diff --git a/pdb2sql/5hvd.pdb b/pdb2sql/5hvd.pdb deleted file mode 100644 index 48b2ed9..0000000 --- a/pdb2sql/5hvd.pdb +++ /dev/null @@ -1,4834 +0,0 @@ -HEADER TRANSPORT PROTEIN 28-JAN-16 5HVD -TITLE FULL LENGTH OPEN-FORM SODIUM CHANNEL NAVMS I218C -COMPND MOL_ID: 1; -COMPND 2 MOLECULE: ION TRANSPORT PROTEIN; -COMPND 3 CHAIN: A; -COMPND 4 ENGINEERED: YES; -COMPND 5 MUTATION: YES; -COMPND 6 OTHER_DETAILS: I218C MUTATION -SOURCE MOL_ID: 1; -SOURCE 2 ORGANISM_SCIENTIFIC: MAGNETOCOCCUS MARINUS (STRAIN ATCC BAA-1437 / -SOURCE 3 JCM 17883 / MC-1); -SOURCE 4 ORGANISM_TAXID: 156889; -SOURCE 5 STRAIN: ATCC BAA-1437 / JCM 17883 / MC-1; -SOURCE 6 GENE: MMC1_0798; -SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI; -SOURCE 8 EXPRESSION_SYSTEM_TAXID: 562; -SOURCE 9 EXPRESSION_SYSTEM_STRAIN: CD41; -SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PET15A -KEYWDS INTEGRAL MEMBRANE VOLTAGE GATED SODIUM CHANNEL, TRANSPORT PROTEIN -EXPDTA X-RAY DIFFRACTION -AUTHOR A.SULA,J.E.BOOKER,C.E.NAYLOR,B.A.WALLACE -REVDAT 2 30-AUG-17 5HVD 1 REMARK -REVDAT 1 01-MAR-17 5HVD 0 -JRNL AUTH A.SULA,J.BOOKER,L.C.NG,C.E.NAYLOR,P.G.DECAEN,B.A.WALLACE -JRNL TITL THE COMPLETE STRUCTURE OF AN ACTIVATED OPEN SODIUM CHANNEL. -JRNL REF NAT COMMUN V. 8 14205 2017 -JRNL REFN ESSN 2041-1723 -JRNL PMID 28205548 -JRNL DOI 10.1038/NCOMMS14205 -REMARK 1 -REMARK 1 REFERENCE 1 -REMARK 1 AUTH C.BAGNERIS -REMARK 1 TITL ROLE OF THE C-TERMINAL DOMAIN IN THE STRUCTURE AND FUNCTION -REMARK 1 TITL 2 OF TETRAMERIC SODIUM CHANNELS. -REMARK 1 REF NAT COMMUN V. 4 2465 2013 -REMARK 1 REFN ESSN 2041-1723 -REMARK 1 PMID 24051986 -REMARK 1 DOI 10.1038/NCOMMS3465 -REMARK 2 -REMARK 2 RESOLUTION. 2.60 ANGSTROMS. -REMARK 3 -REMARK 3 REFINEMENT. -REMARK 3 PROGRAM : BUSTER 2.10.2 -REMARK 3 AUTHORS : BRICOGNE,BLANC,BRANDL,FLENSBURG,KELLER, -REMARK 3 : PACIOREK,ROVERSI,SHARFF,SMART,VONRHEIN, -REMARK 3 : WOMACK,MATTHEWS,TEN EYCK,TRONRUD -REMARK 3 -REMARK 3 DATA USED IN REFINEMENT. -REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.60 -REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 26.92 -REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 -REMARK 3 COMPLETENESS FOR RANGE (%) : 99.9 -REMARK 3 NUMBER OF REFLECTIONS : 20032 -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) : 0.194 -REMARK 3 R VALUE (WORKING SET) : 0.193 -REMARK 3 FREE R VALUE : 0.214 -REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.230 -REMARK 3 FREE R VALUE TEST SET COUNT : 1047 -REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL -REMARK 3 -REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. -REMARK 3 TOTAL NUMBER OF BINS USED : 10 -REMARK 3 BIN RESOLUTION RANGE HIGH (ANGSTROMS) : 2.60 -REMARK 3 BIN RESOLUTION RANGE LOW (ANGSTROMS) : 2.74 -REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 99.37 -REMARK 3 REFLECTIONS IN BIN (WORKING + TEST SET) : 2833 -REMARK 3 BIN R VALUE (WORKING + TEST SET) : 0.2124 -REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 2688 -REMARK 3 BIN R VALUE (WORKING SET) : 0.2109 -REMARK 3 BIN FREE R VALUE : 0.2421 -REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 5.12 -REMARK 3 BIN FREE R VALUE TEST SET COUNT : 145 -REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL -REMARK 3 -REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. -REMARK 3 PROTEIN ATOMS : 1976 -REMARK 3 NUCLEIC ACID ATOMS : 0 -REMARK 3 HETEROGEN ATOMS : 69 -REMARK 3 SOLVENT ATOMS : 111 -REMARK 3 -REMARK 3 B VALUES. -REMARK 3 FROM WILSON PLOT (A**2) : 68.83 -REMARK 3 MEAN B VALUE (OVERALL, A**2) : 93.41 -REMARK 3 OVERALL ANISOTROPIC B VALUE. -REMARK 3 B11 (A**2) : -10.48910 -REMARK 3 B22 (A**2) : -10.48910 -REMARK 3 B33 (A**2) : 20.97810 -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 COORDINATE ERROR. -REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.331 -REMARK 3 DPI (BLOW EQ-10) BASED ON R VALUE (A) : 0.225 -REMARK 3 DPI (BLOW EQ-9) BASED ON FREE R VALUE (A) : 0.184 -REMARK 3 DPI (CRUICKSHANK) BASED ON R VALUE (A) : 0.217 -REMARK 3 DPI (CRUICKSHANK) BASED ON FREE R VALUE (A) : 0.182 -REMARK 3 -REMARK 3 REFERENCES: BLOW, D. (2002) ACTA CRYST D58, 792-797 -REMARK 3 CRUICKSHANK, D.W.J. (1999) ACTA CRYST D55, 583-601 -REMARK 3 -REMARK 3 CORRELATION COEFFICIENTS. -REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.924 -REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.913 -REMARK 3 -REMARK 3 NUMBER OF GEOMETRIC FUNCTION TERMS DEFINED : 15 -REMARK 3 TERM COUNT WEIGHT FUNCTION. -REMARK 3 BOND LENGTHS : 2081 ; 2.000 ; HARMONIC -REMARK 3 BOND ANGLES : 2814 ; 2.000 ; HARMONIC -REMARK 3 TORSION ANGLES : 728 ; 2.000 ; SINUSOIDAL -REMARK 3 TRIGONAL CARBON PLANES : 33 ; 2.000 ; HARMONIC -REMARK 3 GENERAL PLANES : 299 ; 5.000 ; HARMONIC -REMARK 3 ISOTROPIC THERMAL FACTORS : 2081 ; 20.000 ; HARMONIC -REMARK 3 BAD NON-BONDED CONTACTS : 0 ; 5.000 ; SEMIHARMONIC -REMARK 3 IMPROPER TORSIONS : NULL ; NULL ; NULL -REMARK 3 PSEUDOROTATION ANGLES : NULL ; NULL ; NULL -REMARK 3 CHIRAL IMPROPER TORSION : 282 ; 5.000 ; SEMIHARMONIC -REMARK 3 SUM OF OCCUPANCIES : NULL ; NULL ; NULL -REMARK 3 UTILITY DISTANCES : 3 ; 1.000 ; HARMONIC -REMARK 3 UTILITY ANGLES : NULL ; NULL ; NULL -REMARK 3 UTILITY TORSION : NULL ; NULL ; NULL -REMARK 3 IDEAL-DIST CONTACT TERM : 2399 ; 4.000 ; SEMIHARMONIC -REMARK 3 -REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. -REMARK 3 BOND LENGTHS (A) : 0.010 -REMARK 3 BOND ANGLES (DEGREES) : 1.05 -REMARK 3 PEPTIDE OMEGA TORSION ANGLES (DEGREES) : 2.53 -REMARK 3 OTHER TORSION ANGLES (DEGREES) : 17.40 -REMARK 3 -REMARK 3 TLS DETAILS -REMARK 3 NUMBER OF TLS GROUPS : 3 -REMARK 3 -REMARK 3 TLS GROUP : 1 -REMARK 3 SELECTION: { A|-1 - A|108 } -REMARK 3 ORIGIN FOR THE GROUP (A): 248.8850 -26.0447 239.3670 -REMARK 3 T TENSOR -REMARK 3 T11: -0.0121 T22: -0.2249 -REMARK 3 T33: -0.3146 T12: 0.4988 -REMARK 3 T13: 0.0848 T23: -0.1475 -REMARK 3 L TENSOR -REMARK 3 L11: 4.9539 L22: 3.9600 -REMARK 3 L33: 8.0853 L12: -2.3381 -REMARK 3 L13: -0.0294 L23: 1.7600 -REMARK 3 S TENSOR -REMARK 3 S11: -0.0474 S12: -0.1388 S13: 0.8005 -REMARK 3 S21: 0.2343 S22: 0.0192 S23: 0.0673 -REMARK 3 S31: -1.3389 S32: -0.8095 S33: 0.0282 -REMARK 3 -REMARK 3 TLS GROUP : 2 -REMARK 3 SELECTION: { A|109 - A|234 } -REMARK 3 ORIGIN FOR THE GROUP (A): 278.9690 -43.2508 233.9370 -REMARK 3 T TENSOR -REMARK 3 T11: -0.4440 T22: -0.5002 -REMARK 3 T33: -0.4760 T12: -0.0667 -REMARK 3 T13: -0.0127 T23: -0.0382 -REMARK 3 L TENSOR -REMARK 3 L11: 0.8156 L22: 0.8758 -REMARK 3 L33: 3.1633 L12: -0.2526 -REMARK 3 L13: -0.0032 L23: 0.1898 -REMARK 3 S TENSOR -REMARK 3 S11: -0.0125 S12: -0.2670 S13: 0.0722 -REMARK 3 S21: 0.2262 S22: -0.0028 S23: 0.0062 -REMARK 3 S31: -0.4734 S32: 0.1550 S33: 0.0154 -REMARK 3 -REMARK 3 TLS GROUP : 3 -REMARK 3 SELECTION: { A|235 - A|261 } -REMARK 3 ORIGIN FOR THE GROUP (A): 272.5790 -46.0907 276.9460 -REMARK 3 T TENSOR -REMARK 3 T11: 0.5214 T22: 0.2944 -REMARK 3 T33: 0.1424 T12: -0.0090 -REMARK 3 T13: 0.0103 T23: 0.0149 -REMARK 3 L TENSOR -REMARK 3 L11: 3.3199 L22: 0.5872 -REMARK 3 L33: 3.0791 L12: -3.8018 -REMARK 3 L13: -1.4264 L23: -0.6033 -REMARK 3 S TENSOR -REMARK 3 S11: 0.0764 S12: -0.3376 S13: -0.1630 -REMARK 3 S21: 0.3329 S22: 0.0448 S23: -0.1504 -REMARK 3 S31: -0.1283 S32: -0.1218 S33: -0.1212 -REMARK 3 -REMARK 3 OTHER REFINEMENT REMARKS: NULL -REMARK 4 -REMARK 4 5HVD COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 -REMARK 100 -REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 29-JAN-16. -REMARK 100 THE DEPOSITION ID IS D_1000217814. -REMARK 200 -REMARK 200 EXPERIMENTAL DETAILS -REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION -REMARK 200 DATE OF DATA COLLECTION : 08-NOV-15 -REMARK 200 TEMPERATURE (KELVIN) : 100 -REMARK 200 PH : 6.5 -REMARK 200 NUMBER OF CRYSTALS USED : 1 -REMARK 200 -REMARK 200 SYNCHROTRON (Y/N) : Y -REMARK 200 RADIATION SOURCE : SOLEIL -REMARK 200 BEAMLINE : PROXIMA 2 -REMARK 200 X-RAY GENERATOR MODEL : NULL -REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M -REMARK 200 WAVELENGTH OR RANGE (A) : 0.97718 -REMARK 200 MONOCHROMATOR : SI (111) -REMARK 200 OPTICS : BI-MORPH MIRRORS -REMARK 200 -REMARK 200 DETECTOR TYPE : CCD -REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 315R -REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS OCT 15, 2015 -REMARK 200 DATA SCALING SOFTWARE : XDS OCT 15, 2015 -REMARK 200 -REMARK 200 NUMBER OF UNIQUE REFLECTIONS : NULL -REMARK 200 RESOLUTION RANGE HIGH (A) : NULL -REMARK 200 RESOLUTION RANGE LOW (A) : NULL -REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL -REMARK 200 -REMARK 200 OVERALL. -REMARK 200 COMPLETENESS FOR RANGE (%) : NULL -REMARK 200 DATA REDUNDANCY : NULL -REMARK 200 R MERGE (I) : NULL -REMARK 200 R SYM (I) : NULL -REMARK 200 FOR THE DATA SET : NULL -REMARK 200 -REMARK 200 IN THE HIGHEST RESOLUTION SHELL. -REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.60 -REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.72 -REMARK 200 COMPLETENESS FOR SHELL (%) : 99.7 -REMARK 200 DATA REDUNDANCY IN SHELL : 45.50 -REMARK 200 R MERGE FOR SHELL (I) : 3.60000 -REMARK 200 R SYM FOR SHELL (I) : NULL -REMARK 200 FOR SHELL : 1.400 -REMARK 200 -REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH -REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT -REMARK 200 SOFTWARE USED: PHASER 2.5.7 -REMARK 200 STARTING MODEL: 3RVY -REMARK 200 -REMARK 200 REMARK: BIPYRAMIDS -REMARK 280 -REMARK 280 CRYSTAL -REMARK 280 SOLVENT CONTENT, VS (%): 75.00 -REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 4.90 -REMARK 280 -REMARK 280 CRYSTALLIZATION CONDITIONS: 0.05 M NACL, 0.1 M MES BUFFER, PH 6.5, -REMARK 280 37.8% V/V POLYETHYLENE GLYCOL (PEG) 400 AND 4% ETHYLENE GLYCOL, -REMARK 280 VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 277K -REMARK 290 -REMARK 290 CRYSTALLOGRAPHIC SYMMETRY -REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: I 4 2 2 -REMARK 290 -REMARK 290 SYMOP SYMMETRY -REMARK 290 NNNMMM OPERATOR -REMARK 290 1555 X,Y,Z -REMARK 290 2555 -X,-Y,Z -REMARK 290 3555 -Y,X,Z -REMARK 290 4555 Y,-X,Z -REMARK 290 5555 -X,Y,-Z -REMARK 290 6555 X,-Y,-Z -REMARK 290 7555 Y,X,-Z -REMARK 290 8555 -Y,-X,-Z -REMARK 290 9555 X+1/2,Y+1/2,Z+1/2 -REMARK 290 10555 -X+1/2,-Y+1/2,Z+1/2 -REMARK 290 11555 -Y+1/2,X+1/2,Z+1/2 -REMARK 290 12555 Y+1/2,-X+1/2,Z+1/2 -REMARK 290 13555 -X+1/2,Y+1/2,-Z+1/2 -REMARK 290 14555 X+1/2,-Y+1/2,-Z+1/2 -REMARK 290 15555 Y+1/2,X+1/2,-Z+1/2 -REMARK 290 16555 -Y+1/2,-X+1/2,-Z+1/2 -REMARK 290 -REMARK 290 WHERE NNN -> OPERATOR NUMBER -REMARK 290 MMM -> TRANSLATION VECTOR -REMARK 290 -REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS -REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM -REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY -REMARK 290 RELATED MOLECULES. -REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 -REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 -REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 -REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 -REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 -REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 0.00000 -REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 0.00000 -REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 0.00000 -REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 0.00000 -REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 0.00000 -REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 0.00000 -REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 0.00000 -REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 0.00000 -REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 0.00000 -REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 0.00000 -REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 0.00000 -REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 0.00000 -REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 0.00000 -REMARK 290 SMTRY1 7 0.000000 1.000000 0.000000 0.00000 -REMARK 290 SMTRY2 7 1.000000 0.000000 0.000000 0.00000 -REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 