.00 25.99 H new ATOM 1929 N PRO B 70 2.106 30.518 4.578 1.00 25.34 N ATOM 1930 CA PRO B 70 0.909 31.199 5.035 1.00 26.02 C ATOM 1931 C PRO B 70 0.827 32.626 4.484 1.00 25.16 C ATOM 1932 O PRO B 70 -0.237 33.062 4.089 1.00 25.85 O ATOM 1933 CB PRO B 70 1.157 31.300 6.566 1.00 27.32 C ATOM 1934 CG PRO B 70 1.914 30.008 6.850 1.00 26.74 C ATOM 1935 CD PRO B 70 2.884 29.927 5.684 1.00 25.83 C ATOM 0 HA PRO B 70 0.098 30.740 4.765 1.00 26.02 H new ATOM 0 HB2 PRO B 70 1.678 32.085 6.799 1.00 27.32 H new ATOM 0 HB3 PRO B 70 0.327 31.352 7.066 1.00 27.32 H new ATOM 0 HG2 PRO B 70 2.377 30.041 7.702 1.00 26.74 H new ATOM 0 HG3 PRO B 70 1.320 29.241 6.879 1.00 26.74 H new ATOM 0 HD2 PRO B 70 3.699 30.423 5.857 1.00 25.83 H new ATOM 0 HD3 PRO B 70 3.144 29.012 5.494 1.00 25.83 H new ATOM 1936 N GLU B 71 1.915 33.377 4.485 1.00 24.26 N ATOM 1937 CA GLU B 71 1.904 34.741 3.914 1.00 23.86 C ATOM 1938 C GLU B 71 1.710 34.779 2.365 1.00 22.52 C ATOM 1939 O GLU B 71 1.033 35.675 1.866 1.00 21.53 O ATOM 1940 CB GLU B 71 3.234 35.442 4.169 1.00 27.17 C ATOM 1941 CG GLU B 71 3.441 35.784 5.668 1.00 36.96 C ATOM 1942 CD GLU B 71 3.487 34.513 6.611 1.00 51.21 C ATOM 1943 OE1 GLU B 71 4.206 33.534 6.299 1.00 52.37 O ATOM 1944 OE2 GLU B 71 2.761 34.487 7.663 1.00 57.64 O ATOM 0 H GLU B 71 2.673 33.129 4.807 1.00 24.26 H new ATOM 0 HA GLU B 71 1.154 35.176 4.349 1.00 23.86 H new ATOM 0 HB2 GLU B 71 3.960 34.874 3.866 1.00 27.17 H new ATOM 0 HB3 GLU B 71 3.273 36.257 3.645 1.00 27.17 H new ATOM 0 HG2 GLU B 71 4.269 36.280 5.767 1.00 36.96 H new ATOM 0 HG3 GLU B 71 2.724 36.368 5.960 1.00 36.96 H new ATOM 1945 N ASN B 72 2.263 33.778 1.681 1.00 19.00 N ATOM 1946 CA ASN B 72 2.089 33.684 0.215 1.00 19.83 C ATOM 1947 C ASN B 72 0.621 33.363 -0.027 1.00 21.00 C ATOM 1948 O ASN B 72 -0.003 33.945 -0.934 1.00 22.07 O ATOM 1949 CB ASN B 72 2.984 32.566 -0.297 1.00 19.89 C ATOM 1950 CG ASN B 72 4.437 32.892 -0.095 1.00 17.40 C ATOM 1951 OD1 ASN B 72 4.763 34.044 0.039 1.00 20.03 O ATOM 1952 ND2 ASN B 72 5.295 31.910 -0.124 1.00 19.34 N ATOM 0 H ASN B 72 2.735 33.150 2.031 1.00 19.00 H new ATOM 0 HA ASN B 72 2.329 34.504 -0.245 1.00 19.83 H new ATOM 0 HB2 ASN B 72 2.769 31.740 0.164 1.00 19.89 H new ATOM 0 HB3 ASN B 72 2.812 32.418 -1.240 1.00 19.89 H new ATOM 0 HD21 ASN B 72 6.136 32.071 -0.046 1.00 19.34 H new ATOM 0 HD22 ASN B 72 5.020 31.101 -0.222 1.00 19.34 H new ATOM 1953 N LEU B 73 0.008 32.475 0.808 1.00 20.63 N ATOM 1954 CA LEU B 73 -1.426 32.176 0.672 1.00 21.66 C ATOM 1955 C LEU B 73 -2.281 33.432 0.856 1.00 22.50 C ATOM 1956 O LEU B 73 -3.292 33.676 0.153 1.00 21.79 O ATOM 1957 CB LEU B 73 -1.874 31.011 1.642 1.00 19.75 C ATOM 1958 CG LEU B 73 -1.467 29.614 1.178 1.00 23.39 C ATOM 1959 CD1 LEU B 73 -1.557 28.673 2.365 1.00 23.85 C ATOM 1960 CD2 LEU B 73 -2.377 29.155 0.038 1.00 20.01 C ATOM 0 H LEU B 73 0.406 32.051 1.442 1.00 20.63 H new ATOM 0 HA LEU B 73 -1.572 31.861 -0.234 1.00 21.66 H new ATOM 0 HB2 LEU B 73 -1.495 31.172 2.520 1.00 19.75 H new ATOM 0 HB3 LEU B 73 -2.839 31.039 1.740 1.00 19.75 H new ATOM 0 HG LEU B 73 -0.557 29.620 0.842 1.00 23.39 H new ATOM 0 HD11 LEU B 73 -1.302 27.779 2.089 1.00 23.85 H new ATOM 0 HD12 LEU B 73 -0.960 28.978 3.066 1.00 23.85 H new ATOM 0 HD13 LEU B 73 -2.467 28.660 2.700 1.00 23.85 H new ATOM 0 HD21 LEU B 73 -2.112 28.268 -0.251 1.00 20.01 H new ATOM 0 HD22 LEU B 73 -3.296 29.133 0.346 1.00 20.01 H new ATOM 0 HD23 LEU B 73 -2.301 29.773 -0.706 1.00 20.01 H new ATOM 1961 N GLN B 74 -1.874 34.266 1.807 1.00 21.72 N ATOM 1962 CA GLN B 74 -2.602 35.513 2.084 1.00 22.39 C ATOM 1963 C GLN B 74 -2.535 36.478 0.863 1.00 22.49 C ATOM 1964 O GLN B 74 -3.503 37.173 0.557 1.00 21.72 O ATOM 1965 CB GLN B 74 -2.017 36.215 3.315 1.00 23.86 C ATOM 1966 CG GLN B 74 -2.750 37.524 3.714 1.00 26.77 C ATOM 1967 CD GLN B 74 -4.282 37.374 4.012 1.00 31.28 C ATOM 1968 OE1 GLN B 74 -4.789 36.333 4.425 1.00 30.24 O ATOM 1969 NE2 GLN B 74 -5.016 38.447 3.762 1.00 33.97 N ATOM 0 H GLN B 74 -1.184 34.135 2.303 1.00 21.72 H new ATOM 0 HA GLN B 74 -3.529 35.282 2.255 1.00 22.39 H new ATOM 0 HB2 GLN B 74 -2.041 35.602 4.066 1.00 23.86 H new ATOM 0 HB3 GLN B 74 -1.084 36.418 3.145 1.00 23.86 H new ATOM 0 HG2 GLN B 74 -2.318 37.892 4.501 1.00 26.77 H new ATOM 0 HG3 GLN B 74 -2.637 38.171 3.000 1.00 26.77 H new ATOM 0 HE21 GLN B 74 -4.642 39.166 3.474 1.00 33.97 H new ATOM 0 HE22 GLN B 74 -5.866 38.425 3.888 1.00 33.97 H new ATOM 1970 N MET B 75 -1.403 36.539 0.180 1.00 21.66 N ATOM 1971 CA MET B 75 -1.334 37.348 -1.040 1.00 23.17 C ATOM 1972 C MET B 75 -2.319 36.802 -2.107 1.00 22.40 C ATOM 1973 O MET B 75 -3.001 37.588 -2.761 1.00 21.77 O ATOM 1974 CB MET B 75 0.150 37.455 -1.503 1.00 24.49 C ATOM 1975 CG MET B 75 0.374 38.496 -2.616 1.00 34.49 C ATOM 1976 SD MET B 75 2.165 38.694 -3.102 1.00 40.37 S ATOM 1977 CE MET B 75 2.842 38.652 -1.478 1.00 32.28 C ATOM 0 H MET B 75 -0.676 36.132 0.394 1.00 21.66 H new ATOM 0 HA MET B 75 -1.628 38.257 -0.874 1.00 23.17 H new ATOM 0 HB2 MET B 75 0.703 37.684 -0.740 1.00 24.49 H new ATOM 0 HB3 MET B 75 0.446 36.587 -1.818 1.00 24.49 H new ATOM 0 HG2 MET B 75 -0.139 38.238 -3.398 1.00 34.49 H new ATOM 0 HG3 MET B 75 0.030 39.354 -2.321 1.00 34.49 H new ATOM 0 HE1 MET B 75 3.766 38.947 -1.505 1.00 32.28 H new ATOM 0 HE2 MET B 75 2.332 39.240 -0.899 1.00 32.28 H new ATOM 0 HE3 MET B 75 2.802 37.746 -1.134 1.00 32.28 H new ATOM 1978 N GLY B 76 -2.401 35.475 -2.203 1.00 21.58 N ATOM 1979 CA GLY B 76 -3.334 34.730 -3.076 1.00 21.90 C ATOM 1980 C GLY B 76 -4.795 35.146 -2.718 1.00 22.75 C ATOM 1981 O GLY B 76 -5.601 35.515 -3.580 1.00 21.18 O ATOM 0 H GLY B 76 -1.894 34.954 -1.743 1.00 21.58 H new ATOM 0 HA2 GLY B 76 -3.148 34.923 -4.008 1.00 21.90 H new ATOM 0 HA3 GLY B 76 -3.217 33.775 -2.955 1.00 21.90 H new ATOM 1982 N ILE B 77 -5.122 35.066 -1.433 1.00 20.28 N ATOM 1983 CA ILE B 77 -6.441 35.463 -0.966 1.00 20.51 C ATOM 1984 C ILE B 77 -6.768 36.909 -1.330 1.00 18.94 C ATOM 1985 O ILE B 77 -7.832 37.176 -1.866 1.00 21.74 O ATOM 1986 CB ILE B 77 -6.553 35.232 0.627 1.00 18.92 C ATOM 1987 CG1 ILE B 77 -6.527 33.752 0.917 1.00 24.03 C ATOM 1988 CG2 ILE B 77 -7.903 35.900 1.179 1.00 23.55 C ATOM 1989 CD1 ILE B 77 -6.097 33.488 2.362 1.00 25.64 C ATOM 0 H ILE B 77 -4.593 34.784 -0.816 1.00 20.28 H new ATOM 0 HA ILE B 77 -7.095 34.905 -1.415 1.00 20.51 H new ATOM 0 HB ILE B 77 -5.802 35.651 1.076 1.00 18.92 H new ATOM 0 HG12 ILE B 77 -7.406 33.373 0.762 1.00 24.03 H new ATOM 0 HG13 ILE B 77 -5.916 33.310 0.307 1.00 24.03 H new ATOM 0 HG21 ILE B 77 -7.966 35.759 2.137 1.00 23.55 H new ATOM 0 HG22 ILE B 77 -7.893 36.852 0.993 1.00 23.55 H new ATOM 0 HG23 ILE B 77 -8.668 35.494 0.742 1.00 23.55 H new ATOM 0 HD11 ILE B 77 -6.087 32.532 2.527 1.00 25.64 H new ATOM 0 HD12 ILE B 77 -5.209 33.850 2.507 1.00 25.64 H new ATOM 0 HD13 ILE B 77 -6.722 33.914 2.969 1.00 25.64 H new ATOM 1990 N GLU B 78 -5.851 37.845 -1.126 1.00 21.06 N ATOM 1991 CA GLU B 78 -6.159 39.234 -1.398 1.00 22.46 C ATOM 1992 C GLU B 78 -6.314 39.523 -2.868 1.00 22.27 C ATOM 1993 O GLU B 78 -7.184 40.300 -3.238 1.00 21.43 O ATOM 1994 CB GLU B 78 -5.069 40.081 -0.890 1.00 23.67 C ATOM 1995 CG GLU B 78 -5.295 40.122 0.687 1.00 27.97 C ATOM 1996 CD GLU B 78 -4.022 40.575 1.410 1.00 42.92 C ATOM 1997 OE1 GLU B 78 -2.956 40.789 0.743 1.00 51.41 O ATOM 1998 OE2 GLU B 78 -4.069 40.672 2.650 1.00 41.14 O ATOM 0 H GLU B 78 -5.056 37.697 -0.834 1.00 21.06 H new ATOM 0 HA GLU B 78 -7.003 39.424 -0.959 1.00 22.46 H new ATOM 0 HB2 GLU B 78 -4.201 39.710 -1.113 1.00 23.67 H new ATOM 0 HB3 GLU B 78 -5.105 40.971 -1.275 1.00 23.67 H new ATOM 0 HG2 GLU B 78 -6.024 40.727 0.898 1.00 27.97 H new ATOM 0 HG3 GLU B 78 -5.556 39.243 1.003 1.00 27.97 H new ATOM 1999 N GLY B 79 -5.470 38.885 -3.665 1.00 19.37 N ATOM 2000 CA GLY B 79 -5.576 39.081 -5.136 1.00 19.82 C ATOM 2001 C GLY B 79 -6.870 38.466 -5.595 1.00 19.68 C ATOM 2002 O GLY B 79 -7.562 39.074 -6.433 1.00 21.34 O ATOM 0 H GLY B 79 -4.847 38.352 -3.405 1.00 19.37 H new ATOM 0 HA2 GLY B 79 -5.553 40.026 -5.355 1.00 19.82 H new ATOM 0 HA3 GLY B 79 -4.824 38.667 -5.588 1.00 19.82 H new ATOM 2003 N GLU B 80 -7.181 37.219 -5.197 1.00 18.11 N ATOM 2004 CA GLU B 80 -8.433 36.543 -5.687 1.00 19.04 C ATOM 2005 C GLU B 80 -9.664 37.371 -5.260 1.00 19.75 C ATOM 2006 O GLU B 80 -10.634 37.542 -6.049 1.00 19.73 O ATOM 2007 CB GLU B 80 -8.559 35.167 -5.119 1.00 19.94 C ATOM 2008 CG GLU B 80 -7.391 34.221 -5.668 1.00 19.97 C ATOM 2009 CD GLU B 80 -7.546 33.770 -7.138 1.00 23.34 C ATOM 2010 OE1 GLU B 80 -8.531 33.899 -7.867 1.00 18.73 O ATOM 2011 OE2 GLU B 80 -6.671 33.162 -7.767 1.00 25.56 O ATOM 0 H GLU B 80 -6.703 36.748 -4.659 1.00 18.11 H new ATOM 0 HA GLU B 80 -8.384 36.480 -6.654 1.00 19.04 H new ATOM 0 HB2 GLU B 80 -8.521 35.207 -4.151 1.00 19.94 H new ATOM 0 HB3 GLU B 80 -9.422 34.793 -5.354 1.00 19.94 H new ATOM 0 HG2 GLU B 80 -6.546 34.688 -5.575 1.00 19.97 H new ATOM 0 HG3 GLU B 80 -7.342 33.432 -5.106 1.00 19.97 H new ATOM 2012 N THR B 81 -9.598 37.863 -4.011 1.00 21.09 N ATOM 2013 CA THR B 81 -10.712 38.684 -3.482 1.00 22.41 C ATOM 2014 C THR B 81 -10.924 39.989 -4.274 1.00 19.88 C ATOM 2015 O THR B 81 -12.079 40.309 -4.629 1.00 22.21 O ATOM 2016 CB THR B 81 -10.526 38.918 -1.919 1.00 22.26 C ATOM 2017 OG1 THR B 81 -10.548 37.606 -1.379 1.00 22.00 O ATOM 2018 CG2 THR B 81 -11.739 39.729 -1.380 1.00 26.00 C ATOM 0 H THR B 81 -8.942 37.740 -3.468 1.00 21.09 H new ATOM 0 HA THR B 81 -11.536 38.188 -3.607 1.00 22.41 H new ATOM 0 HB THR B 81 -9.718 39.405 -1.693 1.00 22.26 H new ATOM 0 HG1 THR B 81 -9.777 37.274 -1.418 1.00 22.00 H new ATOM 0 HG21 THR B 81 -11.633 39.876 -0.427 1.00 26.00 H new ATOM 0 HG22 THR B 81 -11.785 40.584 -1.835 1.00 26.00 H new ATOM 0 HG23 THR B 81 -12.557 39.233 -1.541 1.00 26.00 H new ATOM 2019 N PHE B 82 -9.822 40.667 -4.637 1.00 20.69 N ATOM 2020 CA PHE B 82 -9.901 41.852 -5.472 1.00 19.62 C ATOM 2021 C PHE B 82 -10.569 41.481 -6.834 1.00 19.07 C ATOM 2022 O PHE B 82 -11.451 42.239 -7.354 1.00 18.86 O ATOM 2023 CB PHE B 82 -8.457 42.373 -5.690 1.00 21.44 C ATOM 2024 CG PHE B 82 -8.333 43.394 -6.829 1.00 21.64 C ATOM 2025 CD1 PHE B 82 -7.647 43.071 -7.981 1.00 22.88 C ATOM 2026 CD2 PHE B 82 -8.929 44.641 -6.710 1.00 26.35 C ATOM 2027 CE1 PHE B 82 -7.568 44.022 -9.044 1.00 25.55 C ATOM 2028 CE2 PHE B 82 -8.882 45.575 -7.734 1.00 31.26 C ATOM 2029 CZ PHE B 82 -8.190 45.242 -8.925 1.00 24.95 C ATOM 0 H PHE B 82 -9.024 40.448 -4.404 1.00 20.69 H new ATOM 0 HA PHE B 82 -10.437 42.542 -5.051 1.00 19.62 H new ATOM 0 HB2 PHE B 82 -8.141 42.778 -4.868 1.00 21.44 H new ATOM 0 HB3 PHE B 82 -7.875 41.620 -5.877 1.00 21.44 H new ATOM 0 HD1 PHE B 82 -7.239 42.240 -8.065 1.00 22.88 H new ATOM 0 HD2 PHE B 82 -9.372 44.857 -5.921 1.00 26.35 H new ATOM 0 HE1 PHE B 82 -7.095 43.815 -9.818 1.00 25.55 H new ATOM 0 HE2 PHE B 82 -9.296 46.403 -7.641 1.00 31.26 H new ATOM 0 HZ PHE B 82 -8.157 45.850 -9.628 1.00 24.95 H new ATOM 2030 N GLU B 83 -10.149 40.368 -7.466 1.00 16.04 N ATOM 2031 CA GLU B 83 -10.723 40.071 -8.739 1.00 17.56 C ATOM 2032 C GLU B 83 -12.179 39.720 -8.647 1.00 18.72 C ATOM 2033 O GLU B 83 -12.949 40.053 -9.558 1.00 18.62 O ATOM 2034 CB GLU B 83 -10.030 38.816 -9.325 1.00 19.17 C ATOM 2035 CG GLU B 83 -8.608 39.222 -9.637 1.00 23.69 C ATOM 2036 CD GLU B 83 -7.808 38.096 -10.210 1.00 37.91 C ATOM 2037 OE1 GLU B 83 -8.083 36.912 -9.925 1.00 37.95 O ATOM 2038 OE2 GLU B 83 -6.856 38.429 -10.949 1.00 47.83 O ATOM 0 H GLU B 83 -9.562 39.812 -7.174 1.00 16.04 H new ATOM 0 HA GLU B 83 -10.608 40.865 -9.284 1.00 17.56 H new ATOM 0 HB2 GLU B 83 -10.049 38.083 -8.691 1.00 19.17 H new ATOM 0 HB3 GLU B 83 -10.486 38.511 -10.125 1.00 19.17 H new ATOM 0 HG2 GLU B 83 -8.616 39.962 -10.264 1.00 23.69 H new ATOM 0 HG3 GLU B 83 -8.180 39.541 -8.827 1.00 23.69 H new ATOM 2039 N VAL B 84 -12.564 39.018 -7.584 1.00 18.83 N ATOM 2040 CA VAL B 84 -14.010 38.603 -7.371 1.00 19.44 C ATOM 2041 C VAL B 84 -14.916 39.827 -7.059 1.00 20.39 C ATOM 2042 O VAL B 84 -16.047 39.906 -7.591 1.00 21.16 O ATOM 2043 CB VAL B 84 -14.110 37.632 -6.147 1.00 20.96 C ATOM 2044 CG1 VAL B 84 -15.607 37.454 -5.681 1.00 21.39 C ATOM 2045 CG2 VAL B 84 -13.566 36.314 -6.509 1.00 21.18 C ATOM 0 H VAL B 84 -12.028 38.760 -6.963 1.00 18.83 H new ATOM 0 HA VAL B 84 -14.306 38.175 -8.190 1.00 19.44 H new ATOM 0 HB VAL B 84 -13.598 38.018 -5.419 1.00 20.96 H new ATOM 0 HG11 VAL B 84 -15.641 36.849 -4.923 1.00 21.39 H new ATOM 0 HG12 VAL B 84 -15.970 38.316 -5.423 1.00 21.39 H new ATOM 0 HG13 VAL B 84 -16.132 37.088 -6.410 1.00 21.39 H new ATOM 0 HG21 VAL B 84 -13.630 35.717 -5.747 1.00 21.18 H new ATOM 0 HG22 VAL B 84 -14.072 35.947 -7.251 1.00 21.18 H new ATOM 0 HG23 VAL B 84 -12.636 36.408 -6.768 1.00 21.18 H new ATOM 2046 N GLU B 85 -14.462 40.716 -6.160 1.00 20.68 N ATOM 2047 CA GLU B 85 -15.318 41.796 -5.663 1.00 22.83 C ATOM 2048 C GLU B 85 -15.271 43.070 -6.497 1.00 23.54 C ATOM 2049 O GLU B 85 -16.237 43.880 -6.517 1.00 25.34 O ATOM 2050 CB GLU B 85 -14.903 42.095 -4.229 1.00 23.92 C ATOM 2051 CG GLU B 85 -15.238 40.859 -3.334 1.00 27.81 C ATOM 2052 CD GLU B 85 -15.035 41.284 -1.886 1.00 34.96 C ATOM 2053 OE1 GLU B 85 -15.196 40.457 -1.041 1.00 39.87 O ATOM 2054 OE2 GLU B 85 -14.584 42.439 -1.658 1.00 37.74 O ATOM 0 H GLU B 85 -13.668 40.708 -5.831 1.00 20.68 H new ATOM 0 HA GLU B 85 -16.237 41.490 -5.720 1.00 22.83 H new ATOM 0 HB2 GLU B 85 -13.954 42.290 -4.189 1.00 23.92 H new ATOM 0 HB3 GLU B 85 -15.368 42.881 -3.903 1.00 23.92 H new ATOM 0 HG2 GLU B 85 -16.152 40.568 -3.481 1.00 27.81 H new ATOM 0 HG3 GLU B 85 -14.662 40.110 -3.555 1.00 27.81 H new ATOM 2055 N GLU B 86 -14.142 43.322 -7.146 1.00 21.59 N ATOM 2056 CA GLU B 86 -13.899 44.635 -7.769 1.00 18.40 C ATOM 2057 C GLU B 86 -13.603 44.483 -9.223 1.00 18.93 C ATOM 2058 O GLU B 86 -14.384 44.941 -10.028 1.00 17.78 O ATOM 2059 CB GLU B 86 -12.654 45.260 -7.101 1.00 21.98 C ATOM 2060 CG GLU B 86 -12.926 45.834 -5.680 1.00 25.38 C ATOM 2061 CD GLU B 86 -13.723 47.151 -5.751 1.00 28.81 C ATOM 2062 OE1 GLU B 86 -14.491 47.362 -4.816 1.00 35.74 O ATOM 2063 OE2 GLU B 86 -13.703 47.917 -6.756 1.00 24.19 O ATOM 0 H GLU B 86 -13.502 42.755 -7.241 1.00 21.59 H new ATOM 0 HA GLU B 86 -14.688 45.188 -7.657 1.00 18.40 H new ATOM 0 HB2 GLU B 86 -11.957 44.588 -7.041 1.00 21.98 H new ATOM 0 HB3 GLU B 86 -12.315 45.970 -7.668 1.00 21.98 H new ATOM 0 HG2 GLU B 86 -13.418 45.184 -5.155 1.00 25.38 H new ATOM 0 HG3 GLU B 86 -12.084 45.987 -5.224 1.00 25.38 H new ATOM 2064 N MET B 87 -12.526 43.758 -9.578 1.00 15.67 N ATOM 2065 CA MET B 87 -12.055 43.889 -11.013 1.00 17.62 C ATOM 2066 C MET B 87 -12.963 43.217 -11.976 1.00 17.02 C ATOM 2067 O MET B 87 -13.385 43.857 -12.923 1.00 17.77 O ATOM 2068 CB MET B 87 -10.617 43.296 -11.249 1.00 18.05 C ATOM 2069 CG MET B 87 -10.051 43.779 -12.585 1.00 19.56 C ATOM 2070 SD MET B 87 -8.502 42.807 -12.805 1.00 23.66 S ATOM 2071 CE MET B 87 -9.192 41.218 -13.381 1.00 21.89 C ATOM 0 H MET B 87 -12.078 43.227 -9.071 1.00 15.67 H new ATOM 0 HA MET B 87 -12.046 44.847 -11.168 1.00 17.62 H new ATOM 0 HB2 MET B 87 -10.028 43.564 -10.526 1.00 18.05 H new ATOM 0 HB3 MET B 87 -10.655 42.327 -11.239 1.00 18.05 H new ATOM 0 HG2 MET B 87 -10.674 43.620 -13.311 1.00 19.56 H new ATOM 0 HG3 MET B 87 -9.871 44.732 -12.569 1.00 19.56 H new ATOM 0 HE1 MET B 87 -8.890 40.504 -12.798 1.00 21.89 H new ATOM 0 HE2 MET B 87 -10.161 41.261 -13.365 1.00 21.89 H new ATOM 0 HE3 MET B 87 -8.892 41.044 -14.287 1.00 21.89 H new ATOM 2072 N TYR B 88 -13.253 41.912 -11.786 1.00 16.47 N ATOM 2073 CA TYR B 88 -14.023 41.263 -12.879 1.00 16.60 C ATOM 2074 C TYR B 88 -15.529 41.661 -12.957 1.00 18.01 C ATOM 2075 O TYR B 88 -16.047 41.770 -14.060 1.00 18.41 O ATOM 2076 CB TYR B 88 -13.916 39.774 -12.838 1.00 16.25 C ATOM 2077 CG TYR B 88 -12.627 39.281 -13.500 1.00 15.40 C ATOM 2078 CD1 TYR B 88 -12.357 39.572 -14.869 1.00 18.82 C ATOM 2079 CD2 TYR B 88 -11.761 38.412 -12.819 1.00 14.85 C ATOM 2080 CE1 TYR B 88 -11.143 39.112 -15.487 1.00 17.67 C ATOM 2081 CE2 TYR B 88 -10.495 37.917 -13.432 1.00 16.86 C ATOM 2082 CZ TYR B 88 -10.277 38.265 -14.780 1.00 18.11 C ATOM 2083 OH TYR B 88 -9.139 37.821 -15.413 1.00 18.61 O ATOM 0 H TYR B 88 -13.041 41.426 -11.109 1.00 16.47 H new ATOM 0 HA TYR B 88 -13.600 41.607 -13.681 1.00 16.60 H new ATOM 0 HB2 TYR B 88 -13.943 39.473 -11.916 1.00 16.25 H new ATOM 0 HB3 TYR B 88 -14.681 39.382 -13.287 1.00 16.25 H new ATOM 0 HD1 TYR B 88 -12.971 40.063 -15.366 1.00 18.82 H new ATOM 0 HD2 TYR B 88 -11.983 38.136 -11.959 1.00 14.85 H new ATOM 0 HE1 TYR B 88 -10.932 39.376 -16.354 1.00 17.67 H new ATOM 0 HE2 TYR B 88 -9.883 37.407 -12.952 1.00 16.86 H new ATOM 0 HH TYR B 88 -8.859 37.126 -15.032 1.00 18.61 H new ATOM 2084 N PRO B 89 -16.149 41.950 -11.830 1.00 17.49 N ATOM 2085 CA PRO B 89 -17.568 42.459 -11.975 1.00 19.66 C ATOM 2086 C PRO B 89 -17.625 43.727 -12.774 1.00 18.80 C ATOM 2087 O PRO B 89 -18.544 43.869 -13.606 1.00 18.02 O ATOM 2088 CB PRO B 89 -18.008 42.726 -10.512 1.00 21.18 C ATOM 2089 CG PRO B 89 -17.256 41.673 -9.699 1.00 20.54 C ATOM 2090 CD PRO B 89 -15.822 41.662 -10.391 1.00 18.02 C ATOM 0 HA PRO B 89 -18.137 41.829 -12.443 1.00 19.66 H new ATOM 0 HB2 PRO B 89 -17.776 43.625 -10.230 1.00 21.18 H new ATOM 0 HB3 PRO B 89 -18.968 42.635 -10.408 1.00 21.18 H new ATOM 0 HG2 PRO B 89 -17.202 41.912 -8.760 1.00 20.54 H new ATOM 0 HG3 PRO B 89 -17.686 40.805 -9.746 1.00 20.54 H new ATOM 0 HD2 PRO B 89 -15.234 42.335 -10.013 1.00 18.02 H new ATOM 0 HD3 PRO B 89 -15.378 40.806 -10.286 1.00 18.02 H new ATOM 2091 N VAL B 90 -16.660 44.648 -12.557 1.00 16.04 N ATOM 2092 CA VAL B 90 -16.626 45.930 -13.295 1.00 16.20 C ATOM 2093 C VAL B 90 -16.240 45.662 -14.735 1.00 16.44 C ATOM 2094 O VAL B 90 -16.860 46.224 -15.651 1.00 16.11 O ATOM 2095 CB VAL B 90 -15.658 46.919 -12.613 1.00 17.62 C ATOM 2096 CG1 VAL B 90 -15.368 48.142 -13.532 1.00 17.56 C ATOM 2097 CG2 VAL B 90 -16.333 47.408 -11.282 1.00 21.50 C ATOM 0 H VAL B 90 -16.021 44.548 -11.990 1.00 16.04 H new ATOM 0 HA VAL B 90 -17.504 46.341 -13.285 1.00 16.20 H new ATOM 0 HB VAL B 90 -14.813 46.477 -12.434 1.00 17.62 H new ATOM 0 HG11 VAL B 90 -14.759 48.748 -13.082 1.00 17.56 H new ATOM 0 HG12 VAL B 90 -14.967 47.836 -14.361 1.00 17.56 H new ATOM 0 HG13 VAL B 90 -16.198 48.605 -13.727 1.00 17.56 H new ATOM 0 HG21 VAL B 90 -15.744 48.033 -10.831 1.00 21.50 H new ATOM 0 HG22 VAL B 90 -17.173 47.847 -11.487 1.00 21.50 H new ATOM 0 HG23 VAL B 90 -16.499 46.647 -10.704 1.00 21.50 H new ATOM 2098 N TYR B 91 -15.181 44.853 -14.955 1.00 15.23 N ATOM 2099 CA TYR B 91 -14.839 44.645 -16.383 1.00 15.72 C ATOM 2100 C TYR B 91 -15.936 43.895 -17.149 1.00 15.31 C ATOM 2101 O TYR B 91 -16.241 44.251 -18.315 1.00 17.21 O ATOM 2102 CB TYR B 91 -13.528 43.821 -16.515 1.00 14.58 C ATOM 2103 CG TYR B 91 -12.261 44.538 -16.121 1.00 14.45 C ATOM 2104 CD1 TYR B 91 -12.239 45.866 -15.796 1.00 15.98 C ATOM 2105 CD2 TYR B 91 -11.072 43.813 -16.105 1.00 20.90 C ATOM 2106 CE1 TYR B 91 -10.995 46.533 -15.482 1.00 20.44 C ATOM 2107 CE2 TYR B 91 -9.857 44.435 -15.785 1.00 18.19 C ATOM 2108 CZ TYR B 91 -9.832 45.788 -15.552 1.00 20.87 C ATOM 2109 OH TYR B 91 -8.597 46.323 -15.193 1.00 23.17 O ATOM 0 H TYR B 91 -14.696 44.455 -14.367 1.00 15.23 H new ATOM 0 HA TYR B 91 -14.736 45.531 -16.765 1.00 15.72 H new ATOM 0 HB2 TYR B 91 -13.611 43.023 -15.970 1.00 14.58 H new ATOM 0 HB3 TYR B 91 -13.441 43.528 -17.436 1.00 14.58 H new ATOM 0 HD1 TYR B 91 -13.035 46.347 -15.777 1.00 15.98 H new ATOM 0 HD2 TYR B 91 -11.084 42.906 -16.309 1.00 20.90 H new ATOM 0 HE1 TYR B 91 -10.978 47.431 -15.241 1.00 20.44 H new ATOM 0 HE2 TYR B 91 -9.074 43.935 -15.731 1.00 18.19 H new ATOM 0 HH TYR B 91 -8.000 45.741 -15.293 1.00 23.17 H new ATOM 2110 N ASN B 92 -16.601 42.941 -16.485 1.00 16.93 N ATOM 2111 CA ASN B 92 -17.706 42.205 -17.126 1.00 16.36 C ATOM 2112 C ASN B 92 -18.911 43.172 -17.421 1.00 18.32 C ATOM 2113 O ASN B 92 -19.488 43.194 -18.543 1.00 19.01 O ATOM 2114 CB ASN B 92 -18.131 41.118 -16.184 1.00 16.49 C ATOM 2115 CG ASN B 92 -19.358 40.344 -16.663 1.00 21.27 C ATOM 2116 OD1 ASN B 92 -20.510 40.713 -16.293 1.00 23.58 O ATOM 2117 ND2 ASN B 92 -19.158 39.318 -17.522 1.00 19.45 N ATOM 0 H ASN B 92 -16.433 42.706 -15.675 1.00 16.93 H new ATOM 0 HA ASN B 92 -17.416 41.829 -17.972 1.00 16.36 H new ATOM 0 HB2 ASN B 92 -17.394 40.499 -16.062 1.00 16.49 H new ATOM 0 HB3 ASN B 92 -18.321 41.508 -15.316 1.00 16.49 H new ATOM 0 HD21 ASN B 92 -19.830 38.887 -17.840 1.00 19.45 H new ATOM 0 HD22 ASN B 92 -18.359 39.097 -17.750 1.00 19.45 H new ATOM 2118 N LYS B 93 -19.198 44.071 -16.476 1.00 17.95 N ATOM 2119 CA LYS B 93 -20.301 45.025 -16.692 1.00 18.86 C ATOM 2120 C LYS B 93 -19.972 45.992 -17.833 1.00 18.96 C ATOM 2121 O LYS B 93 -20.842 46.378 -18.669 1.00 19.72 O ATOM 2122 CB LYS B 93 -20.533 45.827 -15.392 1.00 21.13 C ATOM 2123 CG LYS B 93 -21.647 46.905 -15.533 1.00 24.97 C ATOM 2124 CD LYS B 93 -22.932 46.243 -16.043 1.00 32.07 C ATOM 2125 CE LYS B 93 -23.725 45.643 -14.991 1.00 40.90 C ATOM 2126 NZ LYS B 93 -23.487 44.191 -14.958 1.00 47.38 N ATOM 0 H LYS B 93 -18.784 44.148 -15.726 1.00 17.95 H new ATOM 0 HA LYS B 93 -21.100 44.530 -16.931 1.00 18.86 H new ATOM 0 HB2 LYS B 93 -20.771 45.215 -14.678 1.00 21.13 H new ATOM 0 HB3 LYS B 93 -19.704 46.258 -15.131 1.00 21.13 H new ATOM 0 HG2 LYS B 93 -21.809 47.332 -14.677 1.00 24.97 H new ATOM 0 HG3 LYS B 93 -21.363 47.600 -16.147 1.00 24.97 H new ATOM 0 HD2 LYS B 93 -23.468 46.906 -16.505 1.00 32.07 H new ATOM 0 HD3 LYS B 93 -22.701 45.562 -16.694 1.00 32.07 H new ATOM 0 HE2 LYS B 93 -23.494 46.037 -14.135 1.00 40.90 H new ATOM 0 HE3 LYS B 93 -24.666 45.822 -15.141 1.00 40.90 H new ATOM 0 HZ1 LYS B 93 -23.659 43.880 -14.142 1.00 47.38 H new ATOM 0 HZ2 LYS B 93 -24.020 43.789 -15.546 1.00 47.38 H new ATOM 0 HZ3 LYS B 93 -22.638 44.024 -15.166 1.00 47.38 H new ATOM 2127 N ALA B 94 -18.733 46.466 -17.863 1.00 17.26 N ATOM 2128 CA ALA B 94 -18.316 47.364 -18.957 1.00 17.40 C ATOM 2129 C ALA B 94 -18.358 46.679 -20.302 1.00 16.58 C ATOM 2130 O ALA B 94 -18.837 47.290 -21.305 1.00 17.79 O ATOM 2131 CB ALA B 94 -16.849 47.906 -18.674 1.00 17.43 C ATOM 0 H ALA B 94 -18.125 46.291 -17.280 1.00 17.26 H new ATOM 0 HA ALA B 94 -18.944 48.103 -18.986 1.00 17.40 H new ATOM 0 HB1 ALA B 94 -16.577 48.496 -19.394 1.00 17.43 H new ATOM 0 HB2 ALA B 94 -16.840 48.394 -17.836 1.00 17.43 H new ATOM 0 HB3 ALA B 94 -16.233 47.159 -18.619 1.00 17.43 H new ATOM 2132 N ALA B 95 -17.885 45.429 -20.386 1.00 18.13 N ATOM 2133 CA ALA B 95 -17.974 44.692 -21.659 1.00 18.09 C ATOM 2134 C ALA B 95 -19.450 44.563 -22.099 1.00 18.30 C ATOM 2135 O ALA B 95 -19.751 44.714 -23.275 1.00 18.14 O ATOM 2136 CB ALA B 95 -17.351 43.238 -21.509 1.00 17.96 C ATOM 0 H ALA B 95 -17.518 44.998 -19.738 1.00 18.13 H new ATOM 0 HA ALA B 95 -17.475 45.187 -22.328 1.00 18.09 H new ATOM 0 HB1 ALA B 95 -17.418 42.768 -22.355 1.00 17.96 H new ATOM 0 HB2 ALA B 95 -16.418 43.310 -21.253 1.00 17.96 H new ATOM 0 HB3 ALA B 95 -17.836 42.747 -20.827 1.00 17.96 H new ATOM 2137 N GLU B 96 -20.321 44.190 -21.168 1.00 18.96 N ATOM 2138 CA GLU B 96 -21.756 44.071 -21.497 1.00 21.63 C ATOM 2139 C GLU B 96 -22.283 45.408 -21.977 1.00 20.95 C ATOM 2140 O GLU B 96 -22.961 45.492 -23.024 1.00 18.88 O ATOM 2141 CB GLU B 96 -22.555 43.582 -20.270 1.00 23.91 C ATOM 2142 CG GLU B 96 -24.077 43.585 -20.583 1.00 33.50 C ATOM 2143 CD GLU B 96 -24.933 43.517 -19.338 1.00 44.84 C ATOM 2144 OE1 GLU B 96 -25.119 44.525 -18.584 1.00 48.78 O ATOM 2145 OE2 GLU B 96 -25.452 42.423 -19.143 1.00 52.75 O ATOM 0 H GLU B 96 -20.117 44.003 -20.354 1.00 18.96 H new ATOM 0 HA GLU B 96 -21.863 43.417 -22.206 1.00 21.63 H new ATOM 0 HB2 GLU B 96 -22.270 42.687 -20.026 1.00 23.91 H new ATOM 0 HB3 GLU B 96 -22.374 44.155 -19.509 1.00 23.91 H new ATOM 0 HG2 GLU B 96 -24.299 44.388 -21.079 1.00 33.50 H new ATOM 0 HG3 GLU B 96 -24.286 42.831 -21.156 1.00 33.50 H new ATOM 2146 N PHE B 97 -21.930 46.488 -21.271 1.00 19.70 N ATOM 2147 CA PHE B 97 -22.318 47.832 -21.679 1.00 19.21 C ATOM 2148 C PHE B 97 -21.811 48.221 -23.082 1.00 21.55 C ATOM 2149 O PHE B 97 -22.511 48.943 -23.833 1.00 20.09 O ATOM 2150 CB PHE B 97 -21.754 48.835 -20.644 1.00 19.12 C ATOM 2151 CG PHE B 97 -22.070 50.282 -20.929 1.00 20.40 C ATOM 2152 CD1 PHE B 97 -21.042 51.170 -21.370 1.00 20.13 C ATOM 2153 CD2 PHE B 97 -23.356 50.790 -20.738 1.00 27.14 C ATOM 2154 CE1 PHE B 97 -21.306 52.508 -21.605 1.00 24.04 C ATOM 2155 CE2 PHE B 97 -23.648 52.216 -20.982 1.00 30.56 C ATOM 2156 CZ PHE B 97 -22.627 53.044 -21.434 1.00 27.03 C ATOM 0 H PHE B 97 -21.463 46.457 -20.549 1.00 19.70 H new ATOM 0 HA PHE B 97 -23.287 47.854 -21.718 1.00 19.21 H new ATOM 0 HB2 PHE B 97 -22.103 48.607 -19.768 1.00 19.12 H new ATOM 0 HB3 PHE B 97 -20.791 48.730 -20.602 1.00 19.12 H new ATOM 0 HD1 PHE B 97 -20.181 50.844 -21.501 1.00 20.13 H new ATOM 0 HD2 PHE B 97 -24.037 50.223 -20.454 1.00 27.14 H new ATOM 0 HE1 PHE B 97 -20.617 53.069 -21.878 1.00 24.04 H new ATOM 0 HE2 PHE B 97 -24.501 52.555 -20.836 1.00 30.56 H new ATOM 0 HZ PHE B 97 -22.798 53.938 -21.624 1.00 27.03 H new ATOM 2157 N GLN B 98 -20.602 47.778 -23.467 1.00 19.99 N ATOM 2158 CA GLN B 98 -20.092 48.084 -24.782 1.00 21.42 C ATOM 2159 C GLN B 98 -20.476 47.051 -25.834 1.00 23.34 C ATOM 2160 O GLN B 98 -20.022 47.184 -26.956 1.00 22.63 O ATOM 2161 CB GLN B 98 -18.531 48.141 -24.711 1.00 22.95 C ATOM 2162 CG GLN B 98 -18.049 49.290 -23.764 1.00 21.49 C ATOM 2163 CD GLN B 98 -16.749 49.853 -24.217 1.00 20.05 C ATOM 2164 OE1 GLN B 98 -15.763 49.111 -24.264 1.00 22.26 O ATOM 2165 NE2 GLN B 98 -16.733 51.161 -24.631 1.00 21.89 N ATOM 0 H GLN B 98 -20.078 47.305 -22.976 1.00 19.99 H new ATOM 0 HA GLN B 98 -20.482 48.932 -25.046 1.00 21.42 H new ATOM 0 HB2 GLN B 98 -18.188 47.291 -24.393 1.00 22.95 H new ATOM 0 HB3 GLN B 98 -18.169 48.278 -25.600 1.00 22.95 H new