0.00000 -REMARK 290 SMTRY1 8 0.000000 -1.000000 0.000000 0.00000 -REMARK 290 SMTRY2 8 -1.000000 0.000000 0.000000 0.00000 -REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 -REMARK 290 SMTRY1 9 1.000000 0.000000 0.000000 54.79000 -REMARK 290 SMTRY2 9 0.000000 1.000000 0.000000 54.79000 -REMARK 290 SMTRY3 9 0.000000 0.000000 1.000000 104.85500 -REMARK 290 SMTRY1 10 -1.000000 0.000000 0.000000 54.79000 -REMARK 290 SMTRY2 10 0.000000 -1.000000 0.000000 54.79000 -REMARK 290 SMTRY3 10 0.000000 0.000000 1.000000 104.85500 -REMARK 290 SMTRY1 11 0.000000 -1.000000 0.000000 54.79000 -REMARK 290 SMTRY2 11 1.000000 0.000000 0.000000 54.79000 -REMARK 290 SMTRY3 11 0.000000 0.000000 1.000000 104.85500 -REMARK 290 SMTRY1 12 0.000000 1.000000 0.000000 54.79000 -REMARK 290 SMTRY2 12 -1.000000 0.000000 0.000000 54.79000 -REMARK 290 SMTRY3 12 0.000000 0.000000 1.000000 104.85500 -REMARK 290 SMTRY1 13 -1.000000 0.000000 0.000000 54.79000 -REMARK 290 SMTRY2 13 0.000000 1.000000 0.000000 54.79000 -REMARK 290 SMTRY3 13 0.000000 0.000000 -1.000000 104.85500 -REMARK 290 SMTRY1 14 1.000000 0.000000 0.000000 54.79000 -REMARK 290 SMTRY2 14 0.000000 -1.000000 0.000000 54.79000 -REMARK 290 SMTRY3 14 0.000000 0.000000 -1.000000 104.85500 -REMARK 290 SMTRY1 15 0.000000 1.000000 0.000000 54.79000 -REMARK 290 SMTRY2 15 1.000000 0.000000 0.000000 54.79000 -REMARK 290 SMTRY3 15 0.000000 0.000000 -1.000000 104.85500 -REMARK 290 SMTRY1 16 0.000000 -1.000000 0.000000 54.79000 -REMARK 290 SMTRY2 16 -1.000000 0.000000 0.000000 54.79000 -REMARK 290 SMTRY3 16 0.000000 0.000000 -1.000000 104.85500 -REMARK 290 -REMARK 290 REMARK: NULL -REMARK 300 -REMARK 300 BIOMOLECULE: 1 -REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM -REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN -REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON -REMARK 300 BURIED SURFACE AREA. -REMARK 350 -REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN -REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE -REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS -REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND -REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. -REMARK 350 -REMARK 350 BIOMOLECULE: 1 -REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC -REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC -REMARK 350 SOFTWARE USED: PISA -REMARK 350 TOTAL BURIED SURFACE AREA: 21990 ANGSTROM**2 -REMARK 350 SURFACE AREA OF THE COMPLEX: 49610 ANGSTROM**2 -REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -197.0 KCAL/MOL -REMARK 350 APPLY THE FOLLOWING TO CHAINS: A -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 109.58000 -REMARK 350 BIOMT2 2 0.000000 -1.000000 0.000000 109.58000 -REMARK 350 BIOMT3 2 0.000000 0.000000 1.000000 0.00000 -REMARK 350 BIOMT1 3 0.000000 -1.000000 0.000000 109.58000 -REMARK 350 BIOMT2 3 1.000000 0.000000 0.000000 0.00000 -REMARK 350 BIOMT3 3 0.000000 0.000000 1.000000 0.00000 -REMARK 350 BIOMT1 4 0.000000 1.000000 0.000000 0.00000 -REMARK 350 BIOMT2 4 -1.000000 0.000000 0.000000 109.58000 -REMARK 350 BIOMT3 4 0.000000 0.000000 1.000000 0.00000 -REMARK 375 -REMARK 375 SPECIAL POSITION -REMARK 375 THE FOLLOWING ATOMS ARE FOUND TO BE WITHIN 0.15 ANGSTROMS -REMARK 375 OF A SYMMETRY RELATED ATOM AND ARE ASSUMED TO BE ON SPECIAL -REMARK 375 POSITIONS. -REMARK 375 -REMARK 375 ATOM RES CSSEQI -REMARK 375 NA NA A 301 LIES ON A SPECIAL POSITION. -REMARK 375 NA NA A 302 LIES ON A SPECIAL POSITION. -REMARK 375 NA NA A 303 LIES ON A SPECIAL POSITION. -REMARK 465 -REMARK 465 MISSING RESIDUES -REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE -REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN -REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) -REMARK 465 -REMARK 465 M RES C SSSEQI -REMARK 465 GLY A -2 -REMARK 465 ALA A 92 -REMARK 465 GLN A 93 -REMARK 465 GLY A 94 -REMARK 465 SER A 95 -REMARK 465 LEU A 96 -REMARK 465 SER A 97 -REMARK 465 VAL A 98 -REMARK 465 LEU A 99 -REMARK 465 ASN A 262 -REMARK 465 ASN A 263 -REMARK 465 GLU A 264 -REMARK 465 LEU A 265 -REMARK 465 LEU A 266 -REMARK 465 GLN A 267 -REMARK 465 ARG A 268 -REMARK 465 GLN A 269 -REMARK 465 GLN A 270 -REMARK 465 PRO A 271 -REMARK 465 GLN A 272 -REMARK 465 LYS A 273 -REMARK 465 LYS A 274 -REMARK 470 -REMARK 470 MISSING ATOM -REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; -REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; -REMARK 470 I=INSERTION CODE): -REMARK 470 M RES CSSEQI ATOMS -REMARK 470 LYS A 12 CD CE NZ -REMARK 470 ARG A 74 CG CD NE CZ NH1 NH2 -REMARK 470 ARG A 100 CG CD NE CZ NH1 NH2 -REMARK 470 LYS A 233 CG CD CE NZ -REMARK 470 ASP A 250 CG OD1 OD2 -REMARK 470 ARG A 254 CG CD NE CZ NH1 NH2 -REMARK 470 GLU A 256 CG CD OE1 OE2 -REMARK 470 LYS A 257 CG CD CE NZ -REMARK 470 GLN A 258 CG CD OE1 NE2 -REMARK 470 LEU A 259 CG CD1 CD2 -REMARK 470 GLN A 261 CG CD OE1 NE2 -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 429 O HOH A 434 0.89 -REMARK 500 -REMARK 500 REMARK: NULL -REMARK 500 -REMARK 500 GEOMETRY AND STEREOCHEMISTRY -REMARK 500 SUBTOPIC: CLOSE CONTACTS -REMARK 500 -REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC -REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 -REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A -REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 -REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE -REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. -REMARK 500 -REMARK 500 DISTANCE CUTOFF: -REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS -REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS -REMARK 500 -REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE -REMARK 500 O HOH A 424 O HOH A 427 3655 1.62 -REMARK 500 NH2 ARG A 251 OD1 ASP A 253 3655 1.75 -REMARK 500 -REMARK 500 REMARK: NULL -REMARK 500 -REMARK 500 GEOMETRY AND STEREOCHEMISTRY -REMARK 500 SUBTOPIC: TORSION ANGLES -REMARK 500 -REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: -REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; -REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). -REMARK 500 -REMARK 500 STANDARD TABLE: -REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) -REMARK 500 -REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- -REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 -REMARK 500 -REMARK 500 M RES CSSEQI PSI PHI -REMARK 500 THR A 101 -48.53 73.68 -REMARK 500 -REMARK 500 REMARK: NULL -REMARK 525 -REMARK 525 SOLVENT -REMARK 525 -REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT -REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST -REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT -REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE -REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; -REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE -REMARK 525 NUMBER; I=INSERTION CODE): -REMARK 525 -REMARK 525 M RES CSSEQI -REMARK 525 HOH A 489 DISTANCE = 5.89 ANGSTROMS -REMARK 525 HOH A 490 DISTANCE = 6.19 ANGSTROMS -REMARK 525 HOH A 491 DISTANCE = 6.20 ANGSTROMS -REMARK 525 HOH A 492 DISTANCE = 6.73 ANGSTROMS -REMARK 525 HOH A 493 DISTANCE = 7.16 ANGSTROMS -REMARK 525 HOH A 494 DISTANCE = 8.90 ANGSTROMS -REMARK 525 HOH A 495 DISTANCE = 9.61 ANGSTROMS -REMARK 525 HOH A 496 DISTANCE = 10.43 ANGSTROMS -REMARK 525 HOH A 497 DISTANCE = 11.42 ANGSTROMS -REMARK 525 HOH A 498 DISTANCE = 11.73 ANGSTROMS -REMARK 525 HOH A 499 DISTANCE = 12.92 ANGSTROMS -REMARK 525 HOH A 500 DISTANCE = 13.24 ANGSTROMS -REMARK 525 HOH A 501 DISTANCE = 13.62 ANGSTROMS -REMARK 525 HOH A 502 DISTANCE = 13.91 ANGSTROMS -REMARK 525 HOH A 503 DISTANCE = 14.27 ANGSTROMS -REMARK 525 HOH A 504 DISTANCE = 15.43 ANGSTROMS -REMARK 525 HOH A 505 DISTANCE = 15.97 ANGSTROMS -REMARK 525 HOH A 506 DISTANCE = 16.98 ANGSTROMS -REMARK 525 HOH A 507 DISTANCE = 17.00 ANGSTROMS -REMARK 525 HOH A 508 DISTANCE = 18.57 ANGSTROMS -REMARK 525 HOH A 509 DISTANCE = 19.38 ANGSTROMS -REMARK 525 HOH A 510 DISTANCE = 20.17 ANGSTROMS -REMARK 525 HOH A 511 DISTANCE = 21.09 ANGSTROMS -REMARK 610 -REMARK 610 MISSING HETEROATOM -REMARK 610 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; -REMARK 610 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; -REMARK 610 I=INSERTION CODE): -REMARK 610 M RES C SSEQI -REMARK 610 2CV A 304 -REMARK 610 12P A 305 -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 NA A 301 NA -REMARK 620 N RES CSSEQI ATOM -REMARK 620 1 HOH A 424 O -REMARK 620 2 HOH A 424 O 80.6 -REMARK 620 N 1 -REMARK 620 -REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL -REMARK 620 NA A 302 NA -REMARK 620 N RES CSSEQI ATOM -REMARK 620 1 HOH A 427 O -REMARK 620 2 HOH A 427 O 126.3 -REMARK 620 N 1 -REMARK 800 -REMARK 800 SITE -REMARK 800 SITE_IDENTIFIER: AC1 -REMARK 800 EVIDENCE_CODE: SOFTWARE -REMARK 800 SITE_DESCRIPTION: binding site for residue NA A 301 -REMARK 800 -REMARK 800 SITE_IDENTIFIER: AC2 -REMARK 800 EVIDENCE_CODE: SOFTWARE -REMARK 800 SITE_DESCRIPTION: binding site for residue NA A 302 -REMARK 800 -REMARK 800 SITE_IDENTIFIER: AC3 -REMARK 800 EVIDENCE_CODE: SOFTWARE -REMARK 800 SITE_DESCRIPTION: binding site for residue NA A 303 -REMARK 800 -REMARK 800 SITE_IDENTIFIER: AC4 -REMARK 800 EVIDENCE_CODE: SOFTWARE -REMARK 800 SITE_DESCRIPTION: binding site for residue 2CV A 304 -REMARK 800 -REMARK 800 SITE_IDENTIFIER: AC5 -REMARK 800 EVIDENCE_CODE: SOFTWARE -REMARK 800 SITE_DESCRIPTION: binding site for residue 12P A 305 -REMARK 800 -REMARK 800 SITE_IDENTIFIER: AC6 -REMARK 800 EVIDENCE_CODE: SOFTWARE -REMARK 800 SITE_DESCRIPTION: binding site for residue MES A 306 -DBREF 5HVD A 1 274 UNP A0L5S6 A0L5S6_MAGMM 1 274 -SEQADV 5HVD GLY A -2 UNP A0L5S6 EXPRESSION TAG -SEQADV 5HVD SER A -1 UNP A0L5S6 EXPRESSION TAG -SEQADV 5HVD HIS A 0 UNP A0L5S6 EXPRESSION TAG -SEQADV 5HVD CYS A 218 UNP A0L5S6 ILE 218 ENGINEERED MUTATION -SEQRES 1 A 277 GLY SER HIS MET SER ARG LYS ILE ARG ASP LEU ILE GLU -SEQRES 2 A 277 SER LYS ARG PHE GLN ASN VAL ILE THR ALA ILE ILE VAL -SEQRES 3 A 277 LEU ASN GLY ALA VAL LEU GLY LEU LEU THR ASP THR THR -SEQRES 4 A 277 LEU SER ALA SER SER GLN ASN LEU LEU GLU ARG VAL ASP -SEQRES 5 A 277 GLN LEU CYS LEU THR ILE PHE ILE VAL GLU ILE SER LEU -SEQRES 6 A 277 LYS ILE TYR ALA TYR GLY VAL ARG GLY PHE PHE ARG SER -SEQRES 7 A 277 GLY TRP ASN LEU PHE ASP PHE VAL ILE VAL ALA ILE ALA -SEQRES 8 A 277 LEU MET PRO ALA GLN GLY SER LEU SER VAL LEU ARG THR -SEQRES 9 A 277 PHE ARG ILE PHE ARG VAL MET ARG LEU VAL SER VAL ILE -SEQRES 10 A 277 PRO THR MET ARG ARG VAL VAL GLN GLY MET LEU LEU ALA -SEQRES 11 A 277 LEU PRO GLY VAL GLY SER VAL ALA ALA LEU LEU THR VAL -SEQRES 12 A 277 VAL PHE TYR ILE ALA ALA VAL MET ALA THR ASN LEU TYR -SEQRES 13 A 277 GLY ALA THR PHE PRO GLU TRP PHE GLY ASP LEU SER LYS -SEQRES 14 A 277 SER LEU TYR THR LEU PHE GLN VAL MET THR LEU GLU SER -SEQRES 15 A 277 TRP SER MET GLY ILE VAL ARG PRO VAL MET ASN VAL HIS -SEQRES 16 A 277 PRO ASN ALA TRP VAL PHE PHE ILE PRO PHE ILE MET LEU -SEQRES 17 A 277 THR THR PHE THR VAL LEU ASN LEU PHE ILE GLY ILE CYS -SEQRES 18 A 277 VAL ASP ALA MET ALA ILE THR LYS GLU GLN GLU GLU GLU -SEQRES 19 A 277 ALA LYS THR GLY HIS HIS GLN GLU PRO ILE SER GLN THR -SEQRES 20 A 277 LEU LEU HIS LEU GLY ASP ARG LEU ASP ARG ILE GLU LYS -SEQRES 21 A 277 GLN LEU ALA GLN ASN ASN GLU LEU LEU GLN ARG GLN GLN -SEQRES 22 A 277 PRO GLN LYS LYS -HET NA A 301 1 -HET NA A 302 1 -HET NA A 303 1 -HET 2CV A 304 20 -HET 12P A 305 34 -HET MES A 306 12 -HETNAM NA SODIUM ION -HETNAM 2CV HEGA-10 -HETNAM 12P DODECAETHYLENE GLYCOL -HETNAM MES 2-(N-MORPHOLINO)-ETHANESULFONIC ACID -HETSYN 12P POLYETHYLENE GLYCOL PEG400 -FORMUL 2 NA 3(NA 1+) -FORMUL 5 2CV C18 H37 N O7 -FORMUL 6 12P C24 H50 O13 -FORMUL 7 MES C6 H13 N O4 S -FORMUL 8 HOH *111(H2 O) -HELIX 1 AA1 SER A -1 GLU A 10 1 12 -HELIX 2 AA2 SER A 11 LEU A 32 1 22 -HELIX 3 AA3 SER A 38 GLY A 68 1 31 -HELIX 4 AA4 GLY A 68 PHE A 73 1 6 -HELIX 5 AA5 SER A 75 ALA A 88 1 14 -HELIX 6 AA6 PHE A 102 VAL A 107 5 6 -HELIX 7 AA7 MET A 108 ILE A 114 1 7 -HELIX 8 AA8 ILE A 114 ALA A 127 1 14 -HELIX 9 AA9 LEU A 128 GLY A 130 5 3 -HELIX 10 AB1 VAL A 131 GLY A 154 1 24 -HELIX 11 AB2 PHE A 157 GLY A 162 1 6 -HELIX 12 AB3 ASP A 163 THR A 176 1 14 -HELIX 13 AB4 ILE A 184 HIS A 192 1 9 -HELIX 14 AB5 ALA A 195 GLY A 235 1 41 -HELIX 15 AB6 PRO A 240 GLN A 261 1 22 -LINK NA NA A 301 O HOH A 424 1555 1555 2.95 -LINK NA NA A 302 O HOH A 427 1555 1555 2.97 -LINK NA NA A 301 O HOH A 424 1555 2665 2.95 -LINK NA NA A 302 O HOH A 427 1555 2665 2.97 -CISPEP 1 ARG A 70 GLY A 71 0 8.45 -SITE 1 AC1 1 HOH A 424 -SITE 1 AC2 2 NA A 303 HOH A 427 -SITE 1 AC3 1 NA A 302 -SITE 1 AC4 6 SER A 165 MET A 189 ASN A 194 TRP A 196 -SITE 2 AC4 6 HOH A 423 HOH A 425 -SITE 1 AC5 11 PHE A 105 MET A 124 ILE A 144 MET A 148 -SITE 2 AC5 11 TYR A 153 HIS A 192 PRO A 193 ASN A 194 -SITE 3 AC5 11 PHE A 198 PHE A 208 HOH A 419 -SITE 1 AC6 2 LEU A 205 HOH A 429 -CRYST1 109.580 109.580 209.710 90.00 90.00 90.00 I 4 2 2 16 -ORIGX1 1.000000 0.000000 0.000000 0.00000 -ORIGX2 0.000000 1.000000 0.000000 0.00000 -ORIGX3 0.000000 0.000000 1.000000 0.00000 -SCALE1 0.009126 0.000000 0.000000 0.00000 -SCALE2 0.000000 0.009126 0.000000 0.00000 -SCALE3 0.000000 0.000000 0.004768 0.00000 -ATOM 1 N SER A -1 26.283 95.533 52.433 1.00170.64 N -ANISOU 1 N SER A -1 27103 21224 16510 10413 504 -8044 N -ATOM 2 CA SER A -1 24.889 95.621 52.004 1.00169.99 C -ANISOU 2 CA SER A -1 26771 21374 16443 10741 835 -7786 C -ATOM 3 C SER A -1 24.249 94.243 51.823 1.00169.60 C -ANISOU 3 C SER A -1 26319 22123 15999 10945 1078 -7329 C -ATOM 4 O SER A -1 24.926 93.288 51.427 1.00167.39 O -ANISOU 4 O SER A -1 26118 22061 15422 11117 850 -7182 O -ATOM 5 CB SER A -1 24.764 96.438 50.720 1.00172.81 C -ANISOU 5 CB SER A -1 27236 21043 17380 10606 760 -7676 C -ATOM 6 OG SER A -1 25.388 95.801 49.617 1.00176.72 O -ANISOU 6 OG SER A -1 27689 21390 18066 10324 599 -7344 O -ATOM 7 N HIS A 0 22.932 94.157 52.112 1.00166.95 N -ANISOU 7 N HIS A 0 25682 22311 15440 11291 1449 -7220 N -ATOM 8 CA HIS A 0 22.127 92.938 52.000 1.00165.36 C -ANISOU 8 CA HIS A 0 25064 22930 14836 11528 1760 -6817 C -ATOM 9 C HIS A 0 22.002 92.449 50.552 1.00165.83 C -ANISOU 9 C HIS A 0 25006 23004 14997 11685 1670 -6479 C -ATOM 10 O HIS A 0 21.933 91.239 50.330 1.00164.49 O -ANISOU 10 O HIS A 0 24612 23395 14492 11779 1798 -6140 O -ATOM 11 CB HIS A 0 20.742 93.138 52.635 1.00166.90 C -ANISOU 11 CB HIS A 0 24829 23509 15077 11429 2266 -6762 C -ATOM 12 CG HIS A 0 20.787 93.347 54.115 1.00170.50 C -ANISOU 12 CG HIS A 0 25271 23984 15527 10951 2506 -6939 C -ATOM 13 ND1 HIS A 0 20.978 94.606 54.662 1.00173.13 N -ANISOU 13 ND1 HIS A 0 25818 23727 16238 10671 2466 -7307 N -ATOM 14 CD2 HIS A 0 20.659 92.451 55.121 1.00171.90 C -ANISOU 14 CD2 HIS A 0 25266 24685 15361 10699 2807 -6773 C -ATOM 15 CE1 HIS A 0 20.965 94.435 55.974 1.00173.52 C -ANISOU 15 CE1 HIS A 0 25856 24055 16019 10478 2681 -7418 C -ATOM 16 NE2 HIS A 0 20.767 93.158 56.299 1.00173.13 N -ANISOU 16 NE2 HIS A 0 25578 24656 15549 10461 2893 -7093 N -ATOM 17 N MET A 1 21.989 93.385 49.575 1.00162.91 N -ANISOU 17 N MET A 1 24932 22102 14863 12048 1387 -6631 N -ATOM 18 CA MET A 1 21.892 93.071 48.148 1.00158.69 C -ANISOU 18 CA MET A 1 24226 21413 14657 11862 1360 -6251 C -ATOM 19 C MET A 1 23.162 92.379 47.631 1.00155.82 C -ANISOU 19 C MET A 1 23887 20680 14639 11063 1199 -5994 C -ATOM 20 O MET A 1 23.053 91.415 46.878 1.00150.15 O -ANISOU 20 O MET A 1 22778 20179 14094 10638 1363 -5545 O -ATOM 21 CB MET A 1 21.529 94.321 47.320 1.00163.57 C -ANISOU 21 CB MET A 1 25139 21451 15559 12235 1176 -6410 C -ATOM 22 CG MET A 1 21.168 94.024 45.861 1.00163.34 C -ANISOU 22 CG MET A 1 24813 21344 15906 11973 1240 -5965 C -ATOM 23 SD MET A 1 19.903 92.742 45.597 1.00165.43 S -ANISOU 23 SD MET A 1 24231 22642 15983 11943 1680 -5545 S -ATOM 24 CE MET A 1 18.399 93.711 45.838 1.00166.37 C -ANISOU 24 CE MET A 1 24088 22980 16146 12404 1901 -5742 C -ATOM 25 N SER A 2 24.352 92.849 48.068 1.00152.77 N -ANISOU 25 N SER A 2 23932 19780 14335 10875 874 -6314 N -ATOM 26 CA SER A 2 25.659 92.283 47.719 1.00147.90 C -ANISOU 26 CA SER A 2 23332 18857 14004 10177 690 -6162 C -ATOM 27 C SER A 2 25.742 90.823 48.189 1.00148.71 C -ANISOU 27 C SER A 2 23068 19603 13830 9917 912 -5840 C -ATOM 28 O SER A 2 26.215 89.965 47.435 1.00143.21 O -ANISOU 28 O SER A 2 22146 18875 13391 9386 941 -5460 O -ATOM 29 CB SER A 2 26.782 93.109 48.341 1.00154.48 C -ANISOU 29 CB SER A 2 24638 19167 14892 10115 309 -6672 C -ATOM 30 OG SER A 2 28.069 92.689 47.916 1.00160.35 O -ANISOU 30 OG SER A 2 25361 19609 15956 9450 112 -6566 O -ATOM 31 N ARG A 3 25.233 90.542 49.414 1.00148.17 N -ANISOU 31 N ARG A 3 22968 20113 13218 10322 1091 -5974 N -ATOM 32 CA ARG A 3 25.200 89.198 49.990 1.00145.99 C -ANISOU 32 CA ARG A 3 22427 20437 12605 10151 1353 -5648 C -ATOM 33 C ARG A 3 24.158 88.293 49.336 1.00146.19 C -ANISOU 33 C ARG A 3 21967 20895 12682 10003 1759 -5144 C -ATOM 34 O ARG A 3 24.417 87.098 49.177 1.00142.06 O -ANISOU 34 O ARG A 3 21241 20564 12172 9577 1904 -4757 O -ATOM 35 CB ARG A 3 25.030 89.239 51.516 1.00151.67 C -ANISOU 35 CB ARG A 3 23315 21625 12689 10643 1431 -5939 C -ATOM 36 CG ARG A 3 26.350 89.386 52.277 1.00164.43 C -ANISOU 36 CG ARG A 3 25290 23015 14170 10575 1049 -6297 C -ATOM 37 CD ARG A 3 27.341 88.248 52.035 1.00167.28 C -ANISOU 37 CD ARG A 3 25547 23371 14641 10022 978 -5965 C -ATOM 38 NE ARG A 3 26.851 86.958 52.525 1.00170.42 N -ANISOU 38 NE ARG A 3 25735 24380 14635 10020 1371 -5518 N -ATOM 39 CZ ARG A 3 27.177 86.425 53.698 1.00180.54 C -ANISOU 39 CZ ARG A 3 27060 25931 15606 9859 1475 -5485 C -ATOM 40 NH1 ARG A 3 28.005 87.063 54.518 1.00168.47 N -ANISOU 40 NH1 ARG A 3 25978 24433 13599 10503 1026 -6076 N -ATOM 41 NH2 ARG A 3 26.682 85.250 54.061 1.00169.40 N -ANISOU 41 NH2 ARG A 3 25619 25133 13614 10200 1808 -5086 N -ATOM 42 N LYS A 4 22.989 88.857 48.949 1.00144.19 N -ANISOU 42 N LYS A 4 21529 20795 12463 10365 1926 -5174 N -ATOM 43 CA LYS A 4 21.925 88.120 48.262 1.00142.08 C -ANISOU 43 CA LYS A 4 20739 20968 12277 10235 2278 -4775 C -ATOM 44 C LYS A 4 22.405 87.639 46.888 1.00139.21 C -ANISOU 44 C LYS A 4 20236 20220 12436 9650 2153 -4447 C -ATOM 45 O LYS A 4 22.104 86.506 46.509 1.00136.02 O -ANISOU 45 O LYS A 4 19466 20125 12089 9272 2389 -4064 O -ATOM 46 CB LYS A 4 20.647 88.966 48.128 1.00148.60 C -ANISOU 46 CB LYS A 4 21392 22051 13017 10828 2410 -4960 C -ATOM 47 CG LYS A 4 19.714 88.853 49.326 1.00164.71 C -ANISOU 47 CG LYS A 4 23253 24839 14491 11307 2765 -5075 C -ATOM 48 CD LYS A 4 18.255 88.712 48.899 1.00172.38 C -ANISOU 48 CD LYS A 4 23597 26286 15615 11251 3140 -4902 C -ATOM 49 CE LYS A 4 17.342 88.409 50.063 1.00176.77 C -ANISOU 49 CE LYS A 4 23759 27135 16271 10627 3662 -4839 C -ATOM 50 NZ LYS A 4 15.991 87.991 49.603 1.00181.88 N -ANISOU 50 NZ LYS A 4 23725 28091 17292 10141 4065 -4614 N -ATOM 51 N ILE A 5 23.182 88.487 46.166 1.00133.90 N -ANISOU 51 N ILE A 5 19878 18864 12133 9561 1793 -4604 N -ATOM 52 CA ILE A 5 23.757 88.173 44.849 1.00128.67 C -ANISOU 52 CA ILE A 5 19142 17808 11940 9047 1654 -4326 C -ATOM 53 C ILE A 5 24.874 87.128 45.009 1.00130.26 C -ANISOU 53 C ILE A 5 19358 17963 12171 8512 1593 -4142 C -ATOM 54 O ILE A 5 24.864 86.137 44.284 1.00125.79 O -ANISOU 54 O ILE A 5 18508 17511 11774 8113 1705 -3784 O -ATOM 55 CB ILE A 5 24.199 89.445 44.050 1.00131.70 C -ANISOU 55 CB ILE A 5 19880 17484 12677 9123 1346 -4516 C -ATOM 56 CG1 ILE A 5 22.994 90.376 43.756 1.00135.46 C -ANISOU 56 CG1 ILE A 5 20338 18021 13111 9718 1412 -4640 C -ATOM 57 CG2 ILE A 5 24.924 89.069 42.738 1.00127.08 C -ANISOU 57 CG2 ILE A 5 19229 16532 12525 8570 1227 -4210 C -ATOM 58 CD1 ILE A 5 23.346 91.866 43.525 1.00142.40 C -ANISOU 58 CD1 ILE A 5 21759 18170 14177 10001 1126 -4949 C -ATOM 59 N ARG A 6 25.797 87.329 45.986 1.00129.70 N -ANISOU 59 N ARG A 6 19610 17762 11908 8549 1405 -4415 N -ATOM 60 CA ARG A 6 26.906 86.413 46.303 1.00127.38 C -ANISOU 60 CA ARG A 6 19361 17471 11568 8165 1305 -4305 C -ATOM 61 C ARG A 6 26.383 84.993 46.542 1.00130.76 C -ANISOU 61 C ARG A 6 19501 18417 11766 8017 1646 -3902 C -ATOM 62 O ARG A 6 26.876 84.063 45.912 1.00126.47 O -ANISOU 62 O ARG A 6 18832 17802 11420 7587 1640 -3604 O -ATOM 63 CB ARG A 6 27.681 86.900 47.536 1.00131.36 C -ANISOU 63 CB ARG A 6 20212 17929 11769 8394 1075 -4726 C -ATOM 64 CG ARG A 6 29.194 86.969 47.358 1.00140.60 C -ANISOU 64 CG ARG A 6 21556 18679 13186 8029 698 -4895 C -ATOM 65 CD ARG A 6 29.881 87.590 48.569 1.00158.84 C -ANISOU 65 CD ARG A 6 24182 20965 15203 8292 428 -5407 C -ATOM 66 NE ARG A 6 29.497 88.994 48.754 1.00177.10 N -ANISOU 66 NE ARG A 6 26755 22978 17557 8644 316 -5829 N -ATOM 67 CZ ARG A 6 29.793 89.730 49.821 1.00194.44 C -ANISOU 67 CZ ARG A 6 29149 25096 19633 8720 190 -6267 C -ATOM 68 NH1 ARG A 6 30.484 89.208 50.827 1.00188.90 N -ANISOU 68 NH1 ARG A 6 28603 24751 18421 9008 -31 -6508 N -ATOM 69 NH2 ARG A 6 29.396 90.994 49.893 1.00181.47 N -ANISOU 69 NH2 ARG A 6 27880 23165 17907 9303 3 -6723 N -ATOM 70 N ASP A 7 25.341 84.842 47.393 1.00131.83 N -ANISOU 70 N ASP A 7 19529 19062 11497 8366 1964 -3888 N -ATOM 71 CA ASP A 7 24.704 83.557 47.702 1.00132.17 C -ANISOU 71 CA ASP A 7 19316 19598 11306 8212 2359 -3499 C -ATOM 72 C ASP A 7 24.084 82.891 46.467 1.00133.13 C -ANISOU 72 C ASP A 7 19036 19751 11795 7831 2532 -3148 C -ATOM 73 O ASP A 7 24.070 81.662 46.390 1.00131.57 O -ANISOU 73 O ASP A 7 18697 19718 11576 7480 2742 -2800 O -ATOM 74 CB ASP A 7 23.680 83.697 48.842 1.00139.74 C -ANISOU 74 CB ASP A 7 20221 21119 11757 8674 2694 -3586 C -ATOM 75 CG ASP A 7 24.268 83.942 50.230 1.00155.15 C -ANISOU 75 CG ASP A 7 22556 23185 13207 9029 2597 -3852 C -ATOM 76 OD1 ASP A 7 25.479 83.665 50.428 1.00153.38 O -ANISOU 76 OD1 ASP A 7 22603 22689 12985 8858 2309 -3898 O -ATOM 77 OD2 ASP A 7 23.509 84.376 51.127 1.00168.02 O -ANISOU 77 OD2 ASP A 7 24192 25233 14414 9502 2810 -4023 O -ATOM 78 N LEU A 8 23.606 83.702 45.492 1.00128.81 N -ANISOU 78 N LEU A 8 18343 19026 11575 7915 2425 -3251 N -ATOM 79 CA LEU A 8 23.053 83.222 44.222 1.00125.72 C -ANISOU 79 CA LEU A 8 17574 18662 11531 7611 2512 -2991 C -ATOM 80 C LEU A 8 24.209 82.766 43.312 1.00123.83 C -ANISOU 80 C LEU A 8 17449 17957 11642 7148 2250 -2841 C -ATOM 81 O LEU A 8 24.163 81.651 42.801 1.00120.94 O -ANISOU 81 O LEU A 8 16872 17679 11402 6757 2369 -2547 O -ATOM 82 CB LEU A 8 22.173 84.302 43.543 1.00127.45 C -ANISOU 82 CB LEU A 8 17638 18892 11897 7977 2468 -3165 C -ATOM 83 CG LEU A 8 21.928 84.186 42.023 1.00129.13 C -ANISOU 83 CG LEU A 8 17588 18967 12510 7743 2383 -2991 C -ATOM 84 CD1 LEU A 8 20.973 83.044 41.684 1.00129.32 C -ANISOU 84 CD1 LEU A 8 17088 19498 12551 7463 2690 -2729 C -ATOM 85 CD2 LEU A 8 21.392 85.484 41.464 1.00133.84 C -ANISOU 85 CD2 LEU A 8 18229 19422 13203 8212 2239 -3202 C -ATOM 86 N ILE A 9 25.247 83.625 43.140 1.00118.43 N -ANISOU 86 N ILE A 9 17097 16789 11112 7185 1906 -3064 N -ATOM 87 CA ILE A 9 26.468 83.374 42.355 1.00113.39 C -ANISOU 87 CA ILE A 9 16570 15734 10779 6789 1649 -2983 C -ATOM 88 C ILE A 9 27.093 82.037 42.811 1.00115.28 C -ANISOU 88 C ILE A 9 16814 16112 10873 6497 1709 -2775 C -ATOM 89 O ILE A 9 27.410 81.185 41.974 1.00112.91 O -ANISOU 89 O ILE A 9 16381 15729 10790 6137 1696 -2534 O -ATOM 90 CB ILE A 9 27.474 84.575 42.517 1.00117.09 C -ANISOU 90 CB ILE A 9 17405 15736 11347 6892 1320 -3325 C -ATOM 91 CG1 ILE A 9 26.921 85.926 41.963 1.00119.24 C -ANISOU 91 CG1 ILE A 9 17778 15736 11791 7183 1247 -3499 C -ATOM 92 CG2 ILE A 9 28.867 84.281 41.950 1.00114.61 C -ANISOU 92 CG2 ILE A 9 17172 15086 11286 6475 1076 -3282 C -ATOM 93 CD1 ILE A 9 26.505 86.018 40.500 1.00124.63 C -ANISOU 93 CD1 ILE A 9 18282 16273 12798 7060 1258 -3271 C -ATOM 94 N GLU A 10 27.224 81.858 44.144 1.00112.92 N -ANISOU 94 N GLU A 10 16697 16031 10175 6705 1777 -2872 N -ATOM 95 CA GLU A 10 27.811 80.695 44.812 1.00111.87 C -ANISOU 95 CA GLU A 10 16675 16031 9800 6561 1829 -2691 C -ATOM 96 C GLU A 10 26.922 79.437 44.848 1.00115.57 C -ANISOU 96 C GLU A 10 16941 16817 10155 6379 2216 -2303 C -ATOM 97 O GLU A 10 27.412 78.377 45.254 1.00114.67 O -ANISOU 97 O GLU A 10 16968 16728 