ATOM 0 HG2 GLN B 98 -18.717 49.993 -23.739 1.00 21.49 H new ATOM 0 HG3 GLN B 98 -17.960 48.951 -22.860 1.00 21.49 H new ATOM 0 HE21 GLN B 98 -17.447 51.638 -24.578 1.00 21.89 H new ATOM 0 HE22 GLN B 98 -16.009 51.504 -24.944 1.00 21.89 H new ATOM 2166 N GLY B 99 -21.206 46.015 -25.446 1.00 22.15 N ATOM 2167 CA GLY B 99 -21.688 45.049 -26.405 1.00 23.49 C ATOM 2168 C GLY B 99 -20.637 44.029 -26.813 1.00 23.08 C ATOM 2169 O GLY B 99 -20.848 43.387 -27.828 1.00 21.52 O ATOM 0 H GLY B 99 -21.431 45.857 -24.631 1.00 22.15 H new ATOM 0 HA2 GLY B 99 -22.452 44.584 -26.030 1.00 23.49 H new ATOM 0 HA3 GLY B 99 -22.000 45.516 -27.196 1.00 23.49 H new ATOM 2170 N GLU B 100 -19.568 43.855 -26.039 1.00 18.74 N ATOM 2171 CA GLU B 100 -18.414 42.987 -26.472 1.00 20.29 C ATOM 2172 C GLU B 100 -18.662 41.624 -25.859 1.00 21.49 C ATOM 2173 O GLU B 100 -18.150 41.294 -24.773 1.00 21.64 O ATOM 2174 CB GLU B 100 -17.093 43.597 -25.993 1.00 21.20 C ATOM 2175 CG GLU B 100 -16.713 44.867 -26.804 1.00 23.24 C ATOM 2176 CD GLU B 100 -16.144 44.470 -28.258 1.00 30.09 C ATOM 2177 OE1 GLU B 100 -16.179 43.277 -28.670 1.00 28.62 O ATOM 2178 OE2 GLU B 100 -15.663 45.338 -28.993 1.00 27.47 O ATOM 0 H GLU B 100 -19.471 44.217 -25.265 1.00 18.74 H new ATOM 0 HA GLU B 100 -18.350 42.916 -27.437 1.00 20.29 H new ATOM 0 HB2 GLU B 100 -17.164 43.824 -25.053 1.00 21.20 H new ATOM 0 HB3 GLU B 100 -16.385 42.939 -26.073 1.00 21.20 H new ATOM 0 HG2 GLU B 100 -17.491 45.438 -26.902 1.00 23.24 H new ATOM 0 HG3 GLU B 100 -16.046 45.377 -26.319 1.00 23.24 H new ATOM 2179 N LYS B 101 -19.394 40.782 -26.600 1.00 21.97 N ATOM 2180 CA LYS B 101 -19.845 39.499 -26.023 1.00 21.40 C ATOM 2181 C LYS B 101 -18.709 38.538 -25.685 1.00 20.03 C ATOM 2182 O LYS B 101 -18.842 37.776 -24.732 1.00 20.13 O ATOM 2183 CB LYS B 101 -20.843 38.843 -27.017 1.00 25.50 C ATOM 2184 CG LYS B 101 -22.186 39.643 -27.053 1.00 29.02 C ATOM 2185 CD LYS B 101 -23.219 38.941 -27.946 1.00 40.35 C ATOM 2186 CE LYS B 101 -24.170 39.985 -28.567 1.00 47.29 C ATOM 2187 NZ LYS B 101 -23.772 40.375 -30.007 1.00 48.35 N ATOM 0 H LYS B 101 -19.636 40.924 -27.413 1.00 21.97 H new ATOM 0 HA LYS B 101 -20.273 39.692 -25.174 1.00 21.40 H new ATOM 0 HB2 LYS B 101 -20.453 38.815 -27.905 1.00 25.50 H new ATOM 0 HB3 LYS B 101 -21.014 37.925 -26.754 1.00 25.50 H new ATOM 0 HG2 LYS B 101 -22.538 39.732 -26.153 1.00 29.02 H new ATOM 0 HG3 LYS B 101 -22.023 40.540 -27.384 1.00 29.02 H new ATOM 0 HD2 LYS B 101 -22.768 38.445 -28.647 1.00 40.35 H new ATOM 0 HD3 LYS B 101 -23.726 38.299 -27.425 1.00 40.35 H new ATOM 0 HE2 LYS B 101 -25.073 39.632 -28.570 1.00 47.29 H new ATOM 0 HE3 LYS B 101 -24.178 40.780 -28.011 1.00 47.29 H new ATOM 0 HZ1 LYS B 101 -24.347 40.977 -30.322 1.00 48.35 H new ATOM 0 HZ2 LYS B 101 -22.952 40.721 -30.005 1.00 48.35 H new ATOM 0 HZ3 LYS B 101 -23.787 39.652 -30.526 1.00 48.35 H new ATOM 2188 N GLU B 102 -17.614 38.555 -26.477 1.00 19.30 N ATOM 2189 CA GLU B 102 -16.503 37.642 -26.206 1.00 20.96 C ATOM 2190 C GLU B 102 -15.869 38.031 -24.861 1.00 18.49 C ATOM 2191 O GLU B 102 -15.452 37.120 -24.078 1.00 18.95 O ATOM 2192 CB GLU B 102 -15.409 37.691 -27.284 1.00 22.61 C ATOM 2193 CG GLU B 102 -15.773 37.143 -28.629 1.00 32.86 C ATOM 2194 CD GLU B 102 -14.617 37.443 -29.630 1.00 45.15 C ATOM 2195 OE1 GLU B 102 -13.513 36.806 -29.444 1.00 43.77 O ATOM 2196 OE2 GLU B 102 -14.801 38.369 -30.500 1.00 44.69 O ATOM 0 H GLU B 102 -17.505 39.074 -27.154 1.00 19.30 H new ATOM 0 HA GLU B 102 -16.865 36.742 -26.194 1.00 20.96 H new ATOM 0 HB2 GLU B 102 -15.134 38.615 -27.396 1.00 22.61 H new ATOM 0 HB3 GLU B 102 -14.637 37.203 -26.956 1.00 22.61 H new ATOM 0 HG2 GLU B 102 -15.926 36.187 -28.571 1.00 32.86 H new ATOM 0 HG3 GLU B 102 -16.599 37.544 -28.942 1.00 32.86 H new ATOM 2197 N ALA B 103 -15.827 39.368 -24.600 1.00 17.65 N ATOM 2198 CA ALA B 103 -15.195 39.798 -23.305 1.00 16.21 C ATOM 2199 C ALA B 103 -16.130 39.524 -22.156 1.00 16.43 C ATOM 2200 O ALA B 103 -15.683 39.290 -21.016 1.00 17.33 O ATOM 2201 CB ALA B 103 -14.792 41.314 -23.337 1.00 17.20 C ATOM 0 H ALA B 103 -16.128 39.994 -25.106 1.00 17.65 H new ATOM 0 HA ALA B 103 -14.383 39.282 -23.182 1.00 16.21 H new ATOM 0 HB1 ALA B 103 -14.388 41.560 -22.490 1.00 17.20 H new ATOM 0 HB2 ALA B 103 -14.156 41.465 -24.054 1.00 17.20 H new ATOM 0 HB3 ALA B 103 -15.582 41.856 -23.487 1.00 17.20 H new ATOM 2202 N VAL B 104 -17.445 39.711 -22.384 1.00 16.32 N ATOM 2203 CA VAL B 104 -18.439 39.247 -21.399 1.00 17.04 C ATOM 2204 C VAL B 104 -18.154 37.799 -20.981 1.00 17.07 C ATOM 2205 O VAL B 104 -18.056 37.498 -19.777 1.00 15.83 O ATOM 2206 CB VAL B 104 -19.863 39.415 -21.894 1.00 17.60 C ATOM 2207 CG1 VAL B 104 -20.894 38.799 -20.910 1.00 19.81 C ATOM 2208 CG2 VAL B 104 -20.184 40.938 -21.863 1.00 19.24 C ATOM 0 H VAL B 104 -17.772 40.093 -23.082 1.00 16.32 H new ATOM 0 HA VAL B 104 -18.353 39.811 -20.614 1.00 17.04 H new ATOM 0 HB VAL B 104 -19.924 38.996 -22.767 1.00 17.60 H new ATOM 0 HG11 VAL B 104 -21.790 38.925 -21.259 1.00 19.81 H new ATOM 0 HG12 VAL B 104 -20.718 37.851 -20.808 1.00 19.81 H new ATOM 0 HG13 VAL B 104 -20.819 39.236 -20.047 1.00 19.81 H new ATOM 0 HG21 VAL B 104 -21.091 41.084 -22.175 1.00 19.24 H new ATOM 0 HG22 VAL B 104 -20.097 41.269 -20.955 1.00 19.24 H new ATOM 0 HG23 VAL B 104 -19.564 41.411 -22.440 1.00 19.24 H new ATOM 2209 N ARG B 105 -18.000 36.901 -21.946 1.00 17.59 N ATOM 2210 CA ARG B 105 -17.667 35.485 -21.677 1.00 17.91 C ATOM 2211 C ARG B 105 -16.343 35.293 -20.950 1.00 17.48 C ATOM 2212 O ARG B 105 -16.318 34.541 -19.929 1.00 17.69 O ATOM 2213 CB ARG B 105 -17.678 34.653 -23.030 1.00 19.28 C ATOM 2214 CG ARG B 105 -17.194 33.208 -22.800 1.00 21.53 C ATOM 2215 CD ARG B 105 -17.156 32.397 -24.186 1.00 27.68 C ATOM 2216 NE ARG B 105 -18.435 32.605 -24.854 1.00 37.75 N ATOM 2217 CZ ARG B 105 -18.575 33.240 -26.027 1.00 47.47 C ATOM 2218 NH1 ARG B 105 -17.487 33.662 -26.725 1.00 43.95 N ATOM 2219 NH2 ARG B 105 -19.807 33.440 -26.523 1.00 49.34 N ATOM 0 H ARG B 105 -18.084 37.086 -22.782 1.00 17.59 H new ATOM 0 HA ARG B 105 -18.354 35.154 -21.078 1.00 17.91 H new ATOM 0 HB2 ARG B 105 -18.575 34.641 -23.398 1.00 19.28 H new ATOM 0 HB3 ARG B 105 -17.109 35.087 -23.684 1.00 19.28 H new ATOM 0 HG2 ARG B 105 -16.310 33.217 -22.401 1.00 21.53 H new ATOM 0 HG3 ARG B 105 -17.784 32.760 -22.173 1.00 21.53 H new ATOM 0 HD2 ARG B 105 -16.426 32.709 -24.743 1.00 27.68 H new ATOM 0 HD3 ARG B 105 -17.006 31.452 -24.024 1.00 27.68 H new ATOM 0 HE ARG B 105 -19.144 32.302 -24.472 1.00 37.75 H new ATOM 0 HH11 ARG B 105 -16.697 33.523 -26.415 1.00 43.95 H new ATOM 0 HH12 ARG B 105 -17.589 34.068 -27.476 1.00 43.95 H new ATOM 0 HH21 ARG B 105 -20.496 33.162 -26.089 1.00 49.34 H new ATOM 0 HH22 ARG B 105 -19.907 33.846 -27.274 1.00 49.34 H new ATOM 2220 N THR B 106 -15.224 35.963 -21.394 1.00 17.85 N ATOM 2221 CA THR B 106 -13.916 35.580 -20.821 1.00 15.66 C ATOM 2222 C THR B 106 -13.900 36.116 -19.346 1.00 15.27 C ATOM 2223 O THR B 106 -13.243 35.503 -18.481 1.00 15.69 O ATOM 2224 CB THR B 106 -12.665 36.144 -21.585 1.00 17.32 C ATOM 2225 OG1 THR B 106 -12.736 37.568 -21.607 1.00 19.16 O ATOM 2226 CG2 THR B 106 -12.676 35.606 -23.102 1.00 19.32 C ATOM 0 H THR B 106 -15.212 36.592 -21.981 1.00 17.85 H new ATOM 0 HA THR B 106 -13.838 34.615 -20.887 1.00 15.66 H new ATOM 0 HB THR B 106 -11.855 35.854 -21.137 1.00 17.32 H new ATOM 0 HG1 THR B 106 -12.034 37.889 -21.275 1.00 19.16 H new ATOM 0 HG21 THR B 106 -11.904 35.954 -23.575 1.00 19.32 H new ATOM 0 HG22 THR B 106 -12.645 34.637 -23.102 1.00 19.32 H new ATOM 0 HG23 THR B 106 -13.486 35.903 -23.545 1.00 19.32 H new ATOM 2227 N THR B 107 -14.516 37.279 -19.122 1.00 15.46 N ATOM 2228 CA THR B 107 -14.516 37.825 -17.765 1.00 15.39 C ATOM 2229 C THR B 107 -15.469 37.019 -16.871 1.00 17.67 C ATOM 2230 O THR B 107 -15.175 36.862 -15.682 1.00 17.71 O ATOM 2231 CB THR B 107 -14.911 39.331 -17.678 1.00 15.23 C ATOM 2232 OG1 THR B 107 -16.175 39.547 -18.315 1.00 18.76 O ATOM 2233 CG2 THR B 107 -13.809 40.219 -18.483 1.00 17.77 C ATOM 0 H THR B 107 -14.923 37.750 -19.715 1.00 15.46 H new ATOM 0 HA THR B 107 -13.598 37.754 -17.461 1.00 15.39 H new ATOM 0 HB THR B 107 -14.956 39.584 -16.743 1.00 15.23 H new ATOM 0 HG1 THR B 107 -16.084 39.481 -19.147 1.00 18.76 H new ATOM 0 HG21 THR B 107 -14.050 41.157 -18.432 1.00 17.77 H new ATOM 0 HG22 THR B 107 -12.934 40.088 -18.085 1.00 17.77 H new ATOM 0 HG23 THR B 107 -13.786 39.941 -19.412 1.00 17.77 H new ATOM 2234 N HIS B 108 -16.581 36.554 -17.442 1.00 15.78 N ATOM 2235 CA HIS B 108 -17.476 35.618 -16.663 1.00 18.75 C ATOM 2236 C HIS B 108 -16.773 34.337 -16.279 1.00 19.50 C ATOM 2237 O HIS B 108 -16.781 33.888 -15.086 1.00 18.93 O ATOM 2238 CB HIS B 108 -18.741 35.333 -17.451 1.00 20.25 C ATOM 2239 CG HIS B 108 -19.669 34.393 -16.734 1.00 25.31 C ATOM 2240 ND1 HIS B 108 -20.125 33.204 -17.298 1.00 35.19 N ATOM 2241 CD2 HIS B 108 -20.282 34.499 -15.530 1.00 26.64 C ATOM 2242 CE1 HIS B 108 -20.939 32.593 -16.444 1.00 25.51 C ATOM 2243 NE2 HIS B 108 -21.017 33.331 -15.342 1.00 33.69 N ATOM 0 H HIS B 108 -16.845 36.743 -18.238 1.00 15.78 H new ATOM 0 HA HIS B 108 -17.714 36.061 -15.833 1.00 18.75 H new ATOM 0 HB2 HIS B 108 -19.203 36.167 -17.627 1.00 20.25 H new ATOM 0 HB3 HIS B 108 -18.503 34.954 -18.312 1.00 20.25 H new ATOM 0 HD2 HIS B 108 -20.223 35.216 -14.941 1.00 26.64 H new ATOM 0 HE1 HIS B 108 -21.379 31.787 -16.592 1.00 25.51 H new ATOM 0 HE2 HIS B 108 -21.450 33.122 -14.629 1.00 33.69 H new ATOM 2244 N TYR B 109 -16.092 33.724 -17.250 1.00 15.03 N ATOM 2245 CA TYR B 109 -15.357 32.526 -16.914 1.00 16.71 C ATOM 2246 C TYR B 109 -14.340 32.743 -15.774 1.00 18.24 C ATOM 2247 O TYR B 109 -14.170 31.916 -14.845 1.00 17.48 O ATOM 2248 CB TYR B 109 -14.595 32.102 -18.169 1.00 15.55 C ATOM 2249 CG TYR B 109 -15.330 31.444 -19.300 1.00 16.21 C ATOM 2250 CD1 TYR B 109 -16.658 31.025 -19.147 1.00 18.89 C ATOM 2251 CD2 TYR B 109 -14.619 31.110 -20.475 1.00 19.19 C ATOM 2252 CE1 TYR B 109 -17.321 30.341 -20.171 1.00 17.08 C ATOM 2253 CE2 TYR B 109 -15.236 30.486 -21.515 1.00 18.05 C ATOM 2254 CZ TYR B 109 -16.605 30.017 -21.340 1.00 19.87 C ATOM 2255 OH TYR B 109 -17.272 29.346 -22.378 1.00 21.60 O ATOM 0 H TYR B 109 -16.048 33.978 -18.071 1.00 15.03 H new ATOM 0 HA TYR B 109 -15.987 31.854 -16.608 1.00 16.71 H new ATOM 0 HB2 TYR B 109 -14.162 32.893 -18.526 1.00 15.55 H new ATOM 0 HB3 TYR B 109 -13.891 31.496 -17.889 1.00 15.55 H new ATOM 0 HD1 TYR B 109 -17.106 31.205 -18.352 1.00 18.89 H new ATOM 0 HD2 TYR B 109 -13.715 31.320 -20.538 1.00 19.19 H new ATOM 0 HE1 TYR B 109 -18.216 30.105 -20.082 1.00 17.08 H new ATOM 0 HE2 TYR B 109 -14.792 30.361 -22.323 1.00 18.05 H new ATOM 0 HH TYR B 109 -16.736 29.201 -23.008 1.00 21.60 H new ATOM 2256 N ALA B 110 -13.534 33.810 -15.894 1.00 16.87 N ATOM 2257 CA ALA B 110 -12.544 33.954 -14.888 1.00 17.37 C ATOM 2258 C ALA B 110 -13.185 34.247 -13.524 1.00 19.84 C ATOM 2259 O ALA B 110 -12.742 33.698 -12.507 1.00 19.66 O ATOM 2260 CB ALA B 110 -11.531 35.139 -15.259 1.00 16.48 C ATOM 0 H ALA B 110 -13.557 34.408 -16.512 1.00 16.87 H new ATOM 0 HA ALA B 110 -12.056 33.117 -14.835 1.00 17.37 H new ATOM 0 HB1 ALA B 110 -10.862 35.223 -14.562 1.00 16.48 H new ATOM 0 HB2 ALA B 110 -11.095 34.940 -16.102 1.00 16.48 H new ATOM 0 HB3 ALA B 110 -12.022 35.972 -15.338 1.00 16.48 H new ATOM 2261 N LEU B 111 -14.197 35.106 -13.522 1.00 17.37 N ATOM 2262 CA LEU B 111 -14.793 35.478 -12.229 1.00 18.39 C ATOM 2263 C LEU B 111 -15.282 34.247 -11.446 1.00 19.10 C ATOM 2264 O LEU B 111 -15.079 34.180 -10.194 1.00 20.08 O ATOM 2265 CB LEU B 111 -15.986 36.433 -12.522 1.00 19.14 C ATOM 2266 CG LEU B 111 -16.886 36.740 -11.273 1.00 22.55 C ATOM 2267 CD1 LEU B 111 -16.065 37.243 -9.991 1.00 26.84 C ATOM 2268 CD2 LEU B 111 -17.857 37.848 -11.876 1.00 24.71 C ATOM 0 H LEU B 111 -14.545 35.473 -14.217 1.00 17.37 H new ATOM 0 HA LEU B 111 -14.122 35.911 -11.678 1.00 18.39 H new ATOM 0 HB2 LEU B 111 -15.640 37.269 -12.872 1.00 19.14 H new ATOM 0 HB3 LEU B 111 -16.538 36.041 -13.217 1.00 19.14 H new ATOM 0 HG LEU B 111 -17.341 35.962 -10.915 1.00 22.55 H new ATOM 0 HD11 LEU B 111 -16.679 37.413 -9.260 1.00 26.84 H new ATOM 0 HD12 LEU B 111 -15.429 36.561 -9.726 1.00 26.84 H new ATOM 0 HD13 LEU B 111 -15.590 38.060 -10.211 1.00 26.84 H new ATOM 0 HD21 LEU B 111 -18.483 38.136 -11.193 1.00 24.71 H new ATOM 0 HD22 LEU B 111 -17.334 38.608 -12.176 1.00 24.71 H new ATOM 0 HD23 LEU B 111 -18.346 37.476 -12.627 1.00 24.71 H new ATOM 2269 N GLU B 112 -16.010 33.337 -12.129 1.00 21.50 N ATOM 2270 CA GLU B 112 -16.628 32.190 -11.417 1.00 20.35 C ATOM 2271 C GLU B 112 -15.519 31.313 -10.820 1.00 21.70 C ATOM 2272 O GLU B 112 -15.684 30.767 -9.704 1.00 20.66 O ATOM 2273 CB GLU B 112 -17.450 31.368 -12.340 1.00 20.57 C ATOM 2274 CG GLU B 112 -18.697 32.204 -12.762 1.00 23.08 C ATOM 2275 CD GLU B 112 -19.474 32.750 -11.528 1.00 34.66 C