9874 6234 2269 -2092 O -ATOM 98 CB GLU A 10 28.255 81.072 46.235 1.00116.76 C -ANISOU 98 CB GLU A 10 17602 16781 9982 6918 1740 -2956 C -ATOM 99 CG GLU A 10 29.492 81.955 46.279 1.00125.25 C -ANISOU 99 CG GLU A 10 18896 17512 11181 6952 1309 -3336 C -ATOM 100 CD GLU A 10 29.752 82.721 47.564 1.00146.09 C -ANISOU 100 CD GLU A 10 21812 20257 13441 7362 1165 -3740 C -ATOM 101 OE1 GLU A 10 29.044 82.481 48.570 1.00146.69 O -ANISOU 101 OE1 GLU A 10 21948 20724 13063 7680 1412 -3702 O -ATOM 102 OE2 GLU A 10 30.675 83.568 47.563 1.00135.23 O -ANISOU 102 OE2 GLU A 10 20586 18580 12216 7350 808 -4110 O -ATOM 103 N SER A 11 25.640 79.535 44.430 1.00113.30 N -ANISOU 103 N SER A 11 16328 16764 9958 6382 2480 -2217 N -ATOM 104 CA SER A 11 24.732 78.383 44.439 1.00114.73 C -ANISOU 104 CA SER A 11 16262 17252 10078 6130 2867 -1883 C -ATOM 105 C SER A 11 25.019 77.367 43.317 1.00116.91 C -ANISOU 105 C SER A 11 16414 17300 10708 5650 2816 -1633 C -ATOM 106 O SER A 11 25.633 77.714 42.299 1.00113.71 O -ANISOU 106 O SER A 11 15992 16584 10630 5548 2519 -1720 O -ATOM 107 CB SER A 11 23.272 78.827 44.420 1.00121.08 C -ANISOU 107 CB SER A 11 16689 18469 10845 6299 3156 -1931 C -ATOM 108 OG SER A 11 22.865 79.313 43.152 1.00128.41 O -ANISOU 108 OG SER A 11 17329 19304 12159 6243 3020 -2005 O -ATOM 109 N LYS A 12 24.579 76.104 43.524 1.00114.95 N -ANISOU 109 N LYS A 12 16105 17194 10378 5353 3122 -1322 N -ATOM 110 CA LYS A 12 24.736 75.008 42.568 1.00112.09 C -ANISOU 110 CA LYS A 12 15654 16621 10316 4900 3110 -1096 C -ATOM 111 C LYS A 12 23.917 75.272 41.293 1.00115.30 C -ANISOU 111 C LYS A 12 15606 17107 11095 4738 3094 -1161 C -ATOM 112 O LYS A 12 24.424 75.022 40.202 1.00111.89 O -ANISOU 112 O LYS A 12 15140 16408 10967 4529 2865 -1149 O -ATOM 113 CB LYS A 12 24.349 73.663 43.207 1.00117.09 C -ANISOU 113 CB LYS A 12 16381 17349 10756 4627 3479 -759 C -ATOM 114 CG LYS A 12 24.880 72.449 42.453 1.00128.12 C -ANISOU 114 CG LYS A 12 17890 18395 12394 4225 3398 -550 C -ATOM 115 N ARG A 13 22.671 75.800 41.436 1.00114.83 N -ANISOU 115 N ARG A 13 15194 17457 10980 4885 3325 -1248 N -ATOM 116 CA ARG A 13 21.758 76.120 40.328 1.00114.42 C -ANISOU 116 CA ARG A 13 14670 17591 11213 4832 3308 -1344 C -ATOM 117 C ARG A 13 22.370 77.118 39.341 1.00114.49 C -ANISOU 117 C ARG A 13 14752 17301 11447 5041 2907 -1533 C -ATOM 118 O ARG A 13 22.345 76.854 38.138 1.00112.04 O -ANISOU 118 O ARG A 13 14257 16892 11423 4835 2765 -1505 O -ATOM 119 CB ARG A 13 20.381 76.593 40.852 1.00119.61 C -ANISOU 119 CB ARG A 13 14941 18812 11693 5060 3622 -1440 C -ATOM 120 CG ARG A 13 19.313 76.950 39.790 1.00131.04 C -ANISOU 120 CG ARG A 13 15838 20571 13380 5090 3603 -1575 C -ATOM 121 CD ARG A 13 18.937 75.843 38.802 1.00143.49 C -ANISOU 121 CD ARG A 13 17078 22183 15259 4557 3645 -1449 C -ATOM 122 NE ARG A 13 18.626 74.567 39.451 1.00158.95 N -ANISOU 122 NE ARG A 13 18994 24253 17148 4084 4019 -1211 N -ATOM 123 CZ ARG A 13 19.216 73.411 39.156 1.00171.70 C -ANISOU 123 CZ ARG A 13 20826 25499 18914 3620 3997 -1010 C -ATOM 124 NH1 ARG A 13 20.143 73.353 38.208 1.00151.04 N -ANISOU 124 NH1 ARG A 13 18423 22449 16515 3576 3620 -1039 N -ATOM 125 NH2 ARG A 13 18.876 72.303 39.800 1.00164.20 N -ANISOU 125 NH2 ARG A 13 19896 24604 17887 3207 4368 -773 N -ATOM 126 N PHE A 14 22.952 78.231 39.850 1.00110.28 N -ANISOU 126 N PHE A 14 14519 16603 10777 5430 2729 -1722 N -ATOM 127 CA PHE A 14 23.615 79.253 39.033 1.00107.23 C -ANISOU 127 CA PHE A 14 14284 15865 10595 5599 2385 -1880 C -ATOM 128 C PHE A 14 24.794 78.648 38.274 1.00108.17 C -ANISOU 128 C PHE A 14 14567 15605 10928 5262 2161 -1763 C -ATOM 129 O PHE A 14 24.989 78.967 37.096 1.00106.68 O -ANISOU 129 O PHE A 14 14307 15239 10986 5212 1976 -1770 O -ATOM 130 CB PHE A 14 24.093 80.418 39.904 1.00110.06 C -ANISOU 130 CB PHE A 14 14983 16069 10766 5993 2260 -2119 C -ATOM 131 CG PHE A 14 24.608 81.617 39.142 1.00109.86 C -ANISOU 131 CG PHE A 14 15136 15655 10952 6164 1963 -2283 C -ATOM 132 CD1 PHE A 14 23.734 82.591 38.672 1.00114.73 C -ANISOU 132 CD1 PHE A 14 15633 16341 11617 6511 1954 -2402 C -ATOM 133 CD2 PHE A 14 25.970 81.794 38.931 1.00108.79 C -ANISOU 133 CD2 PHE A 14 15298 15088 10949 5993 1705 -2319 C -ATOM 134 CE1 PHE A 14 24.211 83.706 37.979 1.00115.03 C -ANISOU 134 CE1 PHE A 14 15920 15950 11838 6667 1707 -2509 C -ATOM 135 CE2 PHE A 14 26.447 82.911 38.242 1.00111.15 C -ANISOU 135 CE2 PHE A 14 15781 14998 11452 6089 1480 -2442 C -ATOM 136 CZ PHE A 14 25.564 83.856 37.765 1.00111.48 C -ANISOU 136 CZ PHE A 14 15774 15041 11542 6419 1490 -2515 C -ATOM 137 N GLN A 15 25.568 77.765 38.945 1.00103.27 N -ANISOU 137 N GLN A 15 14170 14889 10180 5075 2184 -1650 N -ATOM 138 CA GLN A 15 26.700 77.076 38.340 1.00 99.30 C -ANISOU 138 CA GLN A 15 13811 14085 9834 4804 1985 -1554 C -ATOM 139 C GLN A 15 26.205 76.164 37.216 1.00100.66 C -ANISOU 139 C GLN A 15 13705 14301 10239 4489 2041 -1397 C -ATOM 140 O GLN A 15 26.810 76.170 36.150 1.00 98.19 O -ANISOU 140 O GLN A 15 13380 13784 10142 4380 1830 -1400 O -ATOM 141 CB GLN A 15 27.498 76.280 39.386 1.00101.30 C -ANISOU 141 CB GLN A 15 14364 14283 9843 4762 2008 -1468 C -ATOM 142 CG GLN A 15 28.878 75.818 38.887 1.00108.38 C -ANISOU 142 CG GLN A 15 15432 14887 10862 4611 1738 -1450 C -ATOM 143 CD GLN A 15 29.372 74.574 39.582 1.00119.87 C -ANISOU 143 CD GLN A 15 17120 16314 12111 4530 1797 -1276 C -ATOM 144 OE1 GLN A 15 29.455 73.494 38.986 1.00110.59 O -ANISOU 144 OE1 GLN A 15 15932 15028 11057 4288 1814 -1106 O -ATOM 145 NE2 GLN A 15 29.727 74.700 40.855 1.00115.35 N -ANISOU 145 NE2 GLN A 15 16803 15825 11200 4769 1811 -1327 N -ATOM 146 N ASN A 16 25.090 75.430 37.437 1.00 98.18 N -ANISOU 146 N ASN A 16 13151 14272 9880 4336 2328 -1283 N -ATOM 147 CA ASN A 16 24.495 74.525 36.446 1.00 97.50 C -ANISOU 147 CA ASN A 16 12770 14257 10019 4001 2386 -1189 C -ATOM 148 C ASN A 16 23.960 75.258 35.209 1.00100.52 C -ANISOU 148 C ASN A 16 12836 14748 10609 4108 2235 -1321 C -ATOM 149 O ASN A 16 24.139 74.759 34.092 1.00 97.98 O -ANISOU 149 O ASN A 16 12409 14329 10489 3907 2094 -1298 O -ATOM 150 CB ASN A 16 23.408 73.642 37.067 1.00100.49 C -ANISOU 150 CB ASN A 16 12948 14923 10309 3762 2756 -1060 C -ATOM 151 CG ASN A 16 23.894 72.652 38.101 1.00115.24 C -ANISOU 151 CG ASN A 16 15175 16637 11975 3602 2929 -850 C -ATOM 152 OD1 ASN A 16 25.050 72.224 38.106 1.00107.12 O -ANISOU 152 OD1 ASN A 16 14503 15269 10931 3583 2740 -786 O -ATOM 153 ND2 ASN A 16 23.010 72.256 39.004 1.00108.79 N -ANISOU 153 ND2 ASN A 16 14270 16093 10973 3507 3307 -729 N -ATOM 154 N VAL A 17 23.323 76.439 35.408 1.00 98.54 N -ANISOU 154 N VAL A 17 12467 14696 10278 4473 2253 -1463 N -ATOM 155 CA VAL A 17 22.781 77.272 34.326 1.00 98.35 C -ANISOU 155 CA VAL A 17 12204 14776 10388 4693 2105 -1577 C -ATOM 156 C VAL A 17 23.936 77.756 33.437 1.00 98.70 C -ANISOU 156 C VAL A 17 12522 14412 10567 4731 1806 -1569 C -ATOM 157 O VAL A 17 23.882 77.575 32.214 1.00 97.30 O -ANISOU 157 O VAL A 17 12190 14236 10543 4653 1673 -1547 O -ATOM 158 CB VAL A 17 21.901 78.445 34.851 1.00105.57 C -ANISOU 158 CB VAL A 17 13005 15959 11150 5153 2190 -1733 C -ATOM 159 CG1 VAL A 17 21.543 79.423 33.734 1.00105.63 C -ANISOU 159 CG1 VAL A 17 12897 15977 11259 5476 1988 -1829 C -ATOM 160 CG2 VAL A 17 20.634 77.930 35.527 1.00109.36 C -ANISOU 160 CG2 VAL A 17 13086 16958 11506 5094 2517 -1744 C -ATOM 161 N ILE A 18 24.996 78.319 34.060 1.00 93.63 N -ANISOU 161 N ILE A 18 12266 13453 9856 4828 1709 -1598 N -ATOM 162 CA ILE A 18 26.184 78.816 33.356 1.00 90.81 C -ANISOU 162 CA ILE A 18 12157 12722 9626 4809 1471 -1595 C -ATOM 163 C ILE A 18 26.906 77.662 32.604 1.00 91.59 C -ANISOU 163 C ILE A 18 12228 12727 9846 4462 1389 -1472 C -ATOM 164 O ILE A 18 27.297 77.858 31.453 1.00 90.66 O -ANISOU 164 O ILE A 18 12094 12494 9859 4435 1244 -1440 O -ATOM 165 CB ILE A 18 27.100 79.660 34.305 1.00 93.98 C -ANISOU 165 CB ILE A 18 12918 12856 9936 4946 1391 -1713 C -ATOM 166 CG1 ILE A 18 26.706 81.161 34.276 1.00 96.29 C -ANISOU 166 CG1 ILE A 18 13325 13035 10224 5312 1342 -1851 C -ATOM 167 CG2 ILE A 18 28.586 79.529 33.948 1.00 91.72 C -ANISOU 167 CG2 ILE A 18 12831 12260 9759 4731 1204 -1692 C -ATOM 168 CD1 ILE A 18 25.361 81.540 34.799 1.00107.49 C -ANISOU 168 CD1 ILE A 18 14582 14771 11489 5636 1504 -1942 C -ATOM 169 N THR A 19 26.999 76.458 33.217 1.00 86.97 N -ANISOU 169 N THR A 19 11651 12198 9195 4232 1498 -1398 N -ATOM 170 CA THR A 19 27.597 75.254 32.614 1.00 84.53 C -ANISOU 170 CA THR A 19 11354 11784 8979 3946 1428 -1303 C -ATOM 171 C THR A 19 26.821 74.868 31.344 1.00 89.21 C -ANISOU 171 C THR A 19 11637 12533 9726 3836 1405 -1297 C -ATOM 172 O THR A 19 27.441 74.580 30.308 1.00 87.61 O -ANISOU 172 O THR A 19 11443 12218 9626 3753 1243 -1283 O -ATOM 173 CB THR A 19 27.621 74.101 33.633 1.00 86.85 C -ANISOU 173 CB THR A 19 11776 12078 9143 3775 1586 -1206 C -ATOM 174 OG1 THR A 19 28.366 74.511 34.778 1.00 84.19 O -ANISOU 174 OG1 THR A 19 11724 11648 8617 3942 1568 -1239 O -ATOM 175 CG2 THR A 19 28.214 72.811 33.062 1.00 81.92 C -ANISOU 175 CG2 THR A 19 11231 11290 8606 3526 1508 -1120 C -ATOM 176 N ALA A 20 25.461 74.884 31.436 1.00 87.03 N -ANISOU 176 N ALA A 20 11059 12567 9443 3858 1562 -1335 N -ATOM 177 CA ALA A 20 24.543 74.561 30.342 1.00 87.08 C -ANISOU 177 CA ALA A 20 10698 12818 9572 3778 1529 -1392 C -ATOM 178 C ALA A 20 24.677 75.551 29.197 1.00 89.10 C -ANISOU 178 C ALA A 20 10923 13066 9865 4055 1321 -1437 C -ATOM 179 O ALA A 20 24.553 75.147 28.042 1.00 88.78 O -ANISOU 179 O ALA A 20 10723 13102 9908 3984 1191 -1464 O -ATOM 180 CB ALA A 20 23.108 74.538 30.845 1.00 91.26 C -ANISOU 180 CB ALA A 20 10866 13746 10062 3782 1748 -1457 C -ATOM 181 N ILE A 21 24.951 76.834 29.510 1.00 84.91 N -ANISOU 181 N ILE A 21 10587 12416 9261 4373 1290 -1445 N -ATOM 182 CA ILE A 21 25.104 77.889 28.508 1.00 84.44 C -ANISOU 182 CA ILE A 21 10597 12271 9216 4653 1130 -1438 C -ATOM 183 C ILE A 21 26.478 77.776 27.819 1.00 85.59 C -ANISOU 183 C ILE A 21 10989 12104 9426 4506 991 -1344 C -ATOM 184 O ILE A 21 26.551 77.989 26.601 1.00 84.55 O -ANISOU 184 O ILE A 21 10818 11994 9314 4592 874 -1300 O -ATOM 185 CB ILE A 21 24.762 79.286 29.094 1.00 89.34 C -ANISOU 185 CB ILE A 21 11363 12834 9748 5041 1163 -1491 C -ATOM 186 CG1 ILE A 21 23.228 79.395 29.215 1.00 93.05 C -ANISOU 186 CG1 ILE A 21 11456 13754 10145 5274 1260 -1600 C -ATOM 187 CG2 ILE A 21 25.300 80.438 28.225 1.00 89.77 C -ANISOU 187 CG2 ILE A 21 11681 12604 9824 5281 1018 -1424 C -ATOM 188 CD1 ILE A 21 22.735 80.200 30.307 1.00106.08 C -ANISOU 188 CD1 ILE A 21 13172 15462 11672 5567 1380 -1695 C -ATOM 189 N ILE A 22 27.535 77.355 28.571 1.00 80.40 N -ANISOU 189 N ILE A 22 10552 11222 8774 4302 1005 -1322 N -ATOM 190 CA ILE A 22 28.874 77.119 28.005 1.00 77.49 C -ANISOU 190 CA ILE A 22 10345 10641 8458 4153 888 -1264 C -ATOM 191 C ILE A 22 28.758 75.973 26.988 1.00 79.85 C -ANISOU 191 C ILE A 22 10458 11082 8798 3997 825 -1249 C -ATOM 192 O ILE A 22 29.250 76.112 25.865 1.00 78.60 O -ANISOU 192 O ILE A 22 10305 10905 8654 4029 722 -1205 O -ATOM 193 CB ILE A 22 29.959 76.835 29.088 1.00 79.33 C -ANISOU 193 CB ILE A 22 10795 10688 8659 4020 888 -1289 C -ATOM 194 CG1 ILE A 22 30.169 78.042 30.017 1.00 79.92 C -ANISOU 194 CG1 ILE A 22 11066 10609 8693 4174 908 -1363 C -ATOM 195 CG2 ILE A 22 31.300 76.412 28.438 1.00 79.04 C -ANISOU 195 CG2 ILE A 22 10830 10534 8670 3877 767 -1258 C -ATOM 196 CD1 ILE A 22 30.759 77.690 31.371 1.00 83.30 C -ANISOU 196 CD1 ILE A 22 11645 10988 9016 4120 923 -1437 C -ATOM 197 N VAL A 23 28.059 74.871 27.374 1.00 77.18 N -ANISOU 197 N VAL A 23 9968 10885 8471 3825 900 -1291 N -ATOM 198 CA VAL A 23 27.830 73.686 26.525 1.00 77.23 C -ANISOU 198 CA VAL A 23 9815 10990 8538 3641 834 -1331 C -ATOM 199 C VAL A 23 27.036 74.084 25.267 1.00 81.69 C -ANISOU 199 C VAL A 23 10127 11803 9109 3801 736 -1388 C -ATOM 200 O VAL A 23 27.441 73.723 24.159 1.00 80.34 O -ANISOU 200 O VAL A 23 9940 11651 8935 3801 597 -1405 O -ATOM 201 CB VAL A 23 27.204 72.491 27.309 1.00 82.28 C -ANISOU 201 CB VAL A 23 10389 