ATOM 2276 OE1 GLU B 112 -19.779 33.944 -11.471 1.00 34.93 O ATOM 2277 OE2 GLU B 112 -19.733 31.984 -10.572 1.00 38.29 O ATOM 0 H GLU B 112 -16.155 33.362 -12.976 1.00 21.50 H new ATOM 0 HA GLU B 112 -17.203 32.537 -10.717 1.00 20.35 H new ATOM 0 HB2 GLU B 112 -16.932 31.116 -13.121 1.00 20.57 H new ATOM 0 HB3 GLU B 112 -17.726 30.546 -11.905 1.00 20.57 H new ATOM 0 HG2 GLU B 112 -18.415 32.945 -13.320 1.00 23.08 H new ATOM 0 HG3 GLU B 112 -19.289 31.654 -13.299 1.00 23.08 H new ATOM 2278 N ALA B 113 -14.374 31.201 -11.520 1.00 18.24 N ATOM 2279 CA ALA B 113 -13.265 30.402 -10.967 1.00 18.64 C ATOM 2280 C ALA B 113 -12.539 31.067 -9.825 1.00 18.66 C ATOM 2281 O ALA B 113 -12.139 30.352 -8.890 1.00 19.90 O ATOM 2282 CB ALA B 113 -12.196 30.079 -12.109 1.00 17.96 C ATOM 0 H ALA B 113 -14.224 31.564 -12.285 1.00 18.24 H new ATOM 0 HA ALA B 113 -13.677 29.594 -10.623 1.00 18.64 H new ATOM 0 HB1 ALA B 113 -11.471 29.554 -11.735 1.00 17.96 H new ATOM 0 HB2 ALA B 113 -12.624 29.578 -12.821 1.00 17.96 H new ATOM 0 HB3 ALA B 113 -11.842 30.909 -12.466 1.00 17.96 H new ATOM 2283 N GLU B 114 -12.383 32.411 -9.890 1.00 18.38 N ATOM 2284 CA GLU B 114 -11.637 33.135 -8.822 1.00 17.81 C ATOM 2285 C GLU B 114 -12.430 33.012 -7.526 1.00 19.63 C ATOM 2286 O GLU B 114 -11.830 32.999 -6.454 1.00 18.91 O ATOM 2287 CB GLU B 114 -11.484 34.651 -9.078 1.00 17.61 C ATOM 2288 CG GLU B 114 -10.962 35.147 -10.489 1.00 17.68 C ATOM 2289 CD GLU B 114 -9.796 34.347 -11.129 1.00 19.60 C ATOM 2290 OE1 GLU B 114 -9.350 34.837 -12.257 1.00 20.84 O ATOM 2291 OE2 GLU B 114 -9.226 33.379 -10.512 1.00 21.82 O ATOM 0 H GLU B 114 -12.689 32.909 -10.521 1.00 18.38 H new ATOM 0 HA GLU B 114 -10.753 32.737 -8.791 1.00 17.81 H new ATOM 0 HB2 GLU B 114 -12.350 35.062 -8.926 1.00 17.61 H new ATOM 0 HB3 GLU B 114 -10.881 35.002 -8.404 1.00 17.61 H new ATOM 0 HG2 GLU B 114 -11.709 35.138 -11.107 1.00 17.68 H new ATOM 0 HG3 GLU B 114 -10.680 36.071 -10.399 1.00 17.68 H new ATOM 2292 N LYS B 115 -13.772 33.001 -7.629 1.00 19.74 N ATOM 2293 CA LYS B 115 -14.575 32.699 -6.328 1.00 21.61 C ATOM 2294 C LYS B 115 -14.133 31.415 -5.598 1.00 22.81 C ATOM 2295 O LYS B 115 -14.018 31.355 -4.335 1.00 21.28 O ATOM 2296 CB LYS B 115 -16.085 32.599 -6.669 1.00 20.84 C ATOM 2297 CG LYS B 115 -16.662 33.933 -7.097 1.00 23.34 C ATOM 2298 CD LYS B 115 -18.092 33.712 -7.644 1.00 29.11 C ATOM 2299 CE LYS B 115 -18.634 35.090 -8.128 1.00 32.71 C ATOM 2300 NZ LYS B 115 -20.140 34.851 -8.516 1.00 35.71 N ATOM 0 H LYS B 115 -14.231 33.144 -8.342 1.00 19.74 H new ATOM 0 HA LYS B 115 -14.396 33.434 -5.721 1.00 21.61 H new ATOM 0 HB2 LYS B 115 -16.213 31.950 -7.379 1.00 20.84 H new ATOM 0 HB3 LYS B 115 -16.569 32.272 -5.895 1.00 20.84 H new ATOM 0 HG2 LYS B 115 -16.682 34.546 -6.345 1.00 23.34 H new ATOM 0 HG3 LYS B 115 -16.102 34.337 -7.778 1.00 23.34 H new ATOM 0 HD2 LYS B 115 -18.082 33.075 -8.375 1.00 29.11 H new ATOM 0 HD3 LYS B 115 -18.667 33.344 -6.955 1.00 29.11 H new ATOM 0 HE2 LYS B 115 -18.557 35.758 -7.429 1.00 32.71 H new ATOM 0 HE3 LYS B 115 -18.127 35.415 -8.888 1.00 32.71 H new ATOM 0 HZ1 LYS B 115 -20.595 35.610 -8.422 1.00 35.71 H new ATOM 0 HZ2 LYS B 115 -20.189 34.579 -9.362 1.00 35.71 H new ATOM 0 HZ3 LYS B 115 -20.489 34.228 -7.984 1.00 35.71 H new ATOM 2301 N ILE B 116 -13.855 30.398 -6.389 1.00 20.45 N ATOM 2302 CA ILE B 116 -13.374 29.104 -5.868 1.00 21.21 C ATOM 2303 C ILE B 116 -11.936 29.229 -5.331 1.00 22.56 C ATOM 2304 O ILE B 116 -11.617 28.787 -4.199 1.00 21.54 O ATOM 2305 CB ILE B 116 -13.435 28.000 -6.933 1.00 21.76 C ATOM 2306 CG1 ILE B 116 -14.937 27.751 -7.281 1.00 25.80 C ATOM 2307 CG2 ILE B 116 -12.821 26.728 -6.399 1.00 23.22 C ATOM 2308 CD1 ILE B 116 -15.092 27.237 -8.645 1.00 26.85 C ATOM 0 H ILE B 116 -13.935 30.424 -7.245 1.00 20.45 H new ATOM 0 HA ILE B 116 -13.966 28.855 -5.141 1.00 21.21 H new ATOM 0 HB ILE B 116 -12.941 28.271 -7.723 1.00 21.76 H new ATOM 0 HG12 ILE B 116 -15.316 27.119 -6.650 1.00 25.80 H new ATOM 0 HG13 ILE B 116 -15.434 28.579 -7.187 1.00 25.80 H new ATOM 0 HG21 ILE B 116 -12.864 26.037 -7.079 1.00 23.22 H new ATOM 0 HG22 ILE B 116 -11.894 26.890 -6.162 1.00 23.22 H new ATOM 0 HG23 ILE B 116 -13.309 26.438 -5.613 1.00 23.22 H new ATOM 0 HD11 ILE B 116 -16.033 27.093 -8.832 1.00 26.85 H new ATOM 0 HD12 ILE B 116 -14.733 27.880 -9.276 1.00 26.85 H new ATOM 0 HD13 ILE B 116 -14.613 26.398 -8.731 1.00 26.85 H new ATOM 2309 N HIS B 117 -11.048 29.822 -6.145 1.00 21.39 N ATOM 2310 CA HIS B 117 -9.670 30.026 -5.690 1.00 20.55 C ATOM 2311 C HIS B 117 -9.592 30.752 -4.346 1.00 20.93 C ATOM 2312 O HIS B 117 -8.775 30.369 -3.521 1.00 22.12 O ATOM 2313 CB HIS B 117 -8.863 30.873 -6.752 1.00 19.11 C ATOM 2314 CG HIS B 117 -8.845 30.244 -8.112 1.00 17.80 C ATOM 2315 ND1 HIS B 117 -8.404 30.950 -9.241 1.00 20.41 N ATOM 2316 CD2 HIS B 117 -9.235 28.987 -8.523 1.00 16.85 C ATOM 2317 CE1 HIS B 117 -8.546 30.115 -10.281 1.00 19.75 C ATOM 2318 NE2 HIS B 117 -9.022 28.929 -9.888 1.00 19.63 N ATOM 0 H HIS B 117 -11.219 30.104 -6.939 1.00 21.39 H new ATOM 0 HA HIS B 117 -9.286 29.142 -5.585 1.00 20.55 H new ATOM 0 HB2 HIS B 117 -9.254 31.759 -6.816 1.00 19.11 H new ATOM 0 HB3 HIS B 117 -7.951 30.987 -6.442 1.00 19.11 H new ATOM 0 HD2 HIS B 117 -9.576 28.309 -7.986 1.00 16.85 H new ATOM 0 HE1 HIS B 117 -8.340 30.333 -11.161 1.00 19.75 H new ATOM 0 HE2 HIS B 117 -9.170 28.250 -10.395 1.00 19.63 H new ATOM 2319 N ALA B 118 -10.385 31.817 -4.129 1.00 20.29 N ATOM 2320 CA ALA B 118 -10.242 32.563 -2.903 1.00 22.65 C ATOM 2321 C ALA B 118 -10.590 31.608 -1.782 1.00 22.08 C ATOM 2322 O ALA B 118 -9.938 31.588 -0.776 1.00 24.65 O ATOM 2323 CB ALA B 118 -11.230 33.820 -2.853 1.00 24.49 C ATOM 0 H ALA B 118 -10.989 32.104 -4.670 1.00 20.29 H new ATOM 0 HA ALA B 118 -9.339 32.909 -2.829 1.00 22.65 H new ATOM 0 HB1 ALA B 118 -11.106 34.296 -2.017 1.00 24.49 H new ATOM 0 HB2 ALA B 118 -11.036 34.414 -3.595 1.00 24.49 H new ATOM 0 HB3 ALA B 118 -12.148 33.513 -2.917 1.00 24.49 H new ATOM 2324 N GLU B 119 -11.657 30.848 -1.959 1.00 23.86 N ATOM 2325 CA GLU B 119 -12.088 29.959 -0.828 1.00 25.14 C ATOM 2326 C GLU B 119 -11.040 28.842 -0.537 1.00 25.59 C ATOM 2327 O GLU B 119 -10.708 28.572 0.609 1.00 25.62 O ATOM 2328 CB GLU B 119 -13.509 29.385 -1.094 1.00 28.33 C ATOM 2329 CG GLU B 119 -14.609 30.449 -0.839 1.00 34.35 C ATOM 2330 CD GLU B 119 -14.342 31.435 0.394 1.00 45.12 C ATOM 2331 OE1 GLU B 119 -13.893 32.641 0.217 1.00 46.62 O ATOM 2332 OE2 GLU B 119 -14.577 31.009 1.548 1.00 46.91 O ATOM 0 H GLU B 119 -12.137 30.813 -2.672 1.00 23.86 H new ATOM 0 HA GLU B 119 -12.138 30.498 -0.023 1.00 25.14 H new ATOM 0 HB2 GLU B 119 -13.566 29.072 -2.010 1.00 28.33 H new ATOM 0 HB3 GLU B 119 -13.661 28.617 -0.522 1.00 28.33 H new ATOM 0 HG2 GLU B 119 -14.714 30.982 -1.642 1.00 34.35 H new ATOM 0 HG3 GLU B 119 -15.451 29.991 -0.690 1.00 34.35 H new ATOM 2333 N LEU B 120 -10.488 28.242 -1.602 1.00 21.75 N ATOM 2334 CA LEU B 120 -9.487 27.187 -1.408 1.00 21.88 C ATOM 2335 C LEU B 120 -8.245 27.708 -0.676 1.00 23.36 C ATOM 2336 O LEU B 120 -7.671 27.011 0.179 1.00 24.33 O ATOM 2337 CB LEU B 120 -9.141 26.544 -2.717 1.00 22.22 C ATOM 2338 CG LEU B 120 -10.240 25.808 -3.442 1.00 22.21 C ATOM 2339 CD1 LEU B 120 -9.843 25.332 -4.856 1.00 21.47 C ATOM 2340 CD2 LEU B 120 -10.565 24.594 -2.551 1.00 29.39 C ATOM 0 H LEU B 120 -10.674 28.426 -2.421 1.00 21.75 H new ATOM 0 HA LEU B 120 -9.875 26.506 -0.837 1.00 21.88 H new ATOM 0 HB2 LEU B 120 -8.801 27.233 -3.309 1.00 22.22 H new ATOM 0 HB3 LEU B 120 -8.415 25.920 -2.562 1.00 22.22 H new ATOM 0 HG LEU B 120 -10.995 26.401 -3.581 1.00 22.21 H new ATOM 0 HD11 LEU B 120 -10.591 24.869 -5.264 1.00 21.47 H new ATOM 0 HD12 LEU B 120 -9.602 26.098 -5.400 1.00 21.47 H new ATOM 0 HD13 LEU B 120 -9.085 24.729 -4.794 1.00 21.47 H new ATOM 0 HD21 LEU B 120 -11.271 24.071 -2.961 1.00 29.39 H new ATOM 0 HD22 LEU B 120 -9.772 24.044 -2.451 1.00 29.39 H new ATOM 0 HD23 LEU B 120 -10.856 24.902 -1.678 1.00 29.39 H new ATOM 2341 N TYR B 121 -7.819 28.943 -1.001 1.00 21.83 N ATOM 2342 CA TYR B 121 -6.618 29.455 -0.364 1.00 22.14 C ATOM 2343 C TYR B 121 -6.925 29.837 1.111 1.00 24.02 C ATOM 2344 O TYR B 121 -6.045 29.788 1.967 1.00 23.97 O ATOM 2345 CB TYR B 121 -6.094 30.673 -1.115 1.00 22.41 C ATOM 2346 CG TYR B 121 -5.434 30.416 -2.481 1.00 19.16 C ATOM 2347 CD1 TYR B 121 -5.522 31.384 -3.498 1.00 19.82 C ATOM 2348 CD2 TYR B 121 -4.635 29.299 -2.675 1.00 21.51 C ATOM 2349 CE1 TYR B 121 -4.847 31.181 -4.721 1.00 19.37 C ATOM 2350 CE2 TYR B 121 -3.963 29.072 -3.881 1.00 21.74 C ATOM 2351 CZ TYR B 121 -4.057 30.000 -4.902 1.00 20.38 C ATOM 2352 OH TYR B 121 -3.328 29.763 -6.109 1.00 19.67 O ATOM 0 H TYR B 121 -8.199 29.471 -1.564 1.00 21.83 H new ATOM 0 HA TYR B 121 -5.938 28.763 -0.382 1.00 22.14 H new ATOM 0 HB2 TYR B 121 -6.833 31.287 -1.247 1.00 22.41 H new ATOM 0 HB3 TYR B 121 -5.449 31.123 -0.548 1.00 22.41 H new ATOM 0 HD1 TYR B 121 -6.024 32.156 -3.365 1.00 19.82 H new ATOM 0 HD2 TYR B 121 -4.543 28.683 -1.984 1.00 21.51 H new ATOM 0 HE1 TYR B 121 -4.915 31.809 -5.404 1.00 19.37 H new ATOM 0 HE2 TYR B 121 -3.456 28.301 -3.995 1.00 21.74 H new ATOM 0 HH TYR B 121 -3.265 30.479 -6.544 1.00 19.67 H new ATOM 2353 N ARG B 122 -8.153 30.262 1.393 1.00 24.75 N ATOM 2354 CA ARG B 122 -8.520 30.474 2.813 1.00 27.08 C ATOM 2355 C ARG B 122 -8.496 29.138 3.548 1.00 26.35 C ATOM 2356 O ARG B 122 -7.958 29.088 4.631 1.00 28.87 O ATOM 2357 CB ARG B 122 -9.978 31.002 2.959 1.00 28.80 C ATOM 2358 CG ARG B 122 -10.191 32.402 2.536 1.00 33.32 C ATOM 2359 CD ARG B 122 -11.727 32.823 2.714 1.00 38.74 C ATOM 2360 NE ARG B 122 -11.902 34.052 1.955 1.00 45.47 N ATOM 2361 CZ ARG B 122 -11.412 35.231 2.342 1.00 50.63 C ATOM 2362 NH1 ARG B 122 -11.542 36.349 1.573 1.00 52.20 N ATOM 2363 NH2 ARG B 122 -10.788 35.295 3.506 1.00 50.79 N ATOM 0 H ARG B 122 -8.769 30.430 0.817 1.00 24.75 H new ATOM 0 HA ARG B 122 -7.887 31.114 3.173 1.00 27.08 H new ATOM 0 HB2 ARG B 122 -10.566 30.431 2.441 1.00 28.80 H new ATOM 0 HB3 ARG B 122 -10.245 30.916 3.888 1.00 28.80 H new ATOM 0 HG2 ARG B 122 -9.627 32.992 3.060 1.00 33.32 H new ATOM 0 HG3 ARG B 122 -9.928 32.508 1.608 1.00 33.32 H new ATOM 0 HD2 ARG B 122 -12.317 32.127 2.386 1.00 38.74 H new ATOM 0 HD3 ARG B 122 -11.942 32.960 3.650 1.00 38.74 H new ATOM 0 HE ARG B 122 -12.344 34.017 1.218 1.00 45.47 H new ATOM 0 HH11 ARG B 122 -11.949 36.306 0.816 1.00 52.20 H new ATOM 0 HH12 ARG B 122 -11.217 37.098 1.844 1.00 52.20 H new ATOM 0 HH21 ARG B 122 -10.707 34.589 3.990 1.00 50.79 H new ATOM 0 HH22 ARG B 122 -10.463 36.043 3.779 1.00 50.79 H new ATOM 2364 N LYS B 123 -9.029 28.052 2.974 1.00 27.69 N ATOM 2365 CA LYS B 123 -8.945 26.729 3.650 1.00 28.86 C ATOM 2366 C LYS B 123 -7.486 26.268 3.791 1.00 29.70 C ATOM 2367 O LYS B 123 -7.058 25.831 4.887 1.00 27.63 O ATOM 2368 CB LYS B 123 -9.799 25.682 2.992 1.00 30.03 C ATOM 2369 CG LYS B 123 -11.274 26.058 3.000 1.00 38.24 C ATOM 2370 CD LYS B 123 -12.082 24.971 2.177 1.00 47.56 C ATOM 2371 CE LYS B 123 -13.180 25.540 1.259 1.00 50.90 C ATOM 2372 NZ LYS B 123 -13.366 24.564 0.099 1.00 52.58 N ATOM 0 H LYS B 123 -9.434 28.049 2.215 1.00 27.69 H new ATOM 0 HA LYS B 123 -9.307 26.849 4.542 1.00 28.86 H new ATOM 0 HB2 LYS B 123 -9.504 25.554 2.077 1.00 30.03 H new ATOM 0 HB3 LYS B 123 -9.680 24.835 3.449 1.00 30.03 H new ATOM 0 HG2 LYS B 123 -11.604 26.104 3.911 1.00 38.24 H new ATOM 0 HG3 LYS B 123 -11.399 26.937 2.609 1.00 38.24 H new ATOM 0 HD2 LYS B 123 -11.457 24.463 1.636 1.00 47.56 H new ATOM 0 HD3 LYS B 123 -12.489 24.349 2.800 1.00 47.56 H new ATOM 0 HE2 LYS B 123 -14.010 25.649 1.749 1.00 50.90 H new ATOM 0 HE3 LYS B 123 -12.928 26.417 0.929 1.00 50.90 H new ATOM 0 HZ1 LYS B 123 -14.212 24.587 -0.176 1.00 52.58 H new ATOM 0 HZ2 LYS B 123 -12.830 24.796 -0.573 1.00 52.58 H new ATOM 0 HZ3 LYS B 123 -13.164 23.740 0.369 1.00 52.58 H new ATOM 2373 N ALA B 124 -6.695 26.425 2.714 1.00 26.45 N ATOM 2374 CA ALA B 124 -5.273 26.133 2.838 1.00 24.92 C ATOM 2375 C ALA B 124 -4.534 26.943 3.933 1.00 24.51 C ATOM 2376 O ALA B 124 -3.636 26.386 4.638 1.00 25.26 O ATOM 2377 CB ALA B 124 -4.532 26.279 1.442 1.00 24.14 C ATOM 0 H ALA B 124 -6.956 26.689 1.938 1.00 26.45 H new ATOM 0 HA ALA B 124 -5.236 25.209 3.131 1.00 24.92 H new ATOM 0 HB1 ALA B 124 -3.589 26.079 1.553 1.00 24.14 H new ATOM 0 HB2 ALA B 124 -4.920 25.660 0.803 1.00 24.14 H new ATOM 0 HB3 ALA B 124 -4.633 27.187 1.115 1.00 24.14 H new ATOM 2378 N LYS B 125 -4.825 28.248 4.058 1.00 24.41 N ATOM 2379 CA LYS B 125 -4.073 29.065 4.977 1.00 25.78 C ATOM 2380 C LYS B 125 -4.349 28.635 6.408 1.00 29.50 C ATOM 2381 O LYS B 125 -3.435 28.673 7.283 1.00 27.98 O ATOM 2382 CB LYS B 125 -4.427 30.534 4.834 1.00 26.15 C ATOM 2383 CG LYS B 125 -3.453 31.479 5.553 1.00 25.94 C ATOM 2384 CD LYS B 125 -3.959 32.942 5.612 1.00 25.33 C ATOM 2385 CE LYS B 125 -2.967 33.854 6.337 1.00 27.85 C ATOM 2386 NZ LYS B 125 -3.482 