11661 9214 3371 970 -1354 C -ATOM 202 CG1 VAL A 23 26.774 71.362 26.377 1.00 82.73 C -ANISOU 202 CG1 VAL A 23 10267 11798 9370 3160 891 -1450 C -ATOM 203 CG2 VAL A 23 28.175 71.959 28.360 1.00 81.20 C -ANISOU 203 CG2 VAL A 23 10573 11262 9016 3277 1023 -1272 C -ATOM 204 N LEU A 24 25.962 74.888 25.441 1.00 79.30 N -ANISOU 204 N LEU A 24 9642 11715 8774 4001 796 -1425 N -ATOM 205 CA LEU A 24 25.146 75.392 24.333 1.00 80.63 C -ANISOU 205 CA LEU A 24 9575 12162 8898 4254 683 -1485 C -ATOM 206 C LEU A 24 25.995 76.201 23.338 1.00 84.73 C -ANISOU 206 C LEU A 24 10324 12527 9342 4480 561 -1365 C -ATOM 207 O LEU A 24 25.846 76.025 22.127 1.00 85.56 O -ANISOU 207 O LEU A 24 10316 12805 9389 4579 424 -1392 O -ATOM 208 CB LEU A 24 23.956 76.226 24.852 1.00 82.64 C -ANISOU 208 CB LEU A 24 9634 12664 9100 4517 770 -1545 C -ATOM 209 CG LEU A 24 23.025 76.858 23.802 1.00 88.70 C -ANISOU 209 CG LEU A 24 10158 13766 9777 4893 633 -1617 C -ATOM 210 CD1 LEU A 24 22.367 75.803 22.921 1.00 89.69 C -ANISOU 210 CD1 LEU A 24 9896 14240 9942 4728 510 -1789 C -ATOM 211 CD2 LEU A 24 21.986 77.758 24.458 1.00 92.58 C -ANISOU 211 CD2 LEU A 24 10499 14482 10196 5227 723 -1683 C -ATOM 212 N ASN A 25 26.888 77.065 23.854 1.00 80.11 N -ANISOU 212 N ASN A 25 10062 11627 8750 4540 618 -1241 N -ATOM 213 CA ASN A 25 27.784 77.882 23.039 1.00 79.36 C -ANISOU 213 CA ASN A 25 10211 11336 8606 4671 565 -1094 C -ATOM 214 C ASN A 25 28.787 76.998 22.279 1.00 81.29 C -ANISOU 214 C ASN A 25 10471 11563 8852 4466 496 -1070 C -ATOM 215 O ASN A 25 29.040 77.245 21.100 1.00 81.55 O -ANISOU 215 O ASN A 25 10531 11665 8791 4602 431 -987 O -ATOM 216 CB ASN A 25 28.507 78.923 23.900 1.00 78.43 C -ANISOU 216 CB ASN A 25 10405 10867 8527 4685 650 -1020 C -ATOM 217 CG ASN A 25 28.974 80.156 23.161 1.00 92.75 C -ANISOU 217 CG ASN A 25 12481 12458 10300 4874 647 -857 C -ATOM 218 OD1 ASN A 25 29.422 81.123 23.773 1.00 85.95 O -ANISOU 218 OD1 ASN A 25 11883 11284 9490 4892 705 -824 O -ATOM 219 ND2 ASN A 25 28.853 80.184 21.838 1.00 84.37 N -ANISOU 219 ND2 ASN A 25 11385 11538 9136 5024 584 -751 N -ATOM 220 N GLY A 26 29.309 75.968 22.948 1.00 75.15 N -ANISOU 220 N GLY A 26 9691 10713 8148 4190 513 -1142 N -ATOM 221 CA GLY A 26 30.230 75.013 22.346 1.00 73.29 C -ANISOU 221 CA GLY A 26 9471 10471 7905 4041 439 -1161 C -ATOM 222 C GLY A 26 29.581 74.221 21.230 1.00 77.84 C -ANISOU 222 C GLY A 26 9839 11302 8434 4076 320 -1266 C -ATOM 223 O GLY A 26 30.187 74.018 20.171 1.00 78.04 O -ANISOU 223 O GLY A 26 9883 11397 8372 4134 238 -1254 O -ATOM 224 N ALA A 27 28.323 73.802 21.460 1.00 75.10 N -ANISOU 224 N ALA A 27 9269 11131 8134 4041 313 -1393 N -ATOM 225 CA ALA A 27 27.485 73.061 20.521 1.00 76.26 C -ANISOU 225 CA ALA A 27 9155 11556 8263 4040 179 -1566 C -ATOM 226 C ALA A 27 27.159 73.897 19.281 1.00 82.32 C -ANISOU 226 C ALA A 27 9846 12569 8862 4393 67 -1534 C -ATOM 227 O ALA A 27 27.210 73.354 18.179 1.00 82.98 O -ANISOU 227 O ALA A 27 9838 12835 8854 4450 -85 -1641 O -ATOM 228 CB ALA A 27 26.201 72.617 21.203 1.00 78.63 C -ANISOU 228 CB ALA A 27 9190 12010 8676 3876 238 -1710 C -ATOM 229 N VAL A 28 26.846 75.210 19.444 1.00 79.81 N -ANISOU 229 N VAL A 28 9604 12242 8478 4665 131 -1389 N -ATOM 230 CA VAL A 28 26.515 76.063 18.292 1.00 81.98 C -ANISOU 230 CA VAL A 28 9880 12716 8552 5063 34 -1311 C -ATOM 231 C VAL A 28 27.785 76.358 17.466 1.00 84.50 C -ANISOU 231 C VAL A 28 10481 12880 8746 5119 49 -1112 C -ATOM 232 O VAL A 28 27.721 76.318 16.227 1.00 86.61 O -ANISOU 232 O VAL A 28 10715 13381 8811 5347 -65 -1104 O -ATOM 233 CB VAL A 28 25.650 77.339 18.581 1.00 87.86 C -ANISOU 233 CB VAL A 28 10637 13511 9233 5419 71 -1235 C -ATOM 234 CG1 VAL A 28 24.320 76.971 19.234 1.00 89.14 C -ANISOU 234 CG1 VAL A 28 10419 13967 9482 5389 61 -1465 C -ATOM 235 CG2 VAL A 28 26.391 78.390 19.406 1.00 86.61 C -ANISOU 235 CG2 VAL A 28 10848 12927 9131 5427 237 -1025 C -ATOM 236 N LEU A 29 28.932 76.586 18.139 1.00 77.06 N -ANISOU 236 N LEU A 29 9779 11596 7904 4907 190 -976 N -ATOM 237 CA LEU A 29 30.205 76.834 17.454 1.00 76.48 C -ANISOU 237 CA LEU A 29 9909 11411 7739 4887 249 -801 C -ATOM 238 C LEU A 29 30.701 75.603 16.656 1.00 79.57 C -ANISOU 238 C LEU A 29 10178 12003 8053 4803 143 -936 C -ATOM 239 O LEU A 29 31.298 75.773 15.588 1.00 80.47 O -ANISOU 239 O LEU A 29 10367 12228 7981 4935 153 -821 O -ATOM 240 CB LEU A 29 31.286 77.361 18.417 1.00 74.94 C -ANISOU 240 CB LEU A 29 9924 10859 7689 4657 403 -687 C -ATOM 241 CG LEU A 29 31.075 78.773 18.998 1.00 79.50 C -ANISOU 241 CG LEU A 29 10722 11166 8318 4764 510 -541 C -ATOM 242 CD1 LEU A 29 32.126 79.072 20.038 1.00 77.99 C -ANISOU 242 CD1 LEU A 29 10676 10664 8291 4482 613 -534 C -ATOM 243 CD2 LEU A 29 31.097 79.845 17.919 1.00 81.96 C -ANISOU 243 CD2 LEU A 29 11245 11434 8462 5025 563 -291 C -ATOM 244 N GLY A 30 30.413 74.397 17.165 1.00 73.86 N -ANISOU 244 N GLY A 30 9295 11313 7455 4602 58 -1172 N -ATOM 245 CA GLY A 30 30.715 73.129 16.510 1.00 73.09 C -ANISOU 245 CA GLY A 30 9111 11351 7309 4536 -73 -1362 C -ATOM 246 C GLY A 30 29.859 72.949 15.269 1.00 79.64 C -ANISOU 246 C GLY A 30 9769 12532 7956 4778 -247 -1495 C -ATOM 247 O GLY A 30 30.344 72.479 14.238 1.00 81.12 O -ANISOU 247 O GLY A 30 9963 12889 7969 4894 -340 -1564 O -ATOM 248 N LEU A 31 28.584 73.368 15.347 1.00 76.78 N -ANISOU 248 N LEU A 31 9238 12331 7605 4900 -301 -1551 N -ATOM 249 CA LEU A 31 27.636 73.326 14.235 1.00 79.51 C -ANISOU 249 CA LEU A 31 9374 13077 7760 5182 -499 -1707 C -ATOM 250 C LEU A 31 28.024 74.336 13.147 1.00 85.36 C -ANISOU 250 C LEU A 31 10298 13949 8184 5586 -485 -1459 C -ATOM 251 O LEU A 31 27.798 74.066 11.972 1.00 86.96 O -ANISOU 251 O LEU A 31 10419 14483 8139 5837 -655 -1572 O -ATOM 252 CB LEU A 31 26.190 73.580 14.718 1.00 81.24 C -ANISOU 252 CB LEU A 31 9315 13480 8073 5229 -548 -1840 C -ATOM 253 CG LEU A 31 25.500 72.423 15.455 1.00 86.01 C -ANISOU 253 CG LEU A 31 9648 14094 8938 4831 -582 -2134 C -ATOM 254 CD1 LEU A 31 24.317 72.913 16.245 1.00 87.83 C -ANISOU 254 CD1 LEU A 31 9624 14477 9272 4848 -522 -2182 C -ATOM 255 CD2 LEU A 31 25.066 71.320 14.504 1.00 90.08 C -ANISOU 255 CD2 LEU A 31 9932 14879 9414 4769 -826 -2483 C -ATOM 256 N LEU A 32 28.644 75.472 13.535 1.00 81.60 N -ANISOU 256 N LEU A 32 10099 13198 7709 5634 -276 -1123 N -ATOM 257 CA LEU A 32 29.104 76.524 12.621 1.00 83.28 C -ANISOU 257 CA LEU A 32 10570 13425 7648 5951 -185 -807 C -ATOM 258 C LEU A 32 30.369 76.139 11.787 1.00 86.54 C -ANISOU 258 C LEU A 32 11101 13889 7892 5902 -113 -713 C -ATOM 259 O LEU A 32 30.783 76.906 10.913 1.00 87.97 O -ANISOU 259 O LEU A 32 11492 14123 7810 6141 -5 -433 O -ATOM 260 CB LEU A 32 29.308 77.853 13.383 1.00 83.03 C -ANISOU 260 CB LEU A 32 10815 13010 7724 5950 24 -511 C -ATOM 261 CG LEU A 32 28.039 78.687 13.624 1.00 89.54 C -ANISOU 261 CG LEU A 32 11621 13881 8518 6277 -42 -503 C -ATOM 262 CD1 LEU A 32 28.179 79.556 14.858 1.00 88.51 C -ANISOU 262 CD1 LEU A 32 11687 13324 8617 6138 128 -382 C -ATOM 263 CD2 LEU A 32 27.688 79.543 12.411 1.00 94.64 C -ANISOU 263 CD2 LEU A 32 12457 14699 8804 6799 -87 -284 C -ATOM 264 N THR A 33 30.957 74.954 12.033 1.00 81.25 N -ANISOU 264 N THR A 33 10310 13214 7349 5625 -161 -938 N -ATOM 265 CA THR A 33 32.106 74.457 11.252 1.00 81.64 C -ANISOU 265 CA THR A 33 10412 13386 7222 5629 -114 -917 C -ATOM 266 C THR A 33 31.597 73.806 9.948 1.00 90.38 C -ANISOU 266 C THR A 33 11397 14923 8019 5946 -340 -1130 C -ATOM 267 O THR A 33 32.382 73.578 9.006 1.00 90.41 O -ANISOU 267 O THR A 33 11459 15139 7755 6095 -306 -1092 O -ATOM 268 CB THR A 33 32.956 73.447 12.052 1.00 76.41 C -ANISOU 268 CB THR A 33 9700 12542 6791 5292 -101 -1093 C -ATOM 269 OG1 THR A 33 32.184 72.272 12.299 1.00 71.56 O -ANISOU 269 OG1 THR A 33 8921 11963 6306 5201 -321 -1448 O -ATOM 270 CG2 THR A 33 33.533 74.035 13.331 1.00 68.11 C -ANISOU 270 CG2 THR A 33 8752 11123 6003 5008 88 -928 C -ATOM 271 N ASP A 34 30.274 73.484 9.936 1.00 89.78 N -ANISOU 271 N ASP A 34 11123 15012 7979 6041 -573 -1388 N -ATOM 272 CA ASP A 34 29.550 72.866 8.841 1.00 94.01 C -ANISOU 272 CA ASP A 34 11483 15973 8262 6321 -852 -1683 C -ATOM 273 C ASP A 34 29.462 73.861 7.695 1.00104.08 C -ANISOU 273 C ASP A 34 12904 17538 9102 6814 -831 -1417 C -ATOM 274 O ASP A 34 28.867 74.936 7.815 1.00104.25 O -ANISOU 274 O ASP A 34 13007 17529 9073 7022 -779 -1190 O -ATOM 275 CB ASP A 34 28.164 72.381 9.308 1.00 97.18 C -ANISOU 275 CB ASP A 34 11579 16468 8878 6210 -1073 -2027 C -ATOM 276 CG ASP A 34 27.367 71.506 8.344 1.00115.65 C -ANISOU 276 CG ASP A 34 13659 19235 11049 6380 -1412 -2463 C -ATOM 277 OD1 ASP A 34 27.589 71.611 7.114 1.00118.35 O -ANISOU 277 OD1 ASP A 34 14072 19904 10990 6766 -1514 -2461 O -ATOM 278 OD2 ASP A 34 26.474 70.769 8.814 1.00125.02 O -ANISOU 278 OD2 ASP A 34 14562 20450 12489 6126 -1570 -2810 O -ATOM 279 N THR A 35 30.132 73.498 6.602 1.00105.44 N -ANISOU 279 N THR A 35 13150 17975 8936 7025 -852 -1430 N -ATOM 280 CA THR A 35 30.240 74.257 5.362 1.00110.17 C -ANISOU 280 CA THR A 35 13934 18891 9035 7513 -806 -1163 C -ATOM 281 C THR A 35 28.911 74.297 4.585 1.00118.54 C -ANISOU 281 C THR A 35 14832 20392 9816 7964 -1140 -1393 C -ATOM 282 O THR A 35 28.594 75.321 3.975 1.00121.85 O -ANISOU 282 O THR A 35 15437 20962 9897 8403 -1100 -1090 O -ATOM 283 CB THR A 35 31.425 73.704 4.511 1.00123.28 C -ANISOU 283 CB THR A 35 15680 20750 10409 7580 -711 -1154 C -ATOM 284 OG1 THR A 35 31.517 72.276 4.639 1.00121.26 O -ANISOU 284 OG1 THR A 35 15216 20543 10315 7384 -931 -1643 O -ATOM 285 CG2 THR A 35 32.764 74.321 4.899 1.00120.53 C -ANISOU 285 CG2 THR A 35 15542 20108 10145 7328 -303 -733 C -ATOM 286 N THR A 36 28.133 73.189 4.635 1.00114.66 N -ANISOU 286 N THR A 36 13999 20092 9473 7849 -1470 -1935 N -ATOM 287 CA THR A 36 26.869 72.987 3.909 1.00117.86 C -ANISOU 287 CA THR A 36 14134 20993 9654 8211 -1848 -2297 C -ATOM 288 C THR A 36 25.630 73.719 4.510 1.00121.52 C -ANISOU 288 C THR A 36 14414 21488 10272 8303 -1926 -2285 C -ATOM 289 O THR A 36 24.547 73.641 3.915 1.00124.62 O -ANISOU 289 O THR A 36 14527 22357 10464 8639 -2251 -2595 O -ATOM 290 CB THR A 36 26.584 71.472 3.728 1.00123.35 C -ANISOU 290 CB THR A 36 14529 21851 10487 7975 -2162 -2922 C -ATOM 291 OG1 THR A 36 26.150 70.891 4.959 1.00118.77 O -ANISOU 291 OG1 THR A 36 13736 20932 10460 7419 -2159 -3138 O -ATOM 292 CG2 THR A 36 27.774 70.700 3.155 1.00121.05 C -ANISOU 292 CG2 THR A 36 14419 21549 10025 7958 -2114 -2990 C -ATOM 293 N LEU A 37 25.782 74.432 5.651 1.00114.51 N -ANISOU 293 N LEU A 37 13660 20145 9705 8051 -1649 -1964 N -ATOM 294 CA LEU A 37 24.661 75.135 6.291 1.00115.45 C -ANISOU 294 CA LEU A 37 13614 20291 9960 8170 -1697 -1959 C -ATOM 295 C LEU A 37 24.092 76.306 5.485 1.00124.02 C -ANISOU 295 C LEU A 37 14859 21668 10594 8874 -1773 -1712 C -ATOM 296 O LEU A 37 24.846 77.059 4.864 1.00125.15 O -ANISOU 296 O LEU A 37 15436 21698 10417 9159 -1588 -1278 O -ATOM 297 CB LEU A 37 25.014 75.617 7.704 1.00111.39 C -ANISOU 297 CB LEU A 37 13242 19218 9863 7768 -1391 -1703 C -ATOM 298 CG LEU A 37 25.123 74.581 8.816 1.00112.50 C -ANISOU 298 CG LEU A 37 13168 19099 10479 7133 -1347 -1969 C -ATOM 299 CD1 LEU A 37 25.481 75.252 10.110 1.00108.96 C -ANISOU 299 CD1 LEU A 37 12909 18160 10329 6867 -1056 -1682 C -ATOM 300 CD2 LEU A 37 23.825 73.806 9.003 1.00117.63 C -ANISOU 300 CD2 LEU A 37 13317 20086 11293 7014 -1608 -2452 C -ATOM 301 N SER A 38 22.758 76.476 5.535 1.00122.81 N -ANISOU 301 N SER A 38 14359 21886 10418 9155 -2027 -1975 N -ATOM 302 CA SER A 38 22.061 77.569 4.859 1.00127.52 C -ANISOU 302 CA SER A 38 15085 22786 10580 9906 -2147 -1782 C -ATOM 303 C SER A 38 22.300 78.888 5.603 1.00130.61 C -ANISOU 303 C SER A 38 15905 22655 11066 10005 -1832 -1270 C -ATOM 304 O SER A 38 22.725 78.866 6.761 1.00126.77 O -ANISOU 304 O SER A 38 15459 21686 11022 9478 -1590 -1194 O -ATOM 305 CB SER A 38 20.567 77.270 4.763 1.00135.06 C -ANISOU 305 CB SER A 38 15453 24357 11507 10164 -2536 -2290 C -ATOM 306 OG SER A 38 19.933 77.243 6.033 1.00141.36 O -ANISOU 306 OG SER A 38 15930 25010 12770 9795 -2461 -2449 O -ATOM 