35.233 6.625 1.00 28.74 N ATOM 0 H LYS B 125 -5.443 28.658 3.623 1.00 24.41 H new ATOM 0 HA LYS B 125 -3.134 28.947 4.766 1.00 25.78 H new ATOM 0 HB2 LYS B 125 -4.450 30.762 3.892 1.00 26.15 H new ATOM 0 HB3 LYS B 125 -5.321 30.678 5.182 1.00 26.15 H new ATOM 0 HG2 LYS B 125 -3.305 31.157 6.456 1.00 25.94 H new ATOM 0 HG3 LYS B 125 -2.596 31.457 5.100 1.00 25.94 H new ATOM 0 HD2 LYS B 125 -4.103 33.271 4.711 1.00 25.33 H new ATOM 0 HD3 LYS B 125 -4.816 32.970 6.065 1.00 25.33 H new ATOM 0 HE2 LYS B 125 -2.713 33.435 7.174 1.00 27.85 H new ATOM 0 HE3 LYS B 125 -2.162 33.928 5.801 1.00 27.85 H new ATOM 0 HZ1 LYS B 125 -2.802 35.765 6.842 1.00 28.74 H new ATOM 0 HZ2 LYS B 125 -3.891 35.554 5.903 1.00 28.74 H new ATOM 0 HZ3 LYS B 125 -4.059 35.199 7.302 1.00 28.74 H new ATOM 2387 N GLU B 126 -5.592 28.236 6.634 1.00 30.21 N ATOM 2388 CA GLU B 126 -5.953 27.791 8.032 1.00 33.64 C ATOM 2389 C GLU B 126 -5.095 26.584 8.443 1.00 34.29 C ATOM 2390 O GLU B 126 -4.643 26.475 9.597 1.00 35.86 O ATOM 2391 CB GLU B 126 -7.463 27.523 8.127 1.00 34.67 C ATOM 2392 CG GLU B 126 -8.037 27.331 9.599 1.00 42.31 C ATOM 2393 CD GLU B 126 -8.121 25.810 9.995 1.00 51.99 C ATOM 2394 OE1 GLU B 126 -8.222 24.946 9.063 1.00 55.32 O ATOM 2395 OE2 GLU B 126 -8.052 25.462 11.215 1.00 51.43 O ATOM 0 H GLU B 126 -6.224 28.205 6.052 1.00 30.21 H new ATOM 0 HA GLU B 126 -5.756 28.498 8.666 1.00 33.64 H new ATOM 0 HB2 GLU B 126 -7.933 28.261 7.708 1.00 34.67 H new ATOM 0 HB3 GLU B 126 -7.667 26.727 7.611 1.00 34.67 H new ATOM 0 HG2 GLU B 126 -7.471 27.800 10.232 1.00 42.31 H new ATOM 0 HG3 GLU B 126 -8.919 27.730 9.658 1.00 42.31 H new ATOM 2396 N LYS B 127 -4.840 25.683 7.511 1.00 34.13 N ATOM 2397 CA LYS B 127 -3.948 24.542 7.803 1.00 33.87 C ATOM 2398 C LYS B 127 -2.487 24.946 7.917 1.00 35.08 C ATOM 2399 O LYS B 127 -1.764 24.564 8.879 1.00 34.23 O ATOM 2400 CB LYS B 127 -4.151 23.481 6.740 1.00 33.53 C ATOM 2401 CG LYS B 127 -5.621 22.973 6.669 1.00 36.04 C ATOM 2402 CD LYS B 127 -5.987 22.214 7.992 1.00 46.36 C ATOM 2403 CE LYS B 127 -5.308 20.822 7.993 1.00 45.07 C ATOM 2404 NZ LYS B 127 -5.798 19.913 9.111 1.00 51.36 N ATOM 0 H LYS B 127 -5.160 25.700 6.713 1.00 34.13 H new ATOM 0 HA LYS B 127 -4.184 24.185 8.673 1.00 33.87 H new ATOM 0 HB2 LYS B 127 -3.895 23.841 5.876 1.00 33.53 H new ATOM 0 HB3 LYS B 127 -3.562 22.731 6.920 1.00 33.53 H new ATOM 0 HG2 LYS B 127 -6.224 23.721 6.538 1.00 36.04 H new ATOM 0 HG3 LYS B 127 -5.731 22.383 5.907 1.00 36.04 H new ATOM 0 HD2 LYS B 127 -5.696 22.727 8.762 1.00 46.36 H new ATOM 0 HD3 LYS B 127 -6.949 22.115 8.064 1.00 46.36 H new ATOM 0 HE2 LYS B 127 -5.469 20.390 7.140 1.00 45.07 H new ATOM 0 HE3 LYS B 127 -4.348 20.937 8.076 1.00 45.07 H new ATOM 0 HZ1 LYS B 127 -5.885 19.083 8.802 1.00 51.36 H new ATOM 0 HZ2 LYS B 127 -5.210 19.921 9.779 1.00 51.36 H new ATOM 0 HZ3 LYS B 127 -6.586 20.203 9.406 1.00 51.36 H new ATOM 2405 N ALA B 128 -2.026 25.757 6.941 1.00 34.43 N ATOM 2406 CA ALA B 128 -0.626 26.150 6.936 1.00 35.78 C ATOM 2407 C ALA B 128 -0.216 26.960 8.184 1.00 37.99 C ATOM 2408 O ALA B 128 0.855 26.732 8.733 1.00 37.85 O ATOM 2409 CB ALA B 128 -0.263 26.885 5.608 1.00 35.31 C ATOM 0 H ALA B 128 -2.501 26.075 6.298 1.00 34.43 H new ATOM 0 HA ALA B 128 -0.104 25.334 6.980 1.00 35.78 H new ATOM 0 HB1 ALA B 128 0.673 27.139 5.624 1.00 35.31 H new ATOM 0 HB2 ALA B 128 -0.425 26.294 4.856 1.00 35.31 H new ATOM 0 HB3 ALA B 128 -0.811 27.680 5.518 1.00 35.31 H new ATOM 2410 N GLU B 129 -1.065 27.892 8.628 1.00 39.96 N ATOM 2411 CA GLU B 129 -0.972 28.574 9.975 1.00 43.50 C ATOM 2412 C GLU B 129 -0.566 27.659 11.116 1.00 43.65 C ATOM 2413 O GLU B 129 0.171 28.043 11.998 1.00 44.66 O ATOM 2414 CB GLU B 129 -2.371 29.121 10.407 1.00 44.77 C ATOM 2415 CG GLU B 129 -2.955 30.334 9.694 1.00 51.32 C ATOM 2416 CD GLU B 129 -2.058 31.585 9.773 1.00 58.73 C ATOM 2417 OE1 GLU B 129 -0.825 31.402 10.010 1.00 62.96 O ATOM 2418 OE2 GLU B 129 -2.596 32.724 9.602 1.00 57.08 O ATOM 0 H GLU B 129 -1.733 28.166 8.160 1.00 39.96 H new ATOM 0 HA GLU B 129 -0.300 29.260 9.841 1.00 43.50 H new ATOM 0 HB2 GLU B 129 -3.008 28.395 10.315 1.00 44.77 H new ATOM 0 HB3 GLU B 129 -2.320 29.336 11.352 1.00 44.77 H new ATOM 0 HG2 GLU B 129 -3.105 30.111 8.762 1.00 51.32 H new ATOM 0 HG3 GLU B 129 -3.821 30.541 10.079 1.00 51.32 H new ATOM 2419 N LYS B 130 -1.108 26.454 11.120 1.00 45.80 N ATOM 2420 CA LYS B 130 -0.904 25.470 12.193 1.00 46.96 C ATOM 2421 C LYS B 130 0.140 24.453 11.823 1.00 46.92 C ATOM 2422 O LYS B 130 0.150 23.380 12.407 1.00 48.57 O ATOM 2423 CB LYS B 130 -2.217 24.700 12.438 1.00 47.33 C ATOM 2424 CG LYS B 130 -3.169 25.433 13.307 1.00 51.47 C ATOM 2425 CD LYS B 130 -4.593 25.042 13.083 1.00 56.76 C ATOM 2426 CE LYS B 130 -5.431 26.186 13.685 1.00 61.38 C ATOM 2427 NZ LYS B 130 -6.869 25.801 13.896 1.00 63.68 N ATOM 0 H LYS B 130 -1.618 26.170 10.489 1.00 45.80 H new ATOM 0 HA LYS B 130 -0.618 25.958 12.981 1.00 46.96 H new ATOM 0 HB2 LYS B 130 -2.642 24.516 11.585 1.00 47.33 H new ATOM 0 HB3 LYS B 130 -2.012 23.843 12.843 1.00 47.33 H new ATOM 0 HG2 LYS B 130 -2.938 25.274 14.236 1.00 51.47 H new ATOM 0 HG3 LYS B 130 -3.073 26.385 13.150 1.00 51.47 H new ATOM 0 HD2 LYS B 130 -4.781 24.931 12.138 1.00 56.76 H new ATOM 0 HD3 LYS B 130 -4.795 24.197 13.513 1.00 56.76 H new ATOM 0 HE2 LYS B 130 -5.044 26.454 14.533 1.00 61.38 H new ATOM 0 HE3 LYS B 130 -5.389 26.957 13.098 1.00 61.38 H new ATOM 0 HZ1 LYS B 130 -7.289 26.451 14.336 1.00 63.68 H new ATOM 0 HZ2 LYS B 130 -7.262 25.675 13.107 1.00 63.68 H new ATOM 0 HZ3 LYS B 130 -6.909 25.049 14.370 1.00 63.68 H new ATOM 2428 N GLY B 131 0.973 24.721 10.812 1.00 45.70 N ATOM 2429 CA GLY B 131 2.013 23.754 10.397 1.00 43.11 C ATOM 2430 C GLY B 131 1.500 22.462 9.757 1.00 42.44 C ATOM 2431 O GLY B 131 2.244 21.485 9.687 1.00 42.29 O ATOM 0 H GLY B 131 0.958 25.449 10.354 1.00 45.70 H new ATOM 0 HA2 GLY B 131 2.607 24.193 9.769 1.00 43.11 H new ATOM 0 HA3 GLY B 131 2.544 23.522 11.175 1.00 43.11 H new ATOM 2432 N GLU B 132 0.251 22.435 9.265 1.00 39.99 N ATOM 2433 CA GLU B 132 -0.282 21.267 8.602 1.00 40.24 C ATOM 2434 C GLU B 132 -0.433 21.543 7.115 1.00 39.23 C ATOM 2435 O GLU B 132 -0.679 22.658 6.739 1.00 38.60 O ATOM 2436 CB GLU B 132 -1.657 20.898 9.145 1.00 41.32 C ATOM 2437 CG GLU B 132 -1.606 20.350 10.585 1.00 45.74 C ATOM 2438 CD GLU B 132 -2.962 20.392 11.278 1.00 50.68 C ATOM 2439 OE1 GLU B 132 -3.942 19.892 10.693 1.00 54.83 O ATOM 2440 OE2 GLU B 132 -3.055 20.940 12.395 1.00 55.95 O ATOM 0 H GLU B 132 -0.297 23.096 9.313 1.00 39.99 H new ATOM 0 HA GLU B 132 0.336 20.537 8.761 1.00 40.24 H new ATOM 0 HB2 GLU B 132 -2.230 21.681 9.122 1.00 41.32 H new ATOM 0 HB3 GLU B 132 -2.061 20.234 8.565 1.00 41.32 H new ATOM 0 HG2 GLU B 132 -1.284 19.435 10.568 1.00 45.74 H new ATOM 0 HG3 GLU B 132 -0.967 20.866 11.101 1.00 45.74 H new ATOM 2441 N ASP B 133 -0.315 20.490 6.316 1.00 39.08 N ATOM 2442 CA ASP B 133 -0.617 20.492 4.910 1.00 39.09 C ATOM 2443 C ASP B 133 -2.124 20.250 4.796 1.00 40.91 C ATOM 2444 O ASP B 133 -2.760 19.772 5.773 1.00 40.89 O ATOM 2445 CB ASP B 133 0.172 19.377 4.239 1.00 38.24 C ATOM 2446 CG ASP B 133 0.390 19.623 2.754 1.00 37.51 C ATOM 2447 OD1 ASP B 133 0.928 18.700 2.059 1.00 32.55 O ATOM 2448 OD2 ASP B 133 -0.004 20.728 2.276 1.00 32.94 O ATOM 0 H ASP B 133 -0.044 19.725 6.600 1.00 39.08 H new ATOM 0 HA ASP B 133 -0.377 21.327 4.478 1.00 39.09 H new ATOM 0 HB2 ASP B 133 1.032 19.286 4.678 1.00 38.24 H new ATOM 0 HB3 ASP B 133 -0.298 18.537 4.358 1.00 38.24 H new ATOM 2449 N ILE B 134 -2.703 20.620 3.658 1.00 39.05 N ATOM 2450 CA ILE B 134 -4.125 20.419 3.443 1.00 41.30 C ATOM 2451 C ILE B 134 -4.276 18.999 2.950 1.00 43.24 C ATOM 2452 O ILE B 134 -3.309 18.424 2.446 1.00 43.72 O ATOM 2453 CB ILE B 134 -4.766 21.461 2.444 1.00 40.83 C ATOM 2454 CG1 ILE B 134 -4.369 21.255 0.960 1.00 41.72 C ATOM 2455 CG2 ILE B 134 -4.510 22.810 2.861 1.00 40.93 C ATOM 2456 CD1 ILE B 134 -3.061 20.989 0.700 1.00 38.49 C ATOM 0 H ILE B 134 -2.288 20.988 3.001 1.00 39.05 H new ATOM 0 HA ILE B 134 -4.609 20.564 4.271 1.00 41.30 H new ATOM 0 HB ILE B 134 -5.721 21.294 2.483 1.00 40.83 H new ATOM 0 HG12 ILE B 134 -4.901 20.526 0.604 1.00 41.72 H new ATOM 0 HG13 ILE B 134 -4.617 22.053 0.468 1.00 41.72 H new ATOM 0 HG21 ILE B 134 -4.914 23.426 2.230 1.00 40.93 H new ATOM 0 HG22 ILE B 134 -4.890 22.954 3.742 1.00 40.93 H new ATOM 0 HG23 ILE B 134 -3.553 22.963 2.893 1.00 40.93 H new ATOM 0 HD11 ILE B 134 -2.936 20.881 -0.256 1.00 38.49 H new ATOM 0 HD12 ILE B 134 -2.512 21.724 1.016 1.00 38.49 H new ATOM 0 HD13 ILE B 134 -2.800 20.173 1.154 1.00 38.49 H new ATOM 2457 N GLU B 135 -5.447 18.395 3.121 1.00 45.23 N ATOM 2458 CA GLU B 135 -5.597 17.013 2.721 1.00 48.49 C ATOM 2459 C GLU B 135 -6.450 17.083 1.485 1.00 49.41 C ATOM 2460 O GLU B 135 -7.678 17.036 1.585 1.00 51.66 O ATOM 2461 CB GLU B 135 -6.369 16.226 3.787 1.00 49.39 C ATOM 2462 CG GLU B 135 -5.735 16.155 5.159 1.00 54.92 C ATOM 2463 CD GLU B 135 -6.645 15.452 6.231 1.00 64.78 C ATOM 2464 OE1 GLU B 135 -6.558 15.832 7.434 1.00 67.26 O ATOM 2465 OE2 GLU B 135 -7.434 14.515 5.894 1.00 66.69 O ATOM 0 H GLU B 135 -6.148 18.761 3.459 1.00 45.23 H new ATOM 0 HA GLU B 135 -4.739 16.580 2.588 1.00 48.49 H new ATOM 0 HB2 GLU B 135 -7.250 16.622 3.879 1.00 49.39 H new ATOM 0 HB3 GLU B 135 -6.497 15.320 3.464 1.00 49.39 H new ATOM 0 HG2 GLU B 135 -4.894 15.677 5.095 1.00 54.92 H new ATOM 0 HG3 GLU B 135 -5.528 17.054 5.459 1.00 54.92 H new ATOM 2466 N ILE B 136 -5.837 17.279 0.335 1.00 48.94 N ATOM 2467 CA ILE B 136 -6.517 17.156 -0.963 1.00 48.88 C ATOM 2468 C ILE B 136 -5.635 16.188 -1.731 1.00 47.29 C ATOM 2469 O ILE B 136 -4.373 16.234 -1.630 1.00 48.21 O ATOM 2470 CB ILE B 136 -6.533 18.478 -1.788 1.00 50.08 C ATOM 2471 CG1 ILE B 136 -5.090 18.855 -2.113 1.00 52.28 C ATOM 2472 CG2 ILE B 136 -7.230 19.634 -1.043 1.00 52.29 C ATOM 2473 CD1 ILE B 136 -4.941 20.063 -2.982 1.00 55.99 C ATOM 0 H ILE B 136 -5.006 17.490 0.273 1.00 48.94 H new ATOM 0 HA ILE B 136 -7.441 16.893 -0.827 1.00 48.88 H new ATOM 0 HB ILE B 136 -7.044 18.327 -2.599 1.00 50.08 H new ATOM 0 HG12 ILE B 136 -4.614 19.008 -1.282 1.00 52.28 H new ATOM 0 HG13 ILE B 136 -4.662 18.102 -2.550 1.00 52.28 H new ATOM 0 HG21 ILE B 136 -7.214 20.431 -1.595 1.00 52.29 H new ATOM 0 HG22 ILE B 136 -8.150 19.390 -0.855 1.00 52.29 H new ATOM 0 HG23 ILE B 136 -6.765 19.809 -0.210 1.00 52.29 H new ATOM 0 HD11 ILE B 136 -3.999 20.234 -3.140 1.00 55.99 H new ATOM 0 HD12 ILE B 136 -5.388 19.910 -3.829 1.00 55.99 H new ATOM 0 HD13 ILE B 136 -5.339 20.830 -2.541 1.00 55.99 H new ATOM 2474 N LYS B 137 -6.253 15.307 -2.490 1.00 43.63 N ATOM 2475 CA LYS B 137 -5.501 14.298 -3.210 1.00 42.85 C ATOM 2476 C LYS B 137 -5.297 14.739 -4.685 1.00 41.11 C ATOM 2477 O LYS B 137 -4.175 14.613 -5.256 1.00 40.64 O ATOM 2478 CB LYS B 137 -6.252 12.942 -3.086 1.00 44.69 C ATOM 2479 CG LYS B 137 -6.659 12.603 -1.572 1.00 47.96 C ATOM 2480 CD LYS B 137 -7.969 11.766 -1.444 1.00 55.28 C ATOM 2481 CE LYS B 137 -8.328 11.499 0.039 1.00 58.79 C ATOM 2482 NZ LYS B 137 -9.048 12.687 0.605 1.00 60.81 N ATOM 0 H LYS B 137 -7.105 15.274 -2.603 1.00 43.63 H new ATOM 0 HA LYS B 137 -4.615 14.188 -2.830 1.00 42.85 H new ATOM 0 HB2 LYS B 137 -7.051 12.967 -3.635 1.00 44.69 H new ATOM 0 HB3 LYS B 137 -5.691 12.232 -3.434 1.00 44.69 H new ATOM 0 HG2 LYS B 137 -5.932 12.117 -1.152 1.00 47.96 H new ATOM 0 HG3 LYS B 137 -6.766 13.433 -1.081 1.00 47.96 H new ATOM 0 HD2 LYS B 137 -8.699 12.237 -1.875 1.00 55.28 H new ATOM 0 HD3 LYS B 137 -7.862 10.922 -1.909 1.00 55.28 H new ATOM 0 HE2 LYS B 137 -8.885 10.708 0.109 1.00 58.79 H new ATOM 0 HE3 LYS B 137 -7.522 11.324 0.550 1.00 58.79 H new ATOM 0 HZ1 LYS B 137 -9.253 12.532 1.457 1.00 60.81 H new ATOM 0 HZ2 LYS B 137 -8.524 13.405 0.553 1.00 60.81 H new ATOM 0 HZ3 LYS B 137 -9.794 12.831 0.142 1.00 60.81 H new ATOM 2483 N LYS B 138 -6.393 15.211 -5.304 1.00 38.10 N ATOM 2484 CA LYS B 138 -6.329 15.750 -6.671 1.00 35.87 C ATOM 2485 C LYS B 138 -7.121 17.017 -6.864 1.00 32.15 C ATOM 2486 O LYS B 138 -8.035 17.333 -6.093 1.00 30.21 O ATOM 2487 CB LYS B 138 -6.728 14.756 -7.738 1.00 37.34 C ATOM 2488 CG LYS B 138 -7.740 13.779 -7.260 1.00 44.36 C ATOM 2489 CD LYS B 138 -7.859 12.625 -8.227 1.00 50.30 C ATOM 2490 CE LYS B 138 -6.614 11.758 -8.223 1.00 55.71 C ATOM 2491 NZ LYS B 138 -6.969 10.381 -8.721 1.00 58.98 N ATOM 0 H LYS B 138 -7.177 15.227 -4.950 1.00 38.10 H new ATOM 0 HA LYS B 138 -5.387 15.957 -6.779 1.00 35.87 H new ATOM 0 HB2 LYS B 138 -7.082 15.234 -8.504 1.00 37.34 H new ATOM 0 HB3 LYS B 138 -5.940 14.278 -8.041 1.00 37.34 H new ATOM 0 HG2 LYS B 138 -7.490 13.449 -6.383 1.00 44.36 H new ATOM 0 HG3 LYS B 138 -8.600 14.217 -7.163 1.00 44.36 H new ATOM 0 HD2 LYS B 138 -8.630 12.085 -7.993 1.00 50.30 H new ATOM 0 HD3 LYS B 138 -8.013 12.967 -9.122 1.00 50.30 H new ATOM 0 HE2 LYS B 138 -5.930 12.152 -8.787 1.00 55.71 H new ATOM 0 