307 N ALA A 39 22.020 80.028 4.946 1.00130.84 N -ANISOU 307 N ALA A 39 16285 22762 10665 10701 -1847 -932 N -ATOM 308 CA ALA A 39 22.176 81.372 5.513 1.00130.76 C -ANISOU 308 CA ALA A 39 16764 22224 10695 10888 -1579 -451 C -ATOM 309 C ALA A 39 21.330 81.576 6.783 1.00132.51 C -ANISOU 309 C ALA A 39 16691 22345 11311 10756 -1596 -664 C -ATOM 310 O ALA A 39 21.820 82.165 7.753 1.00128.70 O -ANISOU 310 O ALA A 39 16504 21269 11129 10466 -1310 -412 O -ATOM 311 CB ALA A 39 21.818 82.422 4.468 1.00137.80 C -ANISOU 311 CB ALA A 39 18063 23292 11002 11754 -1663 -117 C -ATOM 312 N SER A 40 20.070 81.074 6.767 1.00131.28 N -ANISOU 312 N SER A 40 15926 22809 11146 10955 -1931 -1156 N -ATOM 313 CA SER A 40 19.109 81.155 7.875 1.00130.64 C -ANISOU 313 CA SER A 40 15439 22812 11386 10869 -1963 -1424 C -ATOM 314 C SER A 40 19.590 80.361 9.083 1.00127.35 C -ANISOU 314 C SER A 40 14832 22035 11518 10000 -1743 -1563 C -ATOM 315 O SER A 40 19.579 80.887 10.195 1.00124.55 O -ANISOU 315 O SER A 40 14581 21313 11431 9845 -1536 -1450 O -ATOM 316 CB SER A 40 17.728 80.678 7.433 1.00139.39 C -ANISOU 316 CB SER A 40 15864 24761 12338 11227 -2367 -1948 C -ATOM 317 OG SER A 40 17.773 79.364 6.899 1.00149.20 O -ANISOU 317 OG SER A 40 16695 26371 13623 10844 -2564 -2350 O -ATOM 318 N SER A 41 20.053 79.111 8.856 1.00121.16 N -ANISOU 318 N SER A 41 13826 21338 10872 9478 -1792 -1801 N -ATOM 319 CA SER A 41 20.593 78.226 9.889 1.00115.62 C -ANISOU 319 CA SER A 41 13003 20289 10640 8688 -1602 -1918 C -ATOM 320 C SER A 41 21.844 78.837 10.517 1.00114.57 C -ANISOU 320 C SER A 41 13433 19447 10649 8440 -1251 -1465 C -ATOM 321 O SER A 41 21.995 78.766 11.735 1.00111.05 O -ANISOU 321 O SER A 41 12968 18673 10553 8030 -1063 -1466 O -ATOM 322 CB SER A 41 20.912 76.852 9.311 1.00118.62 C -ANISOU 322 CB SER A 41 13152 20861 11058 8313 -1752 -2231 C -ATOM 323 OG SER A 41 19.747 76.214 8.816 1.00132.27 O -ANISOU 323 OG SER A 41 14310 23226 12722 8432 -2088 -2723 O -ATOM 324 N GLN A 42 22.712 79.472 9.691 1.00111.36 N -ANISOU 324 N GLN A 42 13519 18838 9955 8699 -1157 -1084 N -ATOM 325 CA GLN A 42 23.943 80.138 10.137 1.00108.27 C -ANISOU 325 CA GLN A 42 13648 17810 9679 8460 -825 -658 C -ATOM 326 C GLN A 42 23.639 81.371 10.993 1.00112.38 C -ANISOU 326 C GLN A 42 14434 17963 10305 8650 -680 -443 C -ATOM 327 O GLN A 42 24.246 81.528 12.052 1.00108.03 O -ANISOU 327 O GLN A 42 14030 16947 10069 8232 -463 -357 O -ATOM 328 CB GLN A 42 24.847 80.510 8.950 1.00111.25 C -ANISOU 328 CB GLN A 42 14439 18133 9699 8683 -737 -307 C -ATOM 329 CG GLN A 42 25.667 79.343 8.403 1.00125.38 C -ANISOU 329 CG GLN A 42 16087 20089 11461 8355 -764 -460 C -ATOM 330 CD GLN A 42 26.347 79.637 7.080 1.00156.66 C -ANISOU 330 CD GLN A 42 20371 24180 14975 8679 -703 -163 C -ATOM 331 OE1 GLN A 42 26.145 80.681 6.442 1.00158.90 O -ANISOU 331 OE1 GLN A 42 20997 24459 14920 9185 -661 172 O -ATOM 332 NE2 GLN A 42 27.153 78.695 6.614 1.00150.75 N -ANISOU 332 NE2 GLN A 42 19536 23562 14180 8429 -694 -280 N -ATOM 333 N ASN A 43 22.687 82.224 10.545 1.00114.15 N -ANISOU 333 N ASN A 43 14719 18408 10245 9319 -823 -387 N -ATOM 334 CA ASN A 43 22.261 83.436 11.249 1.00115.84 C -ANISOU 334 CA ASN A 43 15213 18299 10503 9637 -728 -219 C -ATOM 335 C ASN A 43 21.631 83.091 12.600 1.00116.89 C -ANISOU 335 C ASN A 43 14943 18469 10998 9339 -714 -542 C -ATOM 336 O ASN A 43 21.892 83.789 13.580 1.00114.73 O -ANISOU 336 O ASN A 43 14952 17715 10926 9227 -521 -409 O -ATOM 337 CB ASN A 43 21.302 84.266 10.380 1.00125.13 C -ANISOU 337 CB ASN A 43 16497 19800 11247 10507 -937 -142 C -ATOM 338 CG ASN A 43 20.518 85.342 11.116 1.00161.93 C -ANISOU 338 CG ASN A 43 21309 24284 15935 10954 -927 -111 C -ATOM 339 OD1 ASN A 43 21.067 86.155 11.875 1.00158.36 O -ANISOU 339 OD1 ASN A 43 21322 23177 15671 10814 -688 135 O -ATOM 340 ND2 ASN A 43 19.209 85.367 10.904 1.00158.57 N -ANISOU 340 ND2 ASN A 43 20471 24465 15314 11522 -1203 -399 N -ATOM 341 N LEU A 44 20.824 82.007 12.647 1.00113.67 N -ANISOU 341 N LEU A 44 13890 18631 10669 9189 -904 -972 N -ATOM 342 CA LEU A 44 20.153 81.526 13.856 1.00112.47 C -ANISOU 342 CA LEU A 44 13291 18611 10831 8868 -865 -1283 C -ATOM 343 C LEU A 44 21.187 81.144 14.909 1.00110.67 C -ANISOU 343 C LEU A 44 13247 17852 10949 8188 -603 -1192 C -ATOM 344 O LEU A 44 21.113 81.645 16.033 1.00109.68 O -ANISOU 344 O LEU A 44 13223 17455 10997 8118 -444 -1161 O -ATOM 345 CB LEU A 44 19.227 80.338 13.529 1.00114.46 C -ANISOU 345 CB LEU A 44 12840 19541 11107 8730 -1097 -1738 C -ATOM 346 CG LEU A 44 18.408 79.776 14.695 1.00119.76 C -ANISOU 346 CG LEU A 44 12991 20433 12081 8377 -1028 -2056 C -ATOM 347 CD1 LEU A 44 16.933 79.722 14.352 1.00125.36 C -ANISOU 347 CD1 LEU A 44 13082 21898 12652 8775 -1271 -2419 C -ATOM 348 CD2 LEU A 44 18.929 78.402 15.122 1.00119.65 C -ANISOU 348 CD2 LEU A 44 12794 20294 12374 7592 -938 -2212 C -ATOM 349 N LEU A 45 22.161 80.282 14.529 1.00103.16 N -ANISOU 349 N LEU A 45 12351 16781 10064 7750 -576 -1164 N -ATOM 350 CA LEU A 45 23.250 79.824 15.390 1.00 98.13 C -ANISOU 350 CA LEU A 45 11884 15694 9707 7157 -368 -1088 C -ATOM 351 C LEU A 45 24.131 80.989 15.851 1.00102.03 C -ANISOU 351 C LEU A 45 12922 15609 10234 7193 -157 -744 C -ATOM 352 O LEU A 45 24.573 80.990 16.998 1.00 99.12 O -ANISOU 352 O LEU A 45 12637 14918 10106 6852 -2 -749 O -ATOM 353 CB LEU A 45 24.103 78.748 14.686 1.00 95.92 C -ANISOU 353 CB LEU A 45 11576 15453 9417 6831 -415 -1130 C -ATOM 354 CG LEU A 45 23.438 77.394 14.394 1.00100.20 C -ANISOU 354 CG LEU A 45 11628 16429 10015 6626 -608 -1518 C -ATOM 355 CD1 LEU A 45 24.230 76.620 13.383 1.00 99.26 C -ANISOU 355 CD1 LEU A 45 11575 16371 9768 6532 -702 -1544 C -ATOM 356 CD2 LEU A 45 23.260 76.565 15.652 1.00 99.42 C -ANISOU 356 CD2 LEU A 45 11311 16214 10252 6110 -500 -1704 C -ATOM 357 N GLU A 46 24.365 81.988 14.972 1.00102.48 N -ANISOU 357 N GLU A 46 13364 15529 10044 7604 -152 -454 N -ATOM 358 CA GLU A 46 25.156 83.182 15.298 1.00103.37 C -ANISOU 358 CA GLU A 46 14032 15046 10198 7621 51 -126 C -ATOM 359 C GLU A 46 24.452 84.043 16.355 1.00109.32 C -ANISOU 359 C GLU A 46 14876 15604 11056 7843 87 -185 C -ATOM 360 O GLU A 46 25.125 84.634 17.205 1.00108.20 O -ANISOU 360 O GLU A 46 15055 14954 11101 7617 254 -83 O -ATOM 361 CB GLU A 46 25.495 84.005 14.040 1.00108.39 C -ANISOU 361 CB GLU A 46 15090 15571 10521 8002 76 231 C -ATOM 362 CG GLU A 46 26.642 83.437 13.207 1.00117.51 C -ANISOU 362 CG GLU A 46 16313 16734 11602 7691 161 381 C -ATOM 363 CD GLU A 46 28.070 83.646 13.688 1.00137.27 C -ANISOU 363 CD GLU A 46 19093 18735 14329 7166 420 574 C -ATOM 364 OE1 GLU A 46 28.268 84.196 14.797 1.00137.91 O -ANISOU 364 OE1 GLU A 46 19332 18400 14665 6968 529 568 O -ATOM 365 OE2 GLU A 46 28.999 83.260 12.941 1.00124.60 O -ANISOU 365 OE2 GLU A 46 17523 17191 12626 6970 508 705 O -ATOM 366 N ARG A 47 23.100 84.080 16.321 1.00108.17 N -ANISOU 366 N ARG A 47 14411 15903 10784 8291 -79 -392 N -ATOM 367 CA ARG A 47 22.277 84.790 17.301 1.00109.53 C -ANISOU 367 CA ARG A 47 14576 16025 11014 8580 -60 -510 C -ATOM 368 C ARG A 47 22.334 84.066 18.654 1.00109.15 C -ANISOU 368 C ARG A 47 14233 15978 11261 8063 53 -748 C -ATOM 369 O ARG A 47 22.373 84.730 19.691 1.00108.95 O -ANISOU 369 O ARG A 47 14410 15644 11343 8092 166 -761 O -ATOM 370 CB ARG A 47 20.823 84.945 16.815 1.00114.38 C -ANISOU 370 CB ARG A 47 14838 17235 11384 9220 -277 -696 C -ATOM 371 CG ARG A 47 20.633 85.974 15.694 1.00132.45 C -ANISOU 371 CG ARG A 47 17541 19462 13323 9921 -387 -432 C -ATOM 372 CD ARG A 47 20.542 87.404 16.195 1.00151.63 C -ANISOU 372 CD ARG A 47 20536 21359 15717 10359 -295 -242 C -ATOM 373 NE ARG A 47 20.618 88.368 15.096 1.00170.66 N -ANISOU 373 NE ARG A 47 23497 23546 17800 10944 -347 108 N -ATOM 374 CZ ARG A 47 20.460 89.682 15.236 1.00190.68 C -ANISOU 374 CZ ARG A 47 26509 25513 20428 11170 -306 314 C -ATOM 375 NH1 ARG A 47 20.212 90.207 16.431 1.00179.01 N -ANISOU 375 NH1 ARG A 47 25229 23837 18948 11494 -231 160 N -ATOM 376 NH2 ARG A 47 20.545 90.481 14.180 1.00183.97 N -ANISOU 376 NH2 ARG A 47 26190 24453 19257 11688 -341 670 N -ATOM 377 N VAL A 48 22.384 82.710 18.640 1.00102.25 N -ANISOU 377 N VAL A 48 12934 15418 10499 7606 23 -929 N -ATOM 378 CA VAL A 48 22.494 81.885 19.854 1.00 99.21 C -ANISOU 378 CA VAL A 48 12314 15022 10358 7101 145 -1107 C -ATOM 379 C VAL A 48 23.885 82.110 20.503 1.00100.61 C -ANISOU 379 C VAL A 48 12926 14610 10693 6725 306 -932 C -ATOM 380 O VAL A 48 23.999 82.064 21.729 1.00 98.90 O -ANISOU 380 O VAL A 48 12725 14238 10615 6518 424 -1016 O -ATOM 381 CB VAL A 48 22.175 80.378 19.612 1.00101.74 C -ANISOU 381 CB VAL A 48 12136 15765 10757 6725 70 -1333 C -ATOM 382 CG1 VAL A 48 22.227 79.580 20.914 1.00 99.25 C -ANISOU 382 CG1 VAL A 48 11658 15389 10663 6239 230 -1460 C -ATOM 383 CG2 VAL A 48 20.816 80.197 18.944 1.00105.35 C -ANISOU 383 CG2 VAL A 48 12108 16845 11075 7064 -112 -1561 C -ATOM 384 N ASP A 49 24.923 82.389 19.674 1.00 96.35 N -ANISOU 384 N ASP A 49 12719 13785 10105 6661 313 -699 N -ATOM 385 CA ASP A 49 26.281 82.701 20.124 1.00 93.68 C -ANISOU 385 CA ASP A 49 12747 12940 9906 6314 452 -547 C -ATOM 386 C ASP A 49 26.267 84.059 20.850 1.00 98.59 C -ANISOU 386 C ASP A 49 13760 13133 10567 6528 536 -473 C -ATOM 387 O ASP A 49 26.864 84.180 21.919 1.00 96.36 O -ANISOU 387 O ASP A 49 13609 12556 10449 6248 625 -536 O -ATOM 388 CB ASP A 49 27.266 82.708 18.931 1.00 95.39 C -ANISOU 388 CB ASP A 49 13158 13054 10032 6225 464 -317 C -ATOM 389 CG ASP A 49 28.702 83.053 19.295 1.00103.51 C -ANISOU 389 CG ASP A 49 14493 13627 11209 5844 614 -175 C -ATOM 390 OD1 ASP A 49 29.383 82.199 19.900 1.00100.43 O -ANISOU 390 OD1 ASP A 49 13945 13252 10961 5445 635 -301 O -ATOM 391 OD2 ASP A 49 29.141 84.184 18.981 1.00112.76 O -ANISOU 391 OD2 ASP A 49 16065 14426 12354 5945 710 56 O -ATOM 392 N GLN A 50 25.547 85.054 20.287 1.00 99.32 N -ANISOU 392 N GLN A 50 14048 13200 10489 7062 484 -366 N -ATOM 393 CA GLN A 50 25.382 86.392 20.863 1.00102.48 C -ANISOU 393 CA GLN A 50 14872 13167 10901 7369 537 -314 C -ATOM 394 C GLN A 50 24.653 86.325 22.202 1.00106.88 C -ANISOU 394 C GLN A 50 15215 13862 11535 7430 548 -600 C -ATOM 395 O GLN A 50 25.081 86.976 23.151 1.00106.87 O -ANISOU 395 O GLN A 50 15513 13443 11652 7343 626 -648 O -ATOM 396 CB GLN A 50 24.627 87.308 19.901 1.00108.70 C -ANISOU 396 CB GLN A 50 15894 13969 11439 8022 452 -147 C -ATOM 397 CG GLN A 50 25.487 87.858 18.770 1.00131.45 C -ANISOU 397 CG GLN A 50 19234 16485 14224 8014 519 223 C -ATOM 398 CD GLN A 50 24.657 88.413 17.634 1.00157.95 C -ANISOU 398 CD GLN A 50 22744 20018 17252 8700 403 397 C -ATOM 399 OE1 GLN A 50 24.822 88.018 16.473 1.00154.36 O -ANISOU 399 OE1 GLN A 50 22229 19821 16598 8760 359 557 O -ATOM 400 NE2 GLN A 50 23.748 89.343 17.937 1.00152.45 N -ANISOU 400 NE2 GLN A 50 22257 19210 16455 9287 338 355 N -ATOM 401 N LEU A 51 23.579 85.508 22.281 1.00104.01 N -ANISOU 401 N LEU A 51 14315 14104 11101 7549 478 -806 N -ATOM 402 CA LEU A 51 22.772 85.281 23.485 1.00104.49 C -ANISOU 402 CA LEU A 51 14075 14431 11197 7590 530 -1066 C -ATOM 403 C LEU A 51 23.631 84.675 24.601 1.00105.25 C -ANISOU 403 C LEU A 51 14190 14328 11474 7035 654 -1136 C -ATOM 404 O LEU A 51 23.582 85.160 25.733 1.00105.40 O -ANISOU 404 O LEU A 51 14348 14180 11518 7095 732 -1251 O -ATOM 405 CB LEU A 51 21.572 84.367 23.158 1.00105.62 C -ANISOU 405 CB LEU A 51 13582 15291 11256 7687 456 -1250 C -ATOM 406 CG LEU A 51 20.629 84.019 24.318 1.00111.33 C -ANISOU 406 CG LEU A 51 13900 16400 11999 7689 558 -1504 C -ATOM 407 CD1 LEU A 51 19.375 84.872 24.277 1.00116.33 C -ANISOU 407 CD1 LEU A 51 14399 17350 12452 8377 497 -1631 C -ATOM 408 CD2 LEU A 51 20.280 82.531 24.311 1.00111.51 C -ANISOU 408 CD2 LEU A 51 13365 16898 12107 7238 583 -1639 C -ATOM 409 N CYS A 52 24.419 83.628 24.272 1.00 99.34 N -ANISOU 409 N CYS A 52 13319 13607 10818 6551 656 -1079 N -ATOM 410 CA CYS A 52 25.333 82.946 25.196 1.00 96.40 C -ANISOU 410 CA CYS A 52 12976 13070 10582 6064 742 -1126 C -ATOM 411 C CYS A 52 26.362 83.935 25.737 1.00101.26 C -ANISOU 411 