HE3 LYS B 138 -6.246 11.705 -7.327 1.00 55.71 H new ATOM 0 HZ1 LYS B 138 -6.347 10.103 -9.294 1.00 58.98 H new ATOM 0 HZ2 LYS B 138 -7.011 9.818 -8.033 1.00 58.98 H new ATOM 0 HZ3 LYS B 138 -7.759 10.408 -9.131 1.00 58.98 H new ATOM 2492 N VAL B 139 -6.688 17.763 -7.898 1.00 29.83 N ATOM 2493 CA VAL B 139 -7.428 18.999 -8.229 1.00 26.82 C ATOM 2494 C VAL B 139 -7.708 18.863 -9.726 1.00 25.73 C ATOM 2495 O VAL B 139 -6.824 18.459 -10.531 1.00 26.96 O ATOM 2496 CB VAL B 139 -6.572 20.259 -7.969 1.00 27.65 C ATOM 2497 CG1 VAL B 139 -7.414 21.539 -8.285 1.00 25.37 C ATOM 2498 CG2 VAL B 139 -6.068 20.292 -6.539 1.00 26.87 C ATOM 0 H VAL B 139 -6.008 17.586 -8.394 1.00 29.83 H new ATOM 0 HA VAL B 139 -8.228 19.100 -7.690 1.00 26.82 H new ATOM 0 HB VAL B 139 -5.798 20.234 -8.553 1.00 27.65 H new ATOM 0 HG11 VAL B 139 -6.876 22.329 -8.121 1.00 25.37 H new ATOM 0 HG12 VAL B 139 -7.690 21.523 -9.215 1.00 25.37 H new ATOM 0 HG13 VAL B 139 -8.199 21.559 -7.715 1.00 25.37 H new ATOM 0 HG21 VAL B 139 -5.535 21.091 -6.402 1.00 26.87 H new ATOM 0 HG22 VAL B 139 -6.823 20.299 -5.930 1.00 26.87 H new ATOM 0 HG23 VAL B 139 -5.524 19.507 -6.369 1.00 26.87 H new ATOM 2499 N TYR B 140 -8.917 19.224 -10.131 1.00 23.78 N ATOM 2500 CA TYR B 140 -9.254 19.154 -11.542 1.00 21.50 C ATOM 2501 C TYR B 140 -9.483 20.564 -12.062 1.00 21.22 C ATOM 2502 O TYR B 140 -10.146 21.350 -11.389 1.00 21.68 O ATOM 2503 CB TYR B 140 -10.587 18.446 -11.663 1.00 23.83 C ATOM 2504 CG TYR B 140 -10.492 17.004 -11.257 1.00 28.35 C ATOM 2505 CD1 TYR B 140 -10.689 16.640 -9.924 1.00 32.15 C ATOM 2506 CD2 TYR B 140 -10.191 16.031 -12.185 1.00 29.18 C ATOM 2507 CE1 TYR B 140 -10.610 15.295 -9.542 1.00 36.17 C ATOM 2508 CE2 TYR B 140 -10.135 14.645 -11.815 1.00 35.30 C ATOM 2509 CZ TYR B 140 -10.323 14.319 -10.507 1.00 38.30 C ATOM 2510 OH TYR B 140 -10.256 13.011 -10.107 1.00 44.04 O ATOM 0 H TYR B 140 -9.545 19.507 -9.616 1.00 23.78 H new ATOM 0 HA TYR B 140 -8.546 18.704 -12.029 1.00 21.50 H new ATOM 0 HB2 TYR B 140 -11.243 18.896 -11.108 1.00 23.83 H new ATOM 0 HB3 TYR B 140 -10.902 18.504 -12.579 1.00 23.83 H new ATOM 0 HD1 TYR B 140 -10.873 17.293 -9.288 1.00 32.15 H new ATOM 0 HD2 TYR B 140 -10.021 16.276 -13.066 1.00 29.18 H new ATOM 0 HE1 TYR B 140 -10.747 15.051 -8.655 1.00 36.17 H new ATOM 0 HE2 TYR B 140 -9.974 13.987 -12.452 1.00 35.30 H new ATOM 0 HH TYR B 140 -10.080 12.524 -10.769 1.00 44.04 H new ATOM 2511 N ILE B 141 -9.039 20.838 -13.286 1.00 19.41 N ATOM 2512 CA ILE B 141 -9.224 22.173 -13.830 1.00 19.61 C ATOM 2513 C ILE B 141 -9.853 22.098 -15.203 1.00 18.80 C ATOM 2514 O ILE B 141 -9.386 21.354 -16.052 1.00 19.70 O ATOM 2515 CB ILE B 141 -7.785 22.940 -14.019 1.00 19.55 C ATOM 2516 CG1 ILE B 141 -6.992 22.997 -12.726 1.00 19.76 C ATOM 2517 CG2 ILE B 141 -8.039 24.405 -14.571 1.00 18.16 C ATOM 2518 CD1 ILE B 141 -7.728 23.770 -11.518 1.00 21.88 C ATOM 0 H ILE B 141 -8.639 20.280 -13.804 1.00 19.41 H new ATOM 0 HA ILE B 141 -9.789 22.655 -13.206 1.00 19.61 H new ATOM 0 HB ILE B 141 -7.257 22.433 -14.655 1.00 19.55 H new ATOM 0 HG12 ILE B 141 -6.795 22.091 -12.441 1.00 19.76 H new ATOM 0 HG13 ILE B 141 -6.142 23.430 -12.901 1.00 19.76 H new ATOM 0 HG21 ILE B 141 -7.190 24.860 -14.684 1.00 18.16 H new ATOM 0 HG22 ILE B 141 -8.494 24.354 -15.426 1.00 18.16 H new ATOM 0 HG23 ILE B 141 -8.589 24.897 -13.941 1.00 18.16 H new ATOM 0 HD11 ILE B 141 -7.158 23.761 -10.733 1.00 21.88 H new ATOM 0 HD12 ILE B 141 -7.903 24.687 -11.780 1.00 21.88 H new ATOM 0 HD13 ILE B 141 -8.566 23.327 -11.313 1.00 21.88 H new ATOM 2519 N CYS B 142 -10.970 22.822 -15.445 1.00 18.41 N ATOM 2520 CA CYS B 142 -11.516 22.887 -16.788 1.00 17.84 C ATOM 2521 C CYS B 142 -10.580 23.679 -17.762 1.00 21.07 C ATOM 2522 O CYS B 142 -10.218 24.825 -17.468 1.00 20.65 O ATOM 2523 CB CYS B 142 -12.851 23.609 -16.725 1.00 16.51 C ATOM 2524 SG CYS B 142 -13.642 23.681 -18.325 1.00 19.12 S ATOM 0 H CYS B 142 -11.405 23.266 -14.851 1.00 18.41 H new ATOM 0 HA CYS B 142 -11.608 21.981 -17.122 1.00 17.84 H new ATOM 0 HB2 CYS B 142 -13.434 23.156 -16.096 1.00 16.51 H new ATOM 0 HB3 CYS B 142 -12.716 24.509 -16.390 1.00 16.51 H new ATOM 2525 N PRO B 143 -10.205 23.068 -18.901 1.00 22.07 N ATOM 2526 CA PRO B 143 -9.227 23.734 -19.835 1.00 22.32 C ATOM 2527 C PRO B 143 -9.942 24.751 -20.695 1.00 23.72 C ATOM 2528 O PRO B 143 -9.295 25.477 -21.413 1.00 22.58 O ATOM 2529 CB PRO B 143 -8.696 22.560 -20.680 1.00 23.01 C ATOM 2530 CG PRO B 143 -9.972 21.562 -20.749 1.00 23.76 C ATOM 2531 CD PRO B 143 -10.508 21.648 -19.260 1.00 20.95 C ATOM 0 HA PRO B 143 -8.519 24.218 -19.382 1.00 22.32 H new ATOM 0 HB2 PRO B 143 -8.417 22.849 -21.563 1.00 23.01 H new ATOM 0 HB3 PRO B 143 -7.929 22.136 -20.265 1.00 23.01 H new ATOM 0 HG2 PRO B 143 -10.633 21.857 -21.394 1.00 23.76 H new ATOM 0 HG3 PRO B 143 -9.718 20.659 -20.996 1.00 23.76 H new ATOM 0 HD2 PRO B 143 -11.457 21.454 -19.204 1.00 20.95 H new ATOM 0 HD3 PRO B 143 -10.055 21.021 -18.674 1.00 20.95 H new ATOM 2532 N ILE B 144 -11.284 24.862 -20.579 1.00 21.88 N ATOM 2533 CA ILE B 144 -12.065 25.884 -21.319 1.00 21.74 C ATOM 2534 C ILE B 144 -12.218 27.203 -20.551 1.00 22.22 C ATOM 2535 O ILE B 144 -11.990 28.307 -21.084 1.00 22.30 O ATOM 2536 CB ILE B 144 -13.488 25.371 -21.633 1.00 22.55 C ATOM 2537 CG1 ILE B 144 -13.449 23.997 -22.343 1.00 24.46 C ATOM 2538 CG2 ILE B 144 -14.253 26.441 -22.474 1.00 23.83 C ATOM 2539 CD1 ILE B 144 -12.783 23.891 -23.685 1.00 31.52 C ATOM 0 H ILE B 144 -11.761 24.353 -20.076 1.00 21.88 H new ATOM 0 HA ILE B 144 -11.561 26.048 -22.131 1.00 21.74 H new ATOM 0 HB ILE B 144 -13.966 25.235 -20.800 1.00 22.55 H new ATOM 0 HG12 ILE B 144 -13.008 23.371 -21.747 1.00 24.46 H new ATOM 0 HG13 ILE B 144 -14.365 23.694 -22.446 1.00 24.46 H new ATOM 0 HG21 ILE B 144 -15.147 26.119 -22.671 1.00 23.83 H new ATOM 0 HG22 ILE B 144 -14.311 27.268 -21.970 1.00 23.83 H new ATOM 0 HG23 ILE B 144 -13.777 26.602 -23.304 1.00 23.83 H new ATOM 0 HD11 ILE B 144 -12.837 22.976 -24.002 1.00 31.52 H new ATOM 0 HD12 ILE B 144 -13.229 24.478 -24.315 1.00 31.52 H new ATOM 0 HD13 ILE B 144 -11.852 24.151 -23.606 1.00 31.52 H new ATOM 2540 N CYS B 145 -12.563 27.121 -19.277 1.00 19.29 N ATOM 2541 CA CYS B 145 -12.893 28.312 -18.487 1.00 20.22 C ATOM 2542 C CYS B 145 -12.093 28.400 -17.176 1.00 20.06 C ATOM 2543 O CYS B 145 -12.172 29.413 -16.443 1.00 22.83 O ATOM 2544 CB CYS B 145 -14.413 28.359 -18.193 1.00 22.27 C ATOM 2545 SG CYS B 145 -14.901 27.104 -16.939 1.00 20.59 S ATOM 0 H CYS B 145 -12.615 26.381 -18.841 1.00 19.29 H new ATOM 0 HA CYS B 145 -12.642 29.081 -19.022 1.00 20.22 H new ATOM 0 HB2 CYS B 145 -14.655 29.244 -17.877 1.00 22.27 H new ATOM 0 HB3 CYS B 145 -14.907 28.206 -19.014 1.00 22.27 H new ATOM 2546 N GLY B 146 -11.338 27.352 -16.783 1.00 18.51 N ATOM 2547 CA GLY B 146 -10.548 27.542 -15.551 1.00 17.53 C ATOM 2548 C GLY B 146 -11.294 27.123 -14.296 1.00 20.08 C ATOM 2549 O GLY B 146 -10.789 27.201 -13.222 1.00 20.26 O ATOM 0 H GLY B 146 -11.271 26.590 -17.176 1.00 18.51 H new ATOM 0 HA2 GLY B 146 -9.726 27.031 -15.618 1.00 17.53 H new ATOM 0 HA3 GLY B 146 -10.296 28.476 -15.475 1.00 17.53 H new ATOM 2550 N TYR B 147 -12.542 26.666 -14.454 1.00 19.81 N ATOM 2551 CA TYR B 147 -13.274 26.212 -13.279 1.00 20.20 C ATOM 2552 C TYR B 147 -12.444 25.148 -12.524 1.00 20.45 C ATOM 2553 O TYR B 147 -11.882 24.247 -13.150 1.00 19.23 O ATOM 2554 CB TYR B 147 -14.611 25.567 -13.758 1.00 22.13 C ATOM 2555 CG TYR B 147 -15.373 25.045 -12.569 1.00 23.77 C ATOM 2556 CD1 TYR B 147 -16.079 25.972 -11.785 1.00 32.32 C ATOM 2557 CD2 TYR B 147 -15.470 23.704 -12.300 1.00 28.89 C ATOM 2558 CE1 TYR B 147 -16.802 25.580 -10.705 1.00 37.64 C ATOM 2559 CE2 TYR B 147 -16.241 23.271 -11.151 1.00 35.56 C ATOM 2560 CZ TYR B 147 -16.872 24.234 -10.397 1.00 36.55 C ATOM 2561 OH TYR B 147 -17.607 23.934 -9.309 1.00 42.28 O ATOM 0 H TYR B 147 -12.964 26.613 -15.202 1.00 19.81 H new ATOM 0 HA TYR B 147 -13.446 26.960 -12.687 1.00 20.20 H new ATOM 0 HB2 TYR B 147 -15.145 26.222 -14.234 1.00 22.13 H new ATOM 0 HB3 TYR B 147 -14.428 24.845 -14.379 1.00 22.13 H new ATOM 0 HD1 TYR B 147 -16.051 26.874 -12.011 1.00 32.32 H new ATOM 0 HD2 TYR B 147 -15.047 23.081 -12.847 1.00 28.89 H new ATOM 0 HE1 TYR B 147 -17.244 26.208 -10.180 1.00 37.64 H new ATOM 0 HE2 TYR B 147 -16.307 22.370 -10.930 1.00 35.56 H new ATOM 0 HH TYR B 147 -17.602 23.103 -9.188 1.00 42.28 H new ATOM 2562 N THR B 148 -12.423 25.224 -11.189 1.00 19.97 N ATOM 2563 CA THR B 148 -11.470 24.490 -10.361 1.00 21.11 C ATOM 2564 C THR B 148 -12.292 23.647 -9.363 1.00 22.01 C ATOM 2565 O THR B 148 -13.201 24.191 -8.697 1.00 21.56 O ATOM 2566 CB THR B 148 -10.641 25.501 -9.584 1.00 22.65 C ATOM 2567 OG1 THR B 148 -9.888 26.262 -10.559 1.00 21.58 O ATOM 2568 CG2 THR B 148 -9.686 24.814 -8.589 1.00 22.63 C ATOM 0 H THR B 148 -12.970 25.710 -10.737 1.00 19.97 H new ATOM 0 HA THR B 148 -10.890 23.927 -10.896 1.00 21.11 H new ATOM 0 HB THR B 148 -11.222 26.073 -9.058 1.00 22.65 H new ATOM 0 HG1 THR B 148 -10.362 26.391 -11.241 1.00 21.58 H new ATOM 0 HG21 THR B 148 -9.175 25.487 -8.113 1.00 22.63 H new ATOM 0 HG22 THR B 148 -10.201 24.291 -7.955 1.00 22.63 H new ATOM 0 HG23 THR B 148 -9.080 24.231 -9.072 1.00 22.63 H new ATOM 2569 N ALA B 149 -12.018 22.350 -9.348 1.00 22.53 N ATOM 2570 CA ALA B 149 -12.675 21.447 -8.379 1.00 24.36 C ATOM 2571 C ALA B 149 -11.702 20.550 -7.647 1.00 27.89 C ATOM 2572 O ALA B 149 -10.776 20.003 -8.235 1.00 26.58 O ATOM 2573 CB ALA B 149 -13.713 20.592 -9.116 1.00 23.88 C ATOM 0 H ALA B 149 -11.462 21.965 -9.880 1.00 22.53 H new ATOM 0 HA ALA B 149 -13.099 22.004 -7.707 1.00 24.36 H new ATOM 0 HB1 ALA B 149 -14.148 19.997 -8.486 1.00 23.88 H new ATOM 0 HB2 ALA B 149 -14.376 21.169 -9.526 1.00 23.88 H new ATOM 0 HB3 ALA B 149 -13.272 20.068 -9.803 1.00 23.88 H new ATOM 2574 N VAL B 150 -11.940 20.332 -6.354 1.00 30.82 N ATOM 2575 CA VAL B 150 -11.003 19.517 -5.556 1.00 35.13 C ATOM 2576 C VAL B 150 -11.606 18.107 -5.328 1.00 38.09 C ATOM 2577 O VAL B 150 -12.825 17.995 -5.028 1.00 38.21 O ATOM 2578 CB VAL B 150 -10.659 20.165 -4.228 1.00 35.61 C ATOM 2579 CG1 VAL B 150 -9.857 19.190 -3.335 1.00 38.09 C ATOM 2580 CG2 VAL B 150 -9.802 21.447 -4.472 1.00 38.76 C ATOM 0 H VAL B 150 -12.619 20.636 -5.923 1.00 30.82 H new ATOM 0 HA VAL B 150 -10.175 19.445 -6.056 1.00 35.13 H new ATOM 0 HB VAL B 150 -11.487 20.398 -3.781 1.00 35.61 H new ATOM 0 HG11 VAL B 150 -9.647 19.621 -2.492 1.00 38.09 H new ATOM 0 HG12 VAL B 150 -10.386 18.395 -3.167 1.00 38.09 H new ATOM 0 HG13 VAL B 150 -9.034 18.942 -3.785 1.00 38.09 H new ATOM 0 HG21 VAL B 150 -9.584 21.858 -3.621 1.00 38.76 H new ATOM 0 HG22 VAL B 150 -8.983 21.206 -4.933 1.00 38.76 H new ATOM 0 HG23 VAL B 150 -10.305 22.075 -5.014 1.00 38.76 H new ATOM 2581 N ASP B 151 -10.762 17.087 -5.584 1.00 40.26 N ATOM 2582 CA ASP B 151 -10.994 15.667 -5.220 1.00 43.19 C ATOM 2583 C ASP B 151 -11.859 14.841 -6.155 1.00 44.18 C ATOM 2584 O ASP B 151 -11.503 13.681 -6.488 1.00 43.77 O ATOM 2585 CB ASP B 151 -11.369 15.526 -3.744 1.00 43.47 C ATOM 2586 CG ASP B 151 -10.121 15.654 -2.832 1.00 46.74 C ATOM 2587 OD1 ASP B 151 -10.282 15.972 -1.643 1.00 55.14 O ATOM 2588 OD2 ASP B 151 -8.970 15.440 -3.298 1.00 43.87 O ATOM 0 H ASP B 151 -10.012 17.206 -5.988 1.00 40.26 H new ATOM 0 HA ASP B 151 -10.130 15.247 -5.356 1.00 43.19 H new ATOM 0 HB2 ASP B 151 -12.017 16.207 -3.506 1.00 43.47 H new ATOM 0 HB3 ASP B 151 -11.793 14.666 -3.596 1.00 43.47 H new ATOM 2589 N GLU B 152 -12.951 15.436 -6.645 1.00 44.14 N ATOM 2590 CA GLU B 152 -13.682 14.820 -7.769 1.00 44.78 C ATOM 2591 C GLU B 152 -14.173 15.861 -8.783 1.00 43.04 C ATOM 2592 O GLU B 152 -14.654 16.920 -8.389 1.00 43.55 O ATOM 2593 CB GLU B 152 -14.852 14.023 -7.239 1.00 44.90 C ATOM 2594 CG GLU B 152 -15.650 14.794 -6.242 1.00 50.93 C ATOM 2595 CD GLU B 152 -16.863 13.992 -5.795 1.00 59.49 C ATOM 2596 OE1 GLU B 152 -17.662 14.485 -4.949 1.00 63.04 O ATOM 2597 OE2 GLU B 152 -16.993 12.856 -6.296 1.00 61.69 O ATOM 0 H GLU B 152 -13.281 16.175 -6.354 1.00 44.14 H new ATOM 0 HA GLU B 152 -13.065 14.234 -8.234 1.00 44.78 H new ATOM 0 HB2 GLU B 152 -15.424 13.761 -7.977 1.00 44.90 H new ATOM 0 HB3 GLU B 152 -14.526 13.206 -6.829 1.00 44.90 H new ATOM 0 HG2 GLU B 152 -15.097 15.010 -5.475 1.00 50.93 H new ATOM 0 HG3 GLU B 152 -15.937 15.635 -6.630 1.00 50.93 H new ATOM 2598 N ALA B 153 -14.024 15.548 -10.062 1.00 41.30 N ATOM 2599 CA ALA B 153 -14.537 16.370 -11.138 1.00 40.31 C ATOM 2600 C ALA B 153 -16.101 16.332 -11.244 1.00 40.11 C ATOM 2601 O ALA B 153 -16.711 15.267 -11.090 1.00 40.10 O ATOM 2602 CB ALA B 153 -13.892 15.924 -12.420 1.00 41.57 C ATOM 0 H ALA B 153 -13.615 14.841 -10.330 1.00 41.30 H new ATOM 0 HA ALA B 153 -14.314 17.296 -10.953 1.00 40.31 H new ATOM 0 HB1 ALA B 153 -14.224 16.464 -13.154 1.00 41.57 H new ATOM 0 HB2 ALA B 153 -12.930 16.028 -12.352 1.00 41.57 H new ATOM 0 HB3 ALA B 153 -14.105 14.992 -12.583 1.00 41.57 H new ATOM 2603 N PRO B 154 -16.774 17.499 -11.442 1.00 38.42 N ATOM 2604 CA PRO B 154 -18.259 17.410 -11.464 1.00 35.53 C ATOM 2605 C PRO B 154 -18.656 16.720 -12.766 1.00 33.47 C ATOM 2606 O PRO B 154 -17.843 16.589 -13.635 1.00 31.31 O ATOM 2607 CB PRO B 154 -18.688 18.891 -11.488 1.00 35.88 C ATOM 2608 CG PRO B 154 -17.521 19.615 -12.220 1.00 35.76 C ATOM 2609 CD PRO B 154 -16.315 18.908 -11.542 1.00 38.38 C ATOM 0 HA PRO B 154 -18.656 16.920 -10.727 1.00 35.53 H new ATOM 0 HB2 PRO B 154 -19.528 19.009 -11.958 1.00 35.88 H new ATOM 0 HB3 PRO B 154 -18.813 19.238 -10.591 1.00 35.88 H new ATOM 0 HG2 PRO B 154 -17.541 19.478 -13.180 1.00 35.76 H new ATOM 0 HG3 PRO B 154 -17.524 20.573 -12.070 1.00 35.76 H new ATOM 0 HD2 PRO B 154 -15.507 18.987 -12.073 1.00 38.38 H new ATOM 0 HD3 PRO B 154 -16.120 19.286 -10.670 1.00 38.38 H new ATOM 2610 N GLU B 155 -19.913 16.291 -12.927 1.00 31.67 N ATOM 2611 CA GLU B 155 -20.320 15.576 -14.141 1.00 31.80 C ATOM 2612 C GLU B 155 -20.131 16.417 -15.452 1.00 30.14 C ATOM 2613 O GLU B 155 -19.777 15.904 -16.521 1.00 30.37 O ATOM 2614 CB GLU B 155 -21.781 15.091 -14.015 1.00 32.26 C ATOM 2615 CG GLU B 155 -22.050 13.923 -14.949 1.00 41.45 C ATOM 2616 CD GLU B 155 -21.211 12.730 -14.545 1.00 51.07 C ATOM 2617 OE1 GLU B 155 -20.642 12.096 -15.469 1.00 56.15 O ATOM 2618 OE2 GLU B 155 -21.080 12.464 -13.304 1.00 52.00 O ATOM 0 H GLU B 155 -20.540 16.403 -12.349 1.00 31.67 H new ATOM 0 HA GLU B 155 -19.729 14.811 -14.221 1.00 31.80 H new ATOM 0 HB2 GLU B 155 -21.959 14.825 -13.099 1.00 32.26 H new ATOM 0 HB3 GLU B 155 -22.386 15.820 -14.221 1.00 32.26 H new ATOM 0 HG2 GLU B 155 -22.991 13.689 -14.923 1.00 41.45 H new ATOM 0 HG3 GLU B 155 -21.846 14.177 -15.863 1.00 41.45 H new ATOM 2619 N TYR B 156 -20.341 17.718 -15.302 1.00 28.05 N ATOM 2620 CA TYR B 156 -20.025 18.659 -16.402 1.00 25.31 C ATOM 2621 C TYR B 156 -19.615 19.964 -15.741 1.00 24.02 C ATOM 2622 O TYR B 156 -19.966 20.217 -14.580 1.00 23.00 O ATOM 2623 CB TYR B 156 -21.235 18.881 -17.300 1.00 26.27 C ATOM 2624 CG TYR B 156 -22.479 19.506 -16.624 1.00 29.23 C ATOM 2625 CD1 TYR B 156 -22.608 20.887 -16.549 1.00 28.06 C ATOM 2626 CD2 TYR B 156 -23.558 18.709 -16.087 1.00 32.76 C ATOM 2627 CE1 TYR B 156 -23.769 21.527 -15.922 1.00 32.87 C ATOM 2628 CE2 TYR B 156 -24.729 19.365 -15.455 1.00 33.33 C ATOM 2629 CZ TYR B 156 -24.805 20.748 -15.407 1.00 32.76 C ATOM 2630 OH TYR B 156 -25.886 21.498 -14.845 1.00 37.64 O ATOM 0 H TYR B 156 -20.659 18.083 -14.591 1.00 28.05 H new ATOM 0 HA TYR B 156 -19.319 18.305 -16.965 1.00 25.31 H new ATOM 0 HB2 TYR B 156 -20.968 19.453 -18.036 1.00 26.27 H new ATOM 0 HB3 TYR B 156 -21.492 18.028 -17.683 1.00 26.27 H new ATOM 0 HD1 TYR B 156 -21.937 21.422 -16.908 1.00 28.06 H new ATOM 0 HD2 TYR B 156 -23.518 17.781 -16.138 1.00 32.76 H new ATOM 0 HE1 TYR B 156 -23.815 22.454 -15.868 1.00 32.87 H new ATOM 0 HE2 TYR B 156 -25.412 18.849 -15.091 1.00 33.33 H new ATOM 0 HH TYR B 156 -26.473 20.971 -14.556 1.00 37.64 H new ATOM 2631 N CYS B 157 -18.835 20.785 -16.456 1.00 21.79 N ATOM 2632 CA CYS B 157 -18.423 22.083 -15.899 1.00 20.38 C ATOM 2633 C CYS B 157 -19.631 23.017 -15.707 1.00 19.89 C ATOM 2634 O CYS B 157 -20.341 23.302 -16.648 1.00 21.73 O ATOM 2635 CB CYS B 157 -17.367 22.751 -16.870 1.00 20.29 C ATOM 2636 SG CYS B 157 -16.891 24.354 -16.148 1.00 21.30 S ATOM 0 H CYS B 157 -18.540 20.616 -17.246 1.00 21.79 H new ATOM 0 HA CYS B 157 -18.023 21.935 -15.027 1.00 20.38 H new ATOM 0 HB2 CYS B 157 -16.590 22.180 -16.973 1.00 20.29 H new ATOM 0 HB3 CYS B 157 -17.747 22.875 -17.754 1.00 20.29 H new ATOM 2637 N PRO B 158 -19.920 23.471 -14.498 1.00 21.51 N ATOM 2638 CA PRO B 158 -21.139 24.365 -14.382 1.00 22.07 C ATOM 2639 C PRO B 158 -21.048 25.733 -15.032 1.00 22.76 C ATOM 2640 O PRO B 158 -22.089 26.436 -15.243 1.00 21.24 O ATOM 2641 CB PRO B 158 -21.346 24.485 -12.851 1.00 24.38 C ATOM 2642 CG PRO B 158 -19.903 24.350 -12.336 1.00 24.38 C ATOM 2643 CD PRO B 158 -19.310 23.220 -13.179 1.00 21.68 C ATOM 0 HA PRO B 158 -21.878 23.971 -14.871 1.00 22.07 H new ATOM 0 HB2 PRO B 158 -21.745 25.333 -12.602 1.00 24.38 H new ATOM 0 HB3 PRO B 158 -21.924 23.787 -12.505 1.00 24.38 H new ATOM 0 HG2 PRO B 158 -19.407 25.176 -12.450 1.00 24.38 H new ATOM 0 HG3 PRO B 158 -19.883 24.135 -11.390 1.00 24.38 H new ATOM 0 HD2 PRO B 158 -18.341 23.262 -13.213 1.00 21.68 H new ATOM 0 HD3 PRO B 158 -19.544 22.345 -12.831 1.00 21.68 H new ATOM 2644 N VAL B 159 -19.807 26.159 -15.322 1.00 19.46 N ATOM 2645 CA VAL B 159 -19.664 27.446 -15.932 1.00 18.68 C ATOM 2646 C VAL B 159 -19.727 27.413 -17.429 1.00 19.53 C ATOM 2647 O VAL B 159 -20.331 28.293 -18.046 1.00 18.86 O ATOM 2648 CB VAL B 159 -18.305 28.048 -15.488 1.00 18.76 C ATOM 2649 CG1 VAL B 159 -17.963 29.381 -16.205 1.00 18.85 C ATOM 2650 CG2 VAL B 159 -18.347 28.165 -13.907 1.00 18.98 C ATOM 0 H VAL B 159 -19.079 25.726 -15.174 1.00 19.46 H new ATOM 0 HA VAL B 159 -20.412 27.989 -15.640 1.00 18.68 H new ATOM 0 HB VAL B 159 -17.576 27.466 -15.754 1.00 18.76 H new ATOM 0 HG11 VAL B 159 -17.106 29.708 -15.889 1.00 18.85 H new ATOM 0 HG12 VAL B 159 -17.918 29.231 -17.162 1.00 18.85 H new ATOM 0 HG13 VAL B 159 -18.651 30.038 -16.013 1.00 18.85 H new ATOM 0 HG21 VAL B 159 -17.511 28.539 -13.588 1.00 18.98 H new ATOM 0 HG22 VAL B 159 -19.081 28.743 -13.644 1.00 18.98 H new ATOM 0 HG23 VAL B 159 -18.475 27.285 -13.520 1.00 18.98 H new ATOM 2651 N CYS B 160 -19.103 26.448 -18.071 1.00 20.57 N ATOM 2652 CA CYS B 160 -19.099 26.495 -19.535 1.00 20.53 C ATOM 2653 C CYS B 160 -19.789 25.281 -20.181 1.00 20.05 C ATOM 2654 O CYS B 160 -19.887 25.223 -21.388 1.00 21.48 O ATOM 2655 CB CYS B 160 -17.678 26.489 -20.082 1.00 20.77 C ATOM 2656 SG CYS B 160 -16.614 25.017 -19.885 1.00 19.95 S ATOM 0 H CYS B 160 -18.692 25.784 -17.710 1.00 20.57 H new ATOM 0 HA CYS B 160 -19.576 27.311 -19.753 1.00 20.53 H new ATOM 0 HB2 CYS B 160 -17.736 26.675 -21.032 1.00 20.77 H new ATOM 0 HB3 CYS B 160 -17.212 27.236 -19.675 1.00 20.77 H new ATOM 2657 N GLY B 161 -20.057 24.290 -19.365 1.00 20.89 N ATOM 2658 CA GLY B 161 -20.783 23.072 -19.813 1.00 19.64 C ATOM 2659 C GLY B 161 -19.880 21.896 -20.289 1.00 22.47 C ATOM 2660 O GLY B 161 -20.384 20.803 -20.674 1.00 21.62 O ATOM 0 H GLY B 161 -19.834 24.282 -18.534 1.00 20.89 H new ATOM 0 HA2 GLY B 161 -21.339 22.758 -19.083 1.00 19.64 H new ATOM 0 HA3 GLY B 161 -21.379 23.317 -20.538 1.00 19.64 H new ATOM 2661 N ALA B 162 -18.550 22.054 -20.198 1.00 20.59 N ATOM 2662 CA ALA B 162 -17.647 20.980 -20.636 1.00 20.38 C ATOM 2663 C ALA B 162 -17.831 19.666 -19.862 1.00 20.43 C ATOM 2664 O ALA B 162 -17.958 19.646 -18.592 1.00 21.02 O ATOM 2665 CB ALA B 162 -16.162 21.513 -20.465 1.00 18.61 C ATOM 0 H ALA B 162 -18.160 22.757 -19.893 1.00 20.59 H new ATOM 0 HA ALA B 162 -17.852 20.766 -21.560 1.00 20.38 H new ATOM 0 HB1 ALA B 162 -15.537 20.826 -20.746 1.00 18.61 H new ATOM 0 HB2 ALA B 162 -16.038 22.306 -21.010 1.00 18.61 H new ATOM 0 HB3 ALA B 162 -16.002 21.733 -19.534 1.00 18.61 H new ATOM 2666 N PRO B 163 -17.676 18.514 -20.562 1.00 24.36 N ATOM 2667 CA PRO B 163 -17.775 17.210 -19.872 1.00 25.19 C ATOM 2668 C PRO B 163 -16.642 16.919 -18.941 1.00 27.81 C ATOM 2669 O PRO B 163 -15.509 17.421 -19.151 1.00 27.78 O ATOM 2670 CB PRO B 163 -17.772 16.181 -21.036 1.00 26.80 C ATOM 2671 CG PRO B 163 -17.104 16.860 -22.122 1.00 26.88 C ATOM 2672 CD PRO B 163 -17.492 18.366 -22.000 1.00 22.64 C ATOM 0 HA PRO B 163 -18.563 17.186 -19.307 1.00 25.19 H new ATOM 0 HB2 PRO B 163 -17.304 15.369 -20.787 1.00 26.80 H new ATOM 0 HB3 PRO B 163 -18.674 15.925 -21.282 1.00 26.80 H new ATOM 0 HG2 PRO B 163 -16.143 16.744 -22.063 1.00 26.88 H new ATOM 0 HG3 PRO B 163 -17.381 16.499 -22.979 1.00 26.88 H new ATOM 0 HD2 PRO B 163 -16.795 18.949 -22.339 1.00 22.64 H new ATOM 0 HD3 PRO B 163 -18.301 18.574 -22.493 1.00 22.64 H new ATOM 2673 N LYS B 164 -16.943 16.131 -17.896 1.00 27.89 N ATOM 2674 CA LYS B 164 -16.037 15.703 -16.903 1.00 30.86 C ATOM 2675 C LYS B 164 -14.723 15.223 -17.550 1.00 30.05 C ATOM 2676 O LYS B 164 -13.671 15.536 -17.018 1.00 30.27 O ATOM 2677 CB LYS B 164 -16.703 14.557 -16.115 1.00 33.67 C ATOM 2678 CG LYS B 164 -15.833 14.019 -14.982 1.00 41.66 C ATOM 2679 CD LYS B 164 -16.312 12.614 -14.527 1.00 51.27 C ATOM 2680 CE LYS B 164 -17.519 12.757 -13.679 1.00 56.23 C ATOM 2681 NZ LYS B 164 -17.318 11.996 -12.405 1.00 59.54 N ATOM 0 H LYS B 164 -17.738 15.830 -17.768 1.00 27.89 H new ATOM 0 HA LYS B 164 -15.821 16.436 -16.305 1.00 30.86 H new ATOM 0 HB2 LYS B 164 -17.544 14.871 -15.748 1.00 33.67 H new ATOM 0 HB3 LYS B 164 -16.913 13.833 -16.725 1.00 33.67 H new ATOM 0 HG2 LYS B 164 -14.910 13.970 -15.275 1.00 41.66 H new ATOM 0 HG3 LYS B 164 -15.860 14.632 -14.231 1.00 41.66 H new ATOM 0 HD2 LYS B 164 -16.511 12.063 -15.300 1.00 51.27 H new ATOM 0 HD3 LYS B 164 -15.608 12.166 -14.033 1.00 51.27 H new ATOM 0 HE2 LYS B 164 -17.683 13.693 -13.487 1.00 56.23 H new ATOM 0 HE3 LYS B 164 -18.299 12.423 -14.149 1.00 56.23 H new ATOM 0 HZ1 LYS B 164 -18.041 12.079 -11.892 1.00 59.54 H new ATOM 0 HZ2 LYS B 164 -17.184 11.136 -12.591 1.00 59.54 H new ATOM 0 HZ3 LYS B 164 -16.610 12.320 -11.974 1.00 59.54 H new ATOM 2682 N GLU B 165 -14.805 14.556 -18.707 1.00 30.05 N ATOM 2683 CA GLU B 165 -13.665 13.882 -19.416 1.00 32.28 C ATOM 2684 C GLU B 165 -12.624 14.914 -19.891 1.00 33.39 C ATOM 2685 O GLU B 165 -11.438 14.586 -20.183 1.00 32.29 O ATOM 2686 CB GLU B 165 -14.197 13.126 -20.684 1.00 33.29 C ATOM 2687 CG GLU B 165 -15.054 11.840 -20.416 1.00 39.81 C ATOM 2688 CD GLU B 165 -16.329 12.072 -19.510 1.00 47.28 C ATOM 2689 OE1 GLU B 165 -17.119 13.051 -19.789 1.00 38.67 O ATOM 2690 OE2 GLU B 165 -16.545 11.246 -18.551 1.00 47.29 O ATOM 0 H GLU B 165 -15.549 14.472 -19.129 1.00 30.05 H new ATOM 0 HA GLU B 165 -13.255 13.264 -18.791 1.00 32.28 H new ATOM 0 HB2 GLU B 165 -14.731 13.745 -21.206 1.00 33.29 H new ATOM 0 HB3 GLU B 165 -13.436 12.877 -21.232 1.00 33.29 H new ATOM 0 HG2 GLU B 165 -15.340 11.473 -21.267 1.00 39.81 H new ATOM 0 HG3 GLU B 165 -14.490 11.173 -19.995 1.00 39.81 H new ATOM 2691 N LYS B 166 -13.053 16.170 -20.007 1.00 30.20 N ATOM 2692 CA LYS B 166 -12.145 17.255 -20.481 1.00 30.32 C ATOM 2693 C LYS B 166 -11.303 17.856 -19.395 1.00 27.43 C ATOM 2694 O LYS B 166 -10.289 18.535 -19.725 1.00 27.06 O ATOM 2695 CB LYS B 166 -12.947 18.426 -21.130 1.00 29.73 C ATOM 2696 CG LYS B 166 -13.650 18.106 -22.410 1.00 38.05 C ATOM 2697 CD LYS B 166 -12.723 17.586 -23.523 1.00 48.08 C ATOM 2698 CE LYS B 166 -13.476 17.532 -24.867 1.00 53.07 C ATOM 2699 NZ LYS B 166 -13.215 16.244 -25.596 1.00 55.86 N ATOM 0 H LYS B 166 -13.853 16.427 -19.823 1.00 30.20 H new ATOM 0 HA LYS B 166 -11.567 16.818 -21.126 1.00 30.32 H new ATOM 0 HB2 LYS B 166 -13.605 18.738 -20.489 1.00 29.73 H new ATOM 0 HB3 LYS B 166 -12.337 19.162 -21.292 1.00 29.73 H new ATOM 0 HG2 LYS B 166 -14.334 17.441 -22.235 1.00 38.05 H new ATOM 0 HG3 LYS B 166 -14.104 18.903 -22.726 1.00 38.05 H new ATOM 0 HD2 LYS B 166 -11.948 18.164 -23.603 1.00 48.08 H new ATOM 0 HD3 LYS B 166 -12.396 16.702 -23.293 1.00 48.08 H new ATOM 0 HE2 LYS B 166 -14.428 17.628 -24.709 1.00 53.07 H new ATOM 0 HE3 LYS B 166 -13.203 18.280 -25.422 1.00 53.07 H new ATOM 0 HZ1 LYS B 166 -13.662 16.242 -26.366 1.00 55.86 H new ATOM 0 HZ2 LYS B 166 -12.344 16.166 -25.759 1.00 55.86 H new ATOM 0 HZ3 LYS B 166 -13.485 15.559 -25.095 1.00 55.86 H new ATOM 2700 N PHE B 167 -11.666 17.652 -18.128 1.00 26.32 N ATOM 2701 CA PHE B 167 -10.905 18.251 -17.039 1.00 26.48 C ATOM 2702 C PHE B 167 -9.459 17.764 -16.983 1.00 28.49 C ATOM 2703 O PHE B 167 -9.174 16.576 -17.237 1.00 27.52 O ATOM 2704 CB PHE B 167 -11.560 18.037 -15.666 1.00 27.34 C ATOM 2705 CG PHE B 167 -12.744 18.969 -15.399 1.00 24.96 C ATOM 2706 CD1 PHE B 167 -12.585 20.068 -14.504 1.00 27.27 C ATOM 2707 CD2 PHE B 167 -13.992 18.751 -15.963 1.00 34.09 C ATOM 2708 CE1 PHE B 167 -13.680 20.963 -14.237 1.00 27.63 C ATOM 2709 CE2 PHE B 167 -15.117 19.651 -15.708 1.00 28.55 C ATOM 2710 CZ PHE B 167 -14.972 20.692 -14.824 1.00 27.64 C ATOM 0 H PHE B 167 -12.340 17.177 -17.883 1.00 26.32 H new ATOM 0 HA PHE B 167 -10.903 19.200 -17.239 1.00 26.48 H new ATOM 0 HB2 PHE B 167 -11.861 17.117 -15.600 1.00 27.34 H new ATOM 0 HB3 PHE B 167 -10.893 18.168 -14.974 1.00 27.34 H new ATOM 0 HD1 PHE B 167 -11.765 20.208 -14.088 1.00 27.27 H new ATOM 0 HD2 PHE B 167 -14.117 18.015 -16.517 1.00 34.09 H new ATOM 0 HE1 PHE B 167 -13.557 21.707 -13.693 1.00 27.63 H new ATOM 0 HE2 PHE B 167 -15.928 19.519 -16.143 1.00 28.55 H new ATOM 0 HZ PHE B 167 -15.704 21.221 -14.604 1.00 27.64 H new ATOM 2711 N VAL B 168 -8.556 18.681 -16.627 1.00 26.32 N ATOM 2712 CA VAL B 168 -7.116 18.375 -16.522 1.00 27.13 C ATOM 2713 C VAL B 168 -6.856 18.027 -15.076 1.00 27.77 C ATOM 2714 O VAL B 168 -7.265 18.794 -14.205 1.00 28.68 O ATOM 2715 CB VAL B 168 -6.302 19.638 -16.928 1.00 26.97 C ATOM 2716 CG1 VAL B 168 -4.800 19.440 -16.757 1.00 30.55 C ATOM 2717 CG2 VAL B 168 -6.688 20.050 -18.383 1.00 27.47 C ATOM 0 H VAL B 168 -8.755 19.496 -16.439 1.00 26.32 H new ATOM 0 HA VAL B 168 -6.856 17.643 -17.103 1.00 27.13 H new ATOM 0 HB VAL B 168 -6.532 20.365 -16.328 1.00 26.97 H new ATOM 0 HG11 VAL B 168 -4.335 20.249 -17.021 1.00 30.55 H new ATOM 0 HG12 VAL B 168 -4.603 19.243 -15.828 1.00 30.55 H new ATOM 0 HG13 VAL B 168 -4.505 18.702 -17.313 1.00 30.55 H new ATOM 0 HG21 VAL B 168 -6.183 20.837 -18.641 1.00 27.47 H new ATOM 0 HG22 VAL B 168 -6.484 19.322 -18.991 1.00 27.47 H new ATOM 0 HG23 VAL B 168 -7.637 20.247 -18.423 1.00 27.47 H new ATOM 2718 N VAL B 169 -6.159 16.888 -14.785 1.00 27.92 N ATOM 2719 CA VAL B 169 -5.929 16.460 -13.380 1.00 29.04 C ATOM 2720 C VAL B 169 -4.545 16.741 -12.808 1.00 29.49 C ATOM 2721 O VAL B 169 -3.563 16.484 -13.432 1.00 29.79 O ATOM 2722 CB VAL B 169 -6.209 14.948 -13.205 1.00 31.10 C ATOM 2723 CG1 VAL B 169 -6.305 14.561 -11.708 1.00 31.13 C ATOM 2724 CG2 VAL B 169 -7.510 14.695 -13.929 1.00 34.59 C ATOM 0 H VAL B 169 -5.821 16.365 -15.378 1.00 27.92 H new ATOM 0 HA VAL B 169 -6.554 17.010 -12.882 1.00 29.04 H new ATOM 0 HB VAL B 169 -5.490 14.406 -13.567 1.00 31.10 H new ATOM 0 HG11 VAL B 169 -6.481 13.610 -11.630 1.00 31.13 H new ATOM 0 HG12 VAL B 169 -5.469 14.772 -11.265 1.00 31.13 H new ATOM 0 HG13 VAL B 169 -7.026 15.058 -11.291 1.00 31.13 H new ATOM 0 HG21 VAL B 169 -7.744 13.756 -13.856 1.00 34.59 H new ATOM 0 HG22 VAL B 169 -8.212 15.234 -13.532 1.00 34.59 H new ATOM 0 HG23 VAL B 169 -7.411 14.932 -14.864 1.00 34.59 H new ATOM 2725 N PHE B 170 -4.488 17.250 -11.602 1.00 30.82 N ATOM 2726 CA PHE B 170 -3.224 17.532 -10.929 1.00 32.66 C ATOM 2727 C PHE B 170 -3.234 16.603 -9.751 1.00 34.91 C ATOM 2728 O PHE B 170 -4.000 16.784 -8.843 1.00 33.84 O ATOM 2729 CB PHE B 170 -3.159 18.988 -10.466 1.00 31.67 C ATOM 2730 CG PHE B 170 -2.968 19.946 -11.621 1.00 29.75 C ATOM 2731 CD1 PHE B 170 -4.044 20.248 -12.471 1.00 26.31 C ATOM 2732 CD2 PHE B 170 -1.715 20.473 -11.895 1.00 31.38 C ATOM 2733 CE1 PHE B 170 -3.868 21.087 -13.542 1.00 28.28 C ATOM 2734 CE2 PHE B 170 -1.527 21.301 -13.008 1.00 30.43 C ATOM 2735 CZ PHE B 170 -2.601 21.596 -13.841 1.00 24.68 C ATOM 0 H PHE B 170 -5.184 17.448 -11.137 1.00 30.82 H new ATOM 0 HA PHE B 170 -2.457 17.403 -11.508 1.00 32.66 H new ATOM 0 HB2 PHE B 170 -3.976 19.212 -9.993 1.00 31.67 H new ATOM 0 HB3 PHE B 170 -2.429 19.093 -9.836 1.00 31.67 H new ATOM 0 HD1 PHE B 170 -4.881 19.877 -12.307 1.00 26.31 H new ATOM 0 HD2 PHE B 170 -0.997 20.276 -11.338 1.00 31.38 H new ATOM 0 HE1 PHE B 170 -4.596 21.319 -14.072 1.00 28.28 H new ATOM 0 HE2 PHE B 170 -0.686 21.653 -13.190 1.00 30.43 H new ATOM 0 HZ PHE B 170 -2.477 22.129 -14.593 1.00 24.68 H new ATOM 2736 N GLU B 171 -2.419 15.564 -9.803 1.00 39.94 N ATOM 2737 CA GLU B 171 -2.349 14.689 -8.635 1.00 45.65 C ATOM 2738 C GLU B 171 -0.945 14.658 -8.105 1.00 47.75 C ATOM 2739 O GLU B 171 -0.758 14.394 -6.907 1.00 50.61 O ATOM 2740 CB GLU B 171 -2.896 13.284 -8.908 1.00 46.90 C ATOM 2741 CG GLU B 171 -2.421 12.571 -10.164 1.00 52.37 C ATOM 2742 CD GLU B 171 -3.552 11.728 -10.785 1.00 59.95 C ATOM 2743 OE1 GLU B 171 -3.602 11.636 -12.034 1.00 62.26 O ATOM 2744 OE2 GLU B 171 -4.415 11.189 -10.028 1.00 61.60 O ATOM 2745 OXT GLU B 171 0.001 14.982 -8.843 1.00 48.69 O ATOM 0 H GLU B 171 -1.918 15.350 -10.468 1.00 39.94 H new ATOM 0 HA GLU B 171 -2.929 15.060 -7.952 1.00 45.65 H new ATOM 0 HB2 GLU B 171 -2.676 12.725 -8.146 1.00 46.90 H new ATOM 0 HB3 GLU B 171 -3.863 13.343 -8.946 1.00 46.90 H new ATOM 0 HG2 GLU B 171 -2.107 13.223 -10.810 1.00 52.37 H new ATOM 0 HG3 GLU B 171 -1.668 11.999 -9.949 1.00 52.37 H new TER 2746 GLU B 171 HETATM 2747 O1 PEO A 172 11.822 38.063 -20.865 1.00 29.66 O HETATM 2748 O2 PEO A 172 11.943 37.764 -22.413 1.00 31.35 O HETATM 2749 FE FE2 A 1 23.136 31.036 -14.780 1.00 19.77 FE HETATM 2750 FE FE2 A 173 13.209 36.229 -23.036 1.00 17.43 FE HETATM 2751 FE FE2 A 174 -7.776 34.002 -13.099 0.75 11.95 FE HETATM 2752 O1 PEO B 1 -6.936 34.832 -10.122 1.00 32.79 O HETATM 2753 O2 PEO B 1 -7.038 35.203 -11.673 1.00 29.23 O HETATM 2754 FE FE2 B 172 -15.478 25.043 -17.883 1.00 19.79 FE HETATM 2755 FE FE2 B 173 -7.652 32.927 -9.494 1.00 18.71 FE HETATM 2756 FE FE2 B 174 13.035 37.299 -19.416 0.75 11.78 FE HETATM 2757 O HOH A 175 -6.397 35.264 -31.449 1.00 22.93 O HETATM 2758 O HOH A 176 23.419 47.575 -20.871 1.00 41.64 O HETATM 2759 O HOH A 177 16.403 38.030 -13.454 1.00 21.26 O HETATM 2760 O HOH A 178 -5.239 30.371 -42.589 1.00 35.25 O HETATM 2761 O HOH A 179 -11.404 33.496 -25.955 1.00 25.40 O HETATM 2762 O HOH A 180 4.263 29.077 -0.636 1.00 19.31 O HETATM 2763 O HOH A 181 10.076 29.861 -5.564 1.00 24.11 O HETATM 2764 O HOH A 182 27.705 19.852 -13.464 1.00 35.16 O HETATM 2765 O HOH A 183 0.571 36.285 -32.508 1.00 32.61 O HETATM 2766 O HOH A 184 -3.549 36.560 -7.120 1.00 31.31 O HETATM 2767 O HOH A 185 22.793 48.954 -18.674 1.00 27.81 O HETATM 2768 O HOH A 186 20.020 38.903 -29.829 1.00 33.47 O HETATM 2769 O HOH A 187 15.648 18.811 -15.688 1.00 35.72 O HETATM 2770 O HOH A 188 0.092 40.699 -25.288 1.00 37.91 O HETATM 2771 O HOH A 189 11.773 44.740 -32.974 1.00 49.84 O HETATM 2772 O HOH A 190 0.739 24.602 -13.587 1.00 24.54 O HETATM 2773 O HOH A 191 -2.386 39.558 -10.453 1.00 28.60 O HETATM 2774 O HOH A 192 17.664 58.692 -8.166 1.00 29.93 O HETATM 2775 O HOH A 193 17.552 39.519 -4.493 1.00 39.22 O HETATM 2776 O HOH A 194 8.665 22.249 -6.229 1.00 53.49 O HETATM 2777 O HOH A 195 -10.446 54.992 -29.091 1.00 34.20 O HETATM 2778 O HOH A 196 10.970 45.384 -30.714 1.00 27.07 O HETATM 2779 O HOH A 197 25.528 50.758 -8.125 1.00 45.63 O HETATM 2780 O HOH A 198 20.784 52.030 -3.103 1.00 37.88 O HETATM 2781 O HOH A 199 21.663 45.350 -25.314 1.00 25.23 O HETATM 2782 O HOH A 200 27.230 52.059 -19.121 1.00 50.14 O HETATM 2783 O HOH A 201 22.933 29.768 -26.018 1.00 24.72 O HETATM 2784 O HOH A 202 -4.805 24.092 -22.066 1.00 48.15 O HETATM 2785 O HOH A 203 8.547 40.730 -24.015 1.00 36.55 O HETATM 2786 O HOH A 204 11.958 17.504 -20.214 1.00 54.67 O HETATM 2787 O HOH A 205 3.380 38.775 -35.287 1.00 32.62 O HETATM 2788 O HOH A 206 24.977 43.602 -8.681 1.00 27.65 O HETATM 2789 O HOH A 207 27.876 37.882 -15.424 1.00 30.65 O HETATM 2790 O HOH A 208 -10.165 30.838 -25.745 1.00 35.40 O HETATM 2791 O HOH A 209 14.626 28.645 -10.655 1.00 37.14 O HETATM 2792 O HOH A 210 6.401 23.432 -8.115 1.00 42.35 O HETATM 2793 O HOH A 211 21.328 34.950 -18.328 1.00 19.77 O HETATM 2794 O HOH A 212 26.163 36.347 -10.548 1.00 45.65 O HETATM 2795 O HOH A 213 5.954 28.105 6.185 1.00 46.86 O HETATM 2796 O HOH A 214 31.521 21.411 -10.937 1.00 43.66 O HETATM 2797 O HOH A 215 8.940 43.427 -21.006 1.00 39.08 O HETATM 2798 O HOH A 216 -8.500 49.346 -14.950 1.00 42.33 O HETATM 2799 O HOH A 217 27.768 45.039 -11.964 1.00 46.16 O HETATM 2800 O HOH A 218 6.476 25.742 -9.488 1.00 33.45 O HETATM 2801 O HOH A 219 22.281 34.478 -20.710 1.00 34.48 O HETATM 2802 O HOH A 220 -13.378 32.148 -24.510 1.00 31.03 O HETATM 2803 O HOH A 221 22.131 27.500 -27.719 1.00 39.09 O HETATM 2804 O HOH A 222 30.371 22.024 -23.016 1.00 30.39 O HETATM 2805 O HOH A 223 -15.748 42.898 -31.200 1.00 47.81 O HETATM 2806 O HOH A 225 7.177 19.011 0.051 1.00 38.70 O HETATM 2807 O HOH A 226 3.397 18.612 -4.669 1.00 31.78 O HETATM 2808 O HOH A 227 25.073 44.787 -14.955 1.00 24.14 O HETATM 2809 O HOH A 228 19.635 46.307 -3.865 1.00 35.71 O HETATM 2810 O HOH A 229 25.422 43.274 -21.779 1.00 44.22 O HETATM 2811 O HOH A 230 23.973 36.447 -24.105 1.00 35.66 O HETATM 2812 O HOH A 231 19.082 34.278 -8.934 1.00 42.87 O HETATM 2813 O HOH A 232 -6.552 38.176 -34.999 1.00 45.31 O HETATM 2814 O HOH A 233 -6.007 41.911 -32.998 1.00 50.12 O HETATM 2815 O HOH A 234 0.112 23.165 -15.608 1.00 51.08 O HETATM 2816 O HOH A 235 5.108 37.404 -39.221 1.00 45.76 O HETATM 2817 O HOH A 236 11.471 38.794 -38.409 1.00 39.98 O HETATM 2818 O HOH A 237 8.415 40.923 -39.456 1.00 48.24 O HETATM 2819 O HOH A 238 14.599 48.315 -30.496 1.00 39.43 O HETATM 2820 O HOH A 239 12.240 47.522 -29.471 1.00 36.39 O HETATM 2821 O HOH A 240 26.469 43.317 -13.411 1.00 32.93 O HETATM 2822 O HOH A 241 28.423 41.477 -13.794 1.00 48.88 O HETATM 2823 O HOH A 242 26.725 45.838 -8.786 1.00 44.31 O HETATM 2824 O HOH A 243 -9.048 28.352 -27.539 1.00 49.80 O HETATM 2825 O HOH B 175 2.806 34.176 -16.247 1.00 18.84 O HETATM 2826 O HOH B 176 8.954 52.092 -17.459 1.00 36.26 O HETATM 2827 O HOH B 177 11.261 37.770 -1.071 1.00 21.98 O HETATM 2828 O HOH B 178 -11.155 33.822 -19.016 1.00 21.95 O HETATM 2829 O HOH B 179 -20.901 18.033 -20.923 1.00 22.58 O HETATM 2830 O HOH B 180 -15.746 28.762 -24.492 1.00 23.12 O HETATM 2831 O HOH B 181 -14.916 29.174 -14.279 1.00 22.77 O HETATM 2832 O HOH B 182 7.693 25.840 -19.087 1.00 22.56 O HETATM 2833 O HOH B 183 -4.581 45.250 -13.181 1.00 43.22 O HETATM 2834 O HOH B 184 -5.758 41.359 -11.133 1.00 48.14 O HETATM 2835 O HOH B 185 7.276 27.343 -16.771 1.00 35.26 O HETATM 2836 O HOH B 186 2.937 28.899 -31.960 1.00 18.49 O HETATM 2837 O HOH B 187 -1.915 37.428 -5.222 1.00 46.57 O HETATM 2838 O HOH B 188 -0.337 40.260 1.277 1.00 52.52 O HETATM 2839 O HOH B 189 -4.811 38.495 -8.704 1.00 37.75 O HETATM 2840 O HOH B 190 -8.318 42.391 -1.754 1.00 27.88 O HETATM 2841 O HOH B 191 -8.713 24.370 6.574 1.00 46.02 O HETATM 2842 O HOH B 192 -9.370 27.854 -23.155 1.00 31.91 O HETATM 2843 O HOH B 193 -12.838 34.738 -27.948 1.00 38.12 O HETATM 2844 O HOH B 194 -15.372 23.558 -7.097 1.00 30.29 O HETATM 2845 O HOH B 195 -2.862 28.071 -27.002 1.00 29.21 O HETATM 2846 O HOH B 196 -5.205 15.182 -17.030 1.00 36.33 O HETATM 2847 O HOH B 197 1.803 25.251 -22.966 1.00 28.73 O HETATM 2848 O HOH B 198 4.303 36.612 0.052 1.00 33.47 O HETATM 2849 O HOH B 199 1.067 38.209 2.700 1.00 37.91 O HETATM 2850 O HOH B 200 -18.605 53.140 -24.275 1.00 34.11 O HETATM 2851 O HOH B 201 5.975 41.058 -21.977 1.00 25.65 O HETATM 2852 O HOH B 202 16.735 37.997 -6.743 1.00 28.83 O HETATM 2853 O HOH B 203 6.924 19.334 -27.858 1.00 31.58 O HETATM 2854 O HOH B 204 16.302 31.848 -9.385 1.00 32.95 O HETATM 2855 O HOH B 205 8.174 38.395 -25.511 1.00 37.67 O HETATM 2856 O HOH B 206 -12.850 29.225 -23.925 1.00 34.10 O HETATM 2857 O HOH B 207 -4.545 27.100 -28.975 1.00 28.85 O HETATM 2858 O HOH B 208 5.808 23.997 -19.883 1.00 39.14 O HETATM 2859 O HOH B 209 6.405 35.619 5.274 1.00 36.92 O HETATM 2860 O HOH B 210 -20.738 42.229 -13.851 1.00 24.63 O HETATM 2861 O HOH B 211 -21.713 37.603 -17.590 1.00 27.46 O HETATM 2862 O HOH B 212 -21.113 35.093 -21.417 1.00 36.03 O HETATM 2863 O HOH B 213 -22.441 36.007 -19.497 1.00 39.51 O HETATM 2864 O HOH B 214 -21.174 36.695 -24.011 1.00 25.98 O HETATM 2865 O HOH B 215 -23.245 38.392 -23.630 1.00 34.61 O HETATM 2866 O HOH B 216 -16.649 40.630 -28.469 1.00 41.26 O HETATM 2867 O HOH B 217 -11.394 36.581 -30.867 1.00 36.74 O HETATM 2868 O HOH B 218 -19.432 40.901 -29.729 1.00 30.34 O HETATM 2869 O HOH B 219 16.640 41.239 1.102 1.00 46.72 O HETATM 2870 O HOH B 220 13.435 56.305 -2.596 1.00 45.49 O HETATM 2871 O HOH B 221 2.733 45.651 -11.510 1.00 46.61 O HETATM 2872 O HOH B 222 2.972 18.637 -32.416 1.00 40.51 O HETATM 2873 O HOH B 223 16.998 35.230 -6.277 1.00 51.16 O HETATM 2874 O HOH B 224 4.214 31.970 8.816 1.00 40.05 O HETATM 2875 O HOH B 225 -18.725 43.447 -5.684 1.00 39.00 O HETATM 2876 O HOH B 226 -18.062 30.107 -8.851 1.00 30.66 O HETATM 2877 O HOH B 227 -15.032 33.275 -2.825 1.00 31.30 O HETATM 2878 O HOH B 228 -22.182 20.884 -12.728 1.00 34.43 O HETATM 2879 O HOH B 229 -17.511 24.188 -23.076 1.00 33.57 O HETATM 2880 O HOH B 230 -6.657 25.137 -22.048 1.00 37.32 O HETATM 2881 O HOH B 231 0.133 25.308 -20.528 1.00 39.42 O HETATM 2882 O HOH B 232 10.275 40.959 2.376 1.00 42.19 O HETATM 2883 O HOH B 233 0.360 38.239 5.389 1.00 43.11 O HETATM 2884 O HOH B 234 -18.492 39.024 -7.363 1.00 33.06 O HETATM 2885 O HOH B 235 -19.027 37.301 -5.043 1.00 45.50 O HETATM 2886 O HOH B 236 -6.646 46.674 -12.504 1.00 48.32 O HETATM 2887 O HOH B 237 -8.195 31.167 6.128 1.00 40.10 O CONECT 153 2751 CONECT 154 2751 CONECT 421 2755 CONECT 422 2751 CONECT 447 2751 CONECT 637 2750 CONECT 638 2750 CONECT 917 2756 CONECT 918 2750 CONECT 942 2750 CONECT 1151 2749 CONECT 1172 2749 CONECT 1263 2749 CONECT 1283 2749 CONECT 1526 2756 CONECT 1527 2756 CONECT 1794 2756 CONECT 1795 2750 CONECT 1820 2756 CONECT 2010 2755 CONECT 2011 2755 CONECT 2290 2751 CONECT 2291 2755 CONECT 2315 2755 CONECT 2524 2754 CONECT 2545 2754 CONECT 2636 2754 CONECT 2656 2754 CONECT 2747 2748 2756 CONECT 2748 2747 2750 CONECT 2749 1151 1172 1263 1283 CONECT 2750 637 638 918 942 CONECT 2750 1795 2748 CONECT 2751 153 154 422 447 CONECT 2751 2290 2753 CONECT 2752 2753 2755 CONECT 2753 2751 2752 CONECT 2754 2524 2545 2636 2656 CONECT 2755 421 2010 2011 2291 CONECT 2755 2315 2752 CONECT 2756 917 1526 1527 1794 CONECT 2756 1820 2747 END