C CYS A 52 14063 13135 11275 6000 779 -1073 C -ATOM 412 O CYS A 52 26.585 83.979 26.949 1.00100.65 O -ANISOU 412 O CYS A 52 14057 12949 11239 5889 837 -1207 O -ATOM 413 CB CYS A 52 26.005 81.757 24.519 1.00 93.96 C -ANISOU 413 CB CYS A 52 12502 12870 10328 5674 704 -1068 C -ATOM 414 SG CYS A 52 24.942 80.301 24.347 1.00 97.92 S -ANISOU 414 SG CYS A 52 12448 13941 10816 5547 678 -1225 S -ATOM 415 N LEU A 53 26.932 84.771 24.842 1.00 99.13 N -ANISOU 415 N LEU A 53 14124 12529 11011 6082 752 -883 N -ATOM 416 CA LEU A 53 27.921 85.789 25.186 1.00 99.82 C -ANISOU 416 CA LEU A 53 14667 12051 11209 5963 793 -831 C -ATOM 417 C LEU A 53 27.373 86.865 26.130 1.00106.97 C -ANISOU 417 C LEU A 53 15834 12709 12100 6295 802 -979 C -ATOM 418 O LEU A 53 28.061 87.209 27.093 1.00107.39 O -ANISOU 418 O LEU A 53 16090 12456 12259 6090 822 -1112 O -ATOM 419 CB LEU A 53 28.543 86.411 23.921 1.00101.19 C -ANISOU 419 CB LEU A 53 15134 11934 11379 5958 810 -552 C -ATOM 420 CG LEU A 53 29.774 87.300 24.127 1.00107.02 C -ANISOU 420 CG LEU A 53 16288 12089 12284 5653 886 -480 C -ATOM 421 CD1 LEU A 53 30.945 86.519 24.722 1.00103.89 C -ANISOU 421 CD1 LEU A 53 15703 11740 12029 5116 899 -600 C -ATOM 422 CD2 LEU A 53 30.190 87.946 22.836 1.00112.04 C -ANISOU 422 CD2 LEU A 53 17224 12466 12879 5686 957 -155 C -ATOM 423 N THR A 54 26.140 87.368 25.880 1.00105.33 N -ANISOU 423 N THR A 54 15604 12672 11744 6839 768 -993 N -ATOM 424 CA THR A 54 25.511 88.397 26.719 1.00108.30 C -ANISOU 424 CA THR A 54 16229 12851 12070 7261 767 -1157 C -ATOM 425 C THR A 54 25.216 87.868 28.138 1.00109.22 C -ANISOU 425 C THR A 54 16089 13239 12169 7172 819 -1433 C -ATOM 426 O THR A 54 25.382 88.619 29.100 1.00110.63 O -ANISOU 426 O THR A 54 16565 13105 12364 7274 827 -1601 O -ATOM 427 CB THR A 54 24.287 89.051 26.040 1.00122.27 C -ANISOU 427 CB THR A 54 18022 14784 13652 7937 702 -1109 C -ATOM 428 OG1 THR A 54 23.301 88.063 25.744 1.00123.37 O -ANISOU 428 OG1 THR A 54 17565 15639 13672 8048 674 -1179 O -ATOM 429 CG2 THR A 54 24.658 89.833 24.774 1.00121.92 C -ANISOU 429 CG2 THR A 54 18412 14333 13579 8099 668 -803 C -ATOM 430 N ILE A 55 24.834 86.576 28.269 1.00101.75 N -ANISOU 430 N ILE A 55 14634 12839 11186 6962 862 -1475 N -ATOM 431 CA ILE A 55 24.594 85.918 29.563 1.00100.12 C -ANISOU 431 CA ILE A 55 14193 12913 10934 6828 957 -1669 C -ATOM 432 C ILE A 55 25.902 85.946 30.383 1.00101.41 C -ANISOU 432 C ILE A 55 14645 12686 11198 6451 954 -1728 C -ATOM 433 O ILE A 55 25.866 86.252 31.576 1.00102.37 O -ANISOU 433 O ILE A 55 14880 12768 11249 6545 991 -1923 O -ATOM 434 CB ILE A 55 24.029 84.476 29.375 1.00100.94 C -ANISOU 434 CB ILE A 55 13756 13582 11013 6589 1020 -1649 C -ATOM 435 CG1 ILE A 55 22.570 84.516 28.864 1.00103.85 C -ANISOU 435 CG1 ILE A 55 13747 14444 11265 6995 1019 -1702 C -ATOM 436 CG2 ILE A 55 24.139 83.643 30.669 1.00 99.93 C -ANISOU 436 CG2 ILE A 55 13491 13628 10851 6309 1152 -1756 C -ATOM 437 CD1 ILE A 55 22.114 83.276 28.072 1.00106.73 C -ANISOU 437 CD1 ILE A 55 13629 15263 11661 6744 1007 -1662 C -ATOM 438 N PHE A 56 27.049 85.686 29.722 1.00 94.95 N -ANISOU 438 N PHE A 56 13934 11621 10522 6063 902 -1582 N -ATOM 439 CA PHE A 56 28.372 85.720 30.348 1.00 93.48 C -ANISOU 439 CA PHE A 56 13959 11116 10442 5695 868 -1654 C -ATOM 440 C PHE A 56 28.771 87.121 30.820 1.00102.11 C -ANISOU 440 C PHE A 56 15507 11689 11602 5822 820 -1787 C -ATOM 441 O PHE A 56 29.419 87.235 31.860 1.00102.05 O -ANISOU 441 O PHE A 56 15621 11545 11609 5670 784 -1993 O -ATOM 442 CB PHE A 56 29.456 85.122 29.431 1.00 92.07 C -ANISOU 442 CB PHE A 56 13721 10872 10388 5289 836 -1477 C -ATOM 443 CG PHE A 56 29.257 83.690 28.993 1.00 89.70 C -ANISOU 443 CG PHE A 56 13039 10999 10045 5122 854 -1388 C -ATOM 444 CD1 PHE A 56 28.797 82.728 29.886 1.00 90.95 C -ANISOU 444 CD1 PHE A 56 12970 11475 10112 5073 907 -1489 C -ATOM 445 CD2 PHE A 56 29.569 83.293 27.698 1.00 90.41 C -ANISOU 445 CD2 PHE A 56 13033 11144 10175 5002 828 -1204 C -ATOM 446 CE1 PHE A 56 28.611 81.405 29.477 1.00 90.09 C -ANISOU 446 CE1 PHE A 56 12566 11674 9991 4886 927 -1413 C -ATOM 447 CE2 PHE A 56 29.381 81.970 27.287 1.00 90.73 C -ANISOU 447 CE2 PHE A 56 12756 11534 10183 4855 822 -1168 C -ATOM 448 CZ PHE A 56 28.916 81.032 28.182 1.00 88.02 C -ANISOU 448 CZ PHE A 56 12215 11440 9789 4778 867 -1277 C -ATOM 449 N ILE A 57 28.372 88.181 30.071 1.00102.57 N -ANISOU 449 N ILE A 57 15841 11443 11686 6117 809 -1682 N -ATOM 450 CA ILE A 57 28.653 89.582 30.428 1.00106.51 C -ANISOU 450 CA ILE A 57 16850 11351 12267 6257 767 -1802 C -ATOM 451 C ILE A 57 27.874 89.952 31.698 1.00113.19 C -ANISOU 451 C ILE A 57 17747 12297 12963 6647 756 -2107 C -ATOM 452 O ILE A 57 28.437 90.596 32.582 1.00115.25 O -ANISOU 452 O ILE A 57 18305 12205 13280 6578 696 -2350 O -ATOM 453 CB ILE A 57 28.421 90.582 29.252 1.00112.79 C -ANISOU 453 CB ILE A 57 18007 11747 13102 6510 773 -1562 C -ATOM 454 CG1 ILE A 57 29.160 90.130 27.975 1.00111.31 C -ANISOU 454 CG1 ILE A 57 17733 11561 13000 6151 816 -1242 C -ATOM 455 CG2 ILE A 57 28.864 92.000 29.638 1.00118.04 C -ANISOU 455 CG2 ILE A 57 19274 11675 13901 6554 740 -1682 C -ATOM 456 CD1 ILE A 57 28.541 90.597 26.671 1.00121.77 C -ANISOU 456 CD1 ILE A 57 19216 12830 14222 6524 835 -946 C -ATOM 457 N VAL A 58 26.603 89.501 31.802 1.00109.67 N -ANISOU 457 N VAL A 58 16973 12378 12319 7035 815 -2121 N -ATOM 458 CA VAL A 58 25.728 89.720 32.963 1.00111.82 C -ANISOU 458 CA VAL A 58 17199 12892 12395 7446 853 -2392 C -ATOM 459 C VAL A 58 26.323 88.982 34.170 1.00114.58 C -ANISOU 459 C VAL A 58 17414 13434 12686 7124 883 -2566 C -ATOM 460 O VAL A 58 26.443 89.572 35.245 1.00116.64 O -ANISOU 460 O VAL A 58 17905 13559 12854 7297 853 -2844 O -ATOM 461 CB VAL A 58 24.258 89.298 32.671 1.00116.31 C -ANISOU 461 CB VAL A 58 17343 14070 12778 7871 938 -2348 C -ATOM 462 CG1 VAL A 58 23.386 89.385 33.920 1.00119.15 C -ANISOU 462 CG1 VAL A 58 17594 14766 12910 8280 1024 -2625 C -ATOM 463 CG2 VAL A 58 23.655 90.134 31.545 1.00118.68 C -ANISOU 463 CG2 VAL A 58 17808 14203 13083 8288 868 -2195 C -ATOM 464 N GLU A 59 26.742 87.713 33.963 1.00107.81 N -ANISOU 464 N GLU A 59 16234 12859 11869 6684 923 -2409 N -ATOM 465 CA GLU A 59 27.366 86.844 34.966 1.00106.01 C -ANISOU 465 CA GLU A 59 15891 12825 11561 6387 945 -2507 C -ATOM 466 C GLU A 59 28.616 87.493 35.583 1.00111.33 C -ANISOU 466 C GLU A 59 16924 13052 12324 6193 799 -2717 C -ATOM 467 O GLU A 59 28.705 87.564 36.810 1.00113.03 O -ANISOU 467 O GLU A 59 17230 13345 12372 6304 781 -2966 O -ATOM 468 CB GLU A 59 27.707 85.470 34.353 1.00103.34 C -ANISOU 468 CB GLU A 59 15222 12760 11282 5985 987 -2274 C -ATOM 469 CG GLU A 59 28.362 84.488 35.317 1.00113.10 C -ANISOU 469 CG GLU A 59 16384 14176 12412 5724 1004 -2330 C -ATOM 470 CD GLU A 59 29.461 83.608 34.745 1.00134.66 C -ANISOU 470 CD GLU A 59 19033 16858 15273 5296 931 -2186 C -ATOM 471 OE1 GLU A 59 29.754 83.714 33.531 1.00129.44 O -ANISOU 471 OE1 GLU A 59 18345 16043 14791 5156 883 -2035 O -ATOM 472 OE2 GLU A 59 30.040 82.815 35.522 1.00127.21 O -ANISOU 472 OE2 GLU A 59 18068 16047 14221 5143 922 -2227 O -ATOM 473 N ILE A 60 29.563 87.965 34.738 1.00107.18 N -ANISOU 473 N ILE A 60 16585 12092 12047 5900 702 -2630 N -ATOM 474 CA ILE A 60 30.810 88.603 35.176 1.00108.52 C -ANISOU 474 CA ILE A 60 17038 11832 12362 5620 560 -2842 C -ATOM 475 C ILE A 60 30.503 89.931 35.890 1.00116.91 C -ANISOU 475 C ILE A 60 18510 12511 13401 5954 492 -3142 C -ATOM 476 O ILE A 60 31.062 90.183 36.962 1.00118.22 O -ANISOU 476 O ILE A 60 18814 12589 13514 5904 378 -3470 O -ATOM 477 CB ILE A 60 31.859 88.720 34.015 1.00110.77 C -ANISOU 477 CB ILE A 60 17359 11807 12922 5178 531 -2642 C -ATOM 478 CG1 ILE A 60 32.294 87.328 33.460 1.00106.69 C -ANISOU 478 CG1 ILE A 60 16445 11697 12397 4879 570 -2419 C -ATOM 479 CG2 ILE A 60 33.084 89.567 34.387 1.00114.45 C -ANISOU 479 CG2 ILE A 60 18096 11804 13587 4847 402 -2887 C -ATOM 480 CD1 ILE A 60 32.905 86.286 34.476 1.00112.71 C -ANISOU 480 CD1 ILE A 60 16996 12805 13024 4716 506 -2574 C -ATOM 481 N SER A 61 29.561 90.733 35.339 1.00115.24 N -ANISOU 481 N SER A 61 18486 12113 13185 6358 545 -3056 N -ATOM 482 CA SER A 61 29.133 92.008 35.924 1.00119.65 C -ANISOU 482 CA SER A 61 19477 12280 13704 6777 481 -3333 C -ATOM 483 C SER A 61 28.499 91.811 37.300 1.00124.40 C -ANISOU 483 C SER A 61 19982 13285 13999 7144 494 -3641 C -ATOM 484 O SER A 61 28.704 92.646 38.186 1.00128.11 O -ANISOU 484 O SER A 61 20798 13451 14429 7311 380 -4005 O -ATOM 485 CB SER A 61 28.177 92.739 34.993 1.00125.08 C -ANISOU 485 CB SER A 61 20346 12780 14397 7220 536 -3137 C -ATOM 486 OG SER A 61 28.818 93.021 33.760 1.00132.96 O -ANISOU 486 OG SER A 61 21520 13359 15641 6901 539 -2844 O -ATOM 487 N LEU A 62 27.763 90.691 37.489 1.00117.34 N -ANISOU 487 N LEU A 62 18628 13071 12883 7242 642 -3502 N -ATOM 488 CA LEU A 62 27.151 90.345 38.770 1.00118.16 C -ANISOU 488 CA LEU A 62 18595 13644 12655 7548 722 -3722 C -ATOM 489 C LEU A 62 28.230 89.966 39.781 1.00122.11 C -ANISOU 489 C LEU A 62 19157 14153 13086 7244 615 -3935 C -ATOM 490 O LEU A 62 28.099 90.296 40.961 1.00124.97 O -ANISOU 490 O LEU A 62 19668 14611 13202 7531 582 -4257 O -ATOM 491 CB LEU A 62 26.118 89.213 38.625 1.00115.71 C -ANISOU 491 CB LEU A 62 17774 14025 12164 7637 947 -3479 C -ATOM 492 CG LEU A 62 24.693 89.616 38.205 1.00122.88 C -ANISOU 492 CG LEU A 62 18531 15182 12974 8159 1062 -3436 C -ATOM 493 CD1 LEU A 62 23.849 88.398 37.936 1.00120.97 C -ANISOU 493 CD1 LEU A 62 17723 15606 12634 8069 1271 -3202 C -ATOM 494 CD2 LEU A 62 24.002 90.473 39.261 1.00128.99 C -ANISOU 494 CD2 LEU A 62 19498 16026 13488 8753 1083 -3781 C -ATOM 495 N LYS A 63 29.309 89.305 39.302 1.00115.30 N -ANISOU 495 N LYS A 63 18179 13217 12413 6709 545 -3777 N -ATOM 496 CA LYS A 63 30.461 88.889 40.106 1.00114.55 C -ANISOU 496 CA LYS A 63 18101 13158 12265 6415 403 -3969 C -ATOM 497 C LYS A 63 31.325 90.092 40.511 1.00122.22 C -ANISOU 497 C LYS A 63 19464 13588 13387 6340 168 -4363 C -ATOM 498 O LYS A 63 31.788 90.134 41.647 1.00123.70 O -ANISOU 498 O LYS A 63 19747 13870 13382 6409 35 -4707 O -ATOM 499 CB LYS A 63 31.309 87.845 39.362 1.00112.61 C -ANISOU 499 CB LYS A 63 17588 13020 12178 5924 395 -3692 C -ATOM 500 CG LYS A 63 30.717 86.445 39.344 1.00120.81 C -ANISOU 500 CG LYS A 63 18279 14595 13030 5930 584 -3399 C -ATOM 501 CD LYS A 63 31.619 85.500 38.574 1.00125.82 C -ANISOU 501 CD LYS A 63 18714 15263 13831 5494 543 -3170 C -ATOM 502 CE LYS A 63 31.073 84.099 38.502 1.00131.97 C -ANISOU 502 CE LYS A 63 19207 16472 14462 5461 717 -2890 C -ATOM 503 NZ LYS A 63 31.906 83.243 37.615 1.00136.71 N -ANISOU 503 NZ LYS A 63 19648 17063 15235 5093 663 -2688 N -ATOM 504 N ILE A 64 31.539 91.069 39.595 1.00120.66 N -ANISOU 504 N ILE A 64 19512 12813 13520 6201 119 -4321 N -ATOM 505 CA ILE A 64 32.322 92.281 39.890 1.00125.40 C -ANISOU 505 CA ILE A 64 20523 12799 14327 6058 -82 -4690 C -ATOM 506 C ILE A 64 31.577 93.136 40.941 1.00135.55 C -ANISOU 506 C ILE A 64 22135 13989 15379 6615 -141 -5085 C -ATOM 507 O ILE A 64 32.219 93.800 41.758 1.00139.27 O -ANISOU 507 O ILE A 64 22867 14187 15864 6561 -348 -5536 O -ATOM 508 CB ILE A 64 32.723 93.079 38.606 1.00129.51 C -ANISOU 508 CB ILE A 64 21274 12684 15249 5744 -64 -4481 C -ATOM 509 CG1 ILE A 64 33.544 92.205 37.637 1.00125.37 C -ANISOU 509 CG1 ILE A 64 20401 12325 14909 5209 -4 -4136 C -ATOM 510 CG2 ILE A 64 33.505 94.363 38.949 1.00136.14 C -ANISOU 510 CG2 ILE A 64 22573 12818 16336 5534 -249 -4877 C -ATOM 511 CD1 ILE A 64 33.649 92.735 36.198 1.00132.95 C -ANISOU 511 CD1 ILE A 64 21517 12841 16157 4998 107 -3780 C -ATOM 512 N TYR A 65 30.229 93.070 40.950 1.00132.79 N -ANISOU 512 N TYR A 65 21727 13930 14795 7160 33 -4950 N -ATOM 513 CA TYR A 65 29.393 93.790 41.910 1.00137.41 C -ANISOU 513 CA TYR A 65 22564 14542 15102 7778 16 -5303 C -ATOM 514 C TYR A 65 29.450 93.125 43.298 1.00141.49 C -ANISOU 514 C TYR A 65 22911 15628 15220 7923 1 -5560 C -ATOM 515 O TYR A 65 29.893 93.762 44.253 1.00145.46 O -ANISOU 515 O TYR A 65 23707 15939 15622 8034 -196 -6031 O -ATOM 516 CB TYR A 65 27.942 93.907 41.391 1.00139.11 C -ANISOU 516 CB TYR A 65 22690 14978 15189 8321 219 -5072 C -ATOM 517 CG TYR A 65 27.047 94.782 42.241 1.00146.55 C -ANISOU 517 CG TYR A 65 23910 15912 15860 9026 205 -5444 C -ATOM 518 CD1 TYR A 65 27.019 96.162 42.066 1.00153.89 C -ANISOU 518 CD1 TYR A 65 25403 16113 16955 9289 57 -5684 C -ATOM 519 CD2 TYR A 65 26.213 94.230 43.209 1.00147.96 C -ANISOU 519 CD2 TYR A 65 23808 16806 15604 9443 360 -5548 C -ATOM 520 CE1 TYR A 65 26.203 96.976 42.852 1.00160.86 C -ANISOU 520 CE1 TYR A 65 26569 16980 17571 9999 27 -6063 C -ATOM 521 CE2 TYR A 65 25.397 95.032 44.006 1.00154.59 C -ANISOU 521 CE2 TYR A 65 24880 17699 16157 10135 359 -5914 C -ATOM 522 CZ TYR A 65 25.390 96.407 43.820 1.00167.86 C -ANISOU 522 CZ TYR A 65 27125 18652 18004 10439 176 -6189 C -ATOM 523 OH TYR A 65 24.580 97.209 44.592 1.00173.45 O -ANISOU 523 OH TYR A 65 27958 19393 18552 10967 236 -6522 O -ATOM 524 N ALA A 66 29.029 91.844 43.393 1.00134.01 N -ANISOU 524 N ALA A 66 21521 15355 14041 7907 206 -5252 N -ATOM 525 CA ALA A 66 28.964 91.044 44.624 1.00134.00 C -ANISOU 525 CA ALA A 66 21361 15945 13609 8063 267 -5367 C -ATOM 526 C ALA A 66 30.300 90.815 45.344 1.00138.45 C -ANISOU 526 C ALA A 66 22005 16465 14136 7745 18 -5628 C -ATOM 527 O ALA A 66 30.280 90.511 46.535 1.00140.47 O -ANISOU 527 O ALA A 66 22281 17111 13980 8003 4 -5842 O -ATOM 528 CB ALA A 66 28.295 89.706 44.342 1.00130.66 C -ANISOU 528 CB ALA A 66 20486 16121 13036 8000 562 -4908 C -ATOM 529 N TYR A 67 31.444 90.932 44.642 1.00133.33 N -ANISOU 529 N TYR A 67 21376 15405 13877 7213 -170 -5613 N -ATOM 530 CA TYR A 67 32.769 90.711 45.238 1.00133.62 C -ANISOU 530 CA TYR A 67 21412 15457 13903 6900 -433 -5891 C -ATOM 531 C TYR A 67 33.641 91.967 45.320 1.00143.66 C -ANISOU 531 C TYR A 67 23007 16112 15465 6691 -735 -6371 C -ATOM 532 O TYR A 67 34.542 92.026 46.160 1.00146.19 O -ANISOU 532 O TYR A 67 23366 16503 15675 6599 -996 -6784 O -ATOM 533 CB TYR A 67 33.537 89.587 44.500 1.00128.84 C -ANISOU 533 CB TYR A 67 20459 15031 13461 6416 -406 -5521 C -ATOM 534 CG TYR A 67 32.876 88.229 44.578 1.00125.66 C -ANISOU 534 CG TYR A 67 19775 15205 12765 6552 -150 -5108 C -ATOM 535 CD1 TYR A 67 33.027 87.420 45.700 1.00127.91 C -ANISOU 535 CD1 TYR A 67 20020 15965 12617 6741 -161 -5177 C -ATOM 536 CD2 TYR A 67 32.115 87.741 43.521 1.00122.80 C -ANISOU 536 CD2 TYR A 67 19207 14898 12554 6479 101 -4653 C -ATOM 537 CE1 TYR A 67 32.408 86.174 45.782 1.00125.73 C -ANISOU 537 CE1 TYR A 67 19542 16144 12086 6822 107 -4772 C -ATOM 538 CE2 TYR A 67 31.496 86.496 43.588 1.00120.96 C -ANISOU 538 CE2 TYR A 67 18722 15146 12091 6537 341 -4302 C -ATOM 539 CZ TYR A 67 31.645 85.715 44.721 1.00128.96 C -ANISOU 539 CZ TYR A 67 19734 16564 12699 6685 360 -4347 C -ATOM 540 OH TYR A 67 31.041 84.485 44.782 1.00128.30 O -ANISOU 540 OH TYR A 67 19455 16881 12410 6694 626 -3974 O -ATOM 541 N GLY A 68 33.383 92.937 44.445 1.00142.43 N -ANISOU 541 N GLY A 68 23089 15361 15669 6614 -702 -6317 N -ATOM 542 CA GLY A 68 34.179 94.154 44.335 1.00147.38 C -ANISOU 542 CA GLY A 68 24066 15278 16654 6320 -936 -6701 C -ATOM 543 C GLY A 68 35.198 93.981 43.226 1.00149.97 C -ANISOU 543 C GLY A 68 24216 15342 17426 5628 -942 -6445 C -ATOM 544 O GLY A 68 35.476 92.850 42.825 1.00144.35 O -ANISOU 544 O GLY A 68 23098 15071 16675 5418 -843 -6094 O -ATOM 545 N VAL A 69 35.759 95.082 42.710 1.00151.49 N -ANISOU 545 N VAL A 69 24719 14804 18034 5265 -1037 -6609 N -ATOM 546 CA VAL A 69 36.730 95.016 41.610 1.00150.34 C -ANISOU 546 CA VAL A 69 24409 14402 18309 4584 -995 -6354 C -ATOM 547 C VAL A 69 38.176 94.704 42.102 1.00155.81 C -ANISOU 547 C VAL A 69 24803 15301 19098 4064 -1241 -6713 C -ATOM 548 O VAL A 69 39.033 94.372 41.279 1.00153.57 O -ANISOU 548 O VAL A 69 24233 15033 19082 3525 -1190 -6494 O -ATOM 549 CB VAL A 69 36.643 96.296 40.723 1.00158.53 C -ANISOU 549 CB VAL A 69 25926 14560 19750 4397 -915 -6263 C -ATOM 550 CG1 VAL A 69 37.382 97.482 41.342 1.00165.85 C -ANISOU 550 CG1 VAL A 69 27235 14850 20930 4102 -1161 -6854 C -ATOM 551 CG2 VAL A 69 37.117 96.031 39.297 1.00155.56 C -ANISOU 551 CG2 VAL A 69 25366 14059 19680 3900 -713 -5739 C -ATOM 552 N ARG A 70 38.425 94.780 43.433 1.00156.04 N -ANISOU 552 N ARG A 70 24868 15553 18868 4272 -1509 -7270 N -ATOM 553 CA ARG A 70 39.749 94.584 44.041 1.00158.33 C -ANISOU 553 CA ARG A 70 24880 16081 19198 3875 -1806 -7716 C -ATOM 554 C ARG A 70 40.360 93.149 43.913 1.00157.02 C -ANISOU 554 C ARG A 70 24149 16654 18858 3754 -1796 -7453 C -ATOM 555 O ARG A 70 41.525 93.075 43.523 1.00157.65 O -ANISOU 555 O ARG A 70 23932 16753 19215 3199 -1904 -7551 O -ATOM 556 CB ARG A 70 39.793 95.049 45.507 1.00164.45 C -ANISOU 556 CB ARG A 70 25866 16939 19680 4214 -2122 -8404 C -ATOM 557 CG ARG A 70 41.180 95.541 45.921 1.00183.34 C -ANISOU 557 CG ARG A 70 28136 19197 22328 3664 -2475 -9014 C -ATOM 558 CD ARG A 70 41.242 96.020 47.358 1.00202.09 C -ANISOU 558 CD ARG A 70 30671 21718 24396 3767 -2567 -9523 C -ATOM 559 NE ARG A 70 42.582 96.505 47.699 1.00214.40 N -ANISOU 559 NE ARG A 70 32064 23284 26112 2346 -1963 -9247 N -ATOM 560 CZ ARG A 70 42.958 96.903 48.911 1.00228.19 C -ANISOU 560 CZ ARG A 70 33948 25281 27474 1231 -947 -8605 C -ATOM 561 NH1 ARG A 70 42.099 96.877 49.923 1.00221.49 N -ANISOU 561 NH1 ARG A 70 33198 24619 26339 2127 -1308 -9135 N -ATOM 562 NH2 ARG A 70 44.197 97.327 49.121 1.00222.52 N -ANISOU 562 NH2 ARG A 70 33311 24455 26783 832 -1384 -9101 N -ATOM 563 N GLY A 71 39.700 92.048 44.303 1.00148.79 N -ANISOU 563 N GLY A 71 22957 16209 17367 4236 -1690 -7180 N -ATOM 564 CA GLY A 71 38.325 91.835 44.744 1.00146.78 C -ANISOU 564 CA GLY A 71 22904 16131 16732 4872 -1504 -6990 C -ATOM 565 C GLY A 71 37.881 90.585 44.016 1.00144.33 C -ANISOU 565 C GLY A 71 22293 16224 16323 4914 -1232 -6367 C -ATOM 566 O GLY A 71 38.159 89.461 44.451 1.00141.63 O -ANISOU 566 O GLY A 71 21698 16429 15685 5014 -1262 -6276 O -ATOM 567 N PHE A 72 37.294 90.785 42.832 1.00137.84 N -ANISOU 567 N PHE A 72 21510 15096 15768 4807 -987 -5945 N -ATOM 568 CA PHE A 72 36.917 89.728 41.902 1.00131.26 C -ANISOU 568 CA PHE A 72 20395 14547 14932 4761 -745 -5380 C -ATOM 569 C PHE A 72 38.223 89.384 41.194 1.00134.17 C -ANISOU 569 C PHE A 72 20481 14913 15585 4205 -835 -5324 C -ATOM 570 O PHE A 72 38.550 88.208 41.044 1.00130.64 O -ANISOU 570 O PHE A 72 19725 14897 15014 4156 -805 -5099 O -ATOM 571 CB PHE A 72 35.852 90.255 40.918 1.00131.64 C -ANISOU 571 CB PHE A 72 20609 14264 15144 4893 -504 -5039 C -ATOM 572 CG PHE A 72 35.783 89.644 39.539 1.00128.26 C -ANISOU 572 CG PHE A 72 19953 13867 14912 4649 -315 -4533 C -ATOM 573 CD1 PHE A 72 36.516 90.181 38.486 1.00131.65 C -ANISOU 573 CD1 PHE A 72 20414 13884 15723 4200 -312 -4430 C -ATOM 574 CD2 PHE A 72 34.918 88.592 39.270 1.00125.74 C -ANISOU 574 CD2 PHE A 72 19411 13972 14393 4871 -123 -4166 C -ATOM 575 CE1 PHE A 72 36.428 89.640 37.203 1.00128.84 C -ANISOU 575 CE1 PHE A 72 19867 13590 15497 4030 -137 -3975 C -ATOM 576 CE2 PHE A 72 34.815 88.064 37.983 1.00124.98 C -ANISOU 576 CE2 PHE A 72 19120 13904 14462 4677 23 -3751 C -ATOM 577 CZ PHE A 72 35.580 88.583 36.960 1.00123.68 C -ANISOU 577 CZ PHE A 72 18992 13372 14630 4286 8 -3660 C -ATOM 578 N PHE A 73 39.008 90.429 40.840 1.00134.23 N -ANISOU 578 N PHE A 73 20603 14433 15965 3786 -947 -5564 N -ATOM 579 CA PHE A 73 40.299 90.323 40.159 1.00134.18 C -ANISOU 579 CA PHE A 73 20309 14408 16267 3204 -1009 -5564 C -ATOM 580 C PHE A 73 41.420 89.728 41.036 1.00138.21 C -ANISOU 580 C PHE A 73 20502 15394 16619 3107 -1294 -5947 C -ATOM 581 O PHE A 73 42.535 89.537 40.542 1.00138.21 O -ANISOU 581 O PHE A 73 20176 15502 16836 2660 -1358 -5984 O -ATOM 582 CB PHE A 73 40.707 91.677 39.551 1.00140.68 C -ANISOU 582 CB PHE A 73 21382 14532 17538 2757 -993 -5685 C -ATOM 583 CG PHE A 73 39.943 92.003 38.288 1.00140.57 C -ANISOU 583 CG PHE A 73 21570 14140 17702 2761 -695 -5172 C -ATOM 584 CD1 PHE A 73 40.298 91.429 37.071 1.00140.18 C -ANISOU 584 CD1 PHE A 73 21246 14225 17790 2470 -512 -4737 C -ATOM 585 CD2 PHE A 73 38.857 92.870 38.316 1.00144.73 C -ANISOU 585 CD2 PHE A 73 22563 14215 18214 3120 -613 -5138 C -ATOM 586 CE1 PHE A 73 39.583 91.720 35.907 1.00139.79 C -ANISOU 586 CE1 PHE A 73 21392 13873 17848 2529 -260 -4273 C -ATOM 587 CE2 PHE A 73 38.141 93.159 37.149 1.00146.23 C -ANISOU 587 CE2 PHE A 73 22941 14102 18520 3199 -367 -4668 C -ATOM 588 CZ PHE A 73 38.510 92.584 35.952 1.00140.93 C -ANISOU 588 CZ PHE A 73 21999 13578 17971 2898 -197 -4237 C -ATOM 589 N ARG A 74 41.110 89.393 42.309 1.00134.68 N -ANISOU 589 N ARG A 74 20132 15285 15756 3564 -1451 -6211 N -ATOM 590 CA ARG A 74 42.042 88.764 43.249 1.00135.52 C -ANISOU 590 CA ARG A 74 19988 15903 15602 3626 -1743 -6565 C -ATOM 591 C ARG A 74 42.285 87.295 42.866 1.00133.23 C -ANISOU 591 C ARG A 74 19369 16127 15127 3706 -1662 -6174 C -ATOM 592 O ARG A 74 43.353 86.759 43.167 1.00134.38 O -ANISOU 592 O ARG A 74 19220 16662 15178 3633 -1891 -6391 O -ATOM 593 CB ARG A 74 41.515 88.867 44.689 1.00138.66 C -ANISOU 593 CB ARG A 74 20644 16490 15550 4160 -1900 -6914 C -ATOM 594 N SER A 75 41.297 86.659 42.191 1.00123.22 N -ANISOU 594 N SER A 75 18152 14858 13808 3871 -1353 -5629 N -ATOM 595 CA SER A 75 41.356 85.272 41.718 1.00117.83 C -ANISOU 595 CA SER A 75 17233 14556 12982 3945 -1242 -5226 C -ATOM 596 C SER A 75 41.859 85.205 40.271 1.00117.78 C -ANISOU 596 C SER A 75 16984 14409 13360 3506 -1116 -4954 C -ATOM 597 O SER A 75 41.438 86.008 39.431 1.00117.31 O -ANISOU 597 O SER A 75 17047 13931 13596 3297 -944 -4796 O -ATOM 598 CB SER A 75 39.981 84.613 41.821 1.00117.65 C -ANISOU 598 CB SER A 75 17385 14625 12691 4335 -983 -4837 C -ATOM 599 OG SER A 75 39.965 83.296 41.291 1.00120.54 O -ANISOU 599 OG SER A 75 17573 15251 12976 4354 -857 -4442 O -ATOM 600 N GLY A 76 42.737 84.237 40.001 1.00111.06 N -ANISOU 600 N GLY A 76 15814 13925 12460 3426 -1199 -4894 N -ATOM 601 CA GLY A 76 43.303 84.000 38.676 1.00107.98 C -ANISOU 601 CA GLY A 76 15149 13523 12355 3068 -1082 -4650 C -ATOM 602 C GLY A 76 42.291 83.433 37.699 1.00105.05 C -ANISOU 602 C GLY A 76 14859 13059 11997 3166 -791 -4131 C -ATOM 603 O GLY A 76 42.406 83.641 36.485 1.00103.59 O -ANISOU 603 O GLY A 76 14573 12712 12074 2884 -635 -3902 O -ATOM 604 N TRP A 77 41.292 82.704 38.234 1.00 97.52 N -ANISOU 604 N TRP A 77 14079 12230 10742 3561 -711 -3951 N -ATOM 605 CA TRP A 77 40.209 82.082 37.472 1.00 92.76 C -ANISOU 605 CA TRP A 77 13530 11592 10123 3674 -459 -3516 C -ATOM 606 C TRP A 77 39.161 83.107 37.065 1.00 96.76 C -ANISOU 606 C TRP A 77 14240 11733 10791 3671 -288 -3412 C -ATOM 607 O TRP A 77 38.510 82.931 36.037 1.00 93.96 O -ANISOU 607 O TRP A 77 13855 11300 10545 3637 -107 -3093 O -ATOM 608 CB TRP A 77 39.576 80.943 38.275 1.00 89.57 C -ANISOU 608 CB TRP A 77 13222 11458 9354 4036 -421 -3387 C -ATOM 609 CG TRP A 77 40.512 79.796 38.488 1.00 89.73 C -ANISOU 609 CG TRP A 77 13099 11795 9200 4105 -570 -3404 C -ATOM 610 CD1 TRP A 77 41.246 79.532 39.606 1.00 94.86 C -ANISOU 610 CD1 TRP A 77 13768 12691 9584 4302 -801 -3679 C -ATOM 611 CD2 TRP A 77 40.884 78.811 37.519 1.00 86.87 C -ANISOU 611 CD2 TRP A 77 12558 11543 8906 4018 -529 -3171 C -ATOM 612 NE1 TRP A 77 42.028 78.420 39.407 1.00 93.44 N -ANISOU 612 NE1 TRP A 77 13444 12765 9295 4376 -903 -3608 N -ATOM 613 CE2 TRP A 77 41.840 77.967 38.126 1.00 91.76 C -ANISOU 613 CE2 TRP A 77 13110 12460 9295 4196 -737 -3309 C -ATOM 614 CE3 TRP A 77 40.509 78.563 36.188 1.00 85.15 C -ANISOU 614 CE3 TRP A 77 12241 11219 8895 3851 -354 -2880 C -ATOM 615 CZ2 TRP A 77 42.389 76.863 37.462 1.00 89.33 C -ANISOU 615 CZ2 TRP A 77 12663 12313 8966 4228 -763 -3159 C -ATOM 616 CZ3 TRP A 77 41.053 77.468 35.533 1.00 84.73 C -ANISOU 616 CZ3 TRP A 77 12039 11336 8819 3855 -381 -2750 C -ATOM 617 CH2 TRP A 77 41.977 76.632 36.169 1.00 86.54 C -ANISOU 617 CH2 TRP A 77 12225 11827 8828 4046 -578 -2888 C -ATOM 618 N ASN A 78 38.992 84.173 37.865 1.00 96.62 N -ANISOU 618 N ASN A 78 14441 11502 10767 3750 -365 -3703 N -ATOM 619 CA ASN A 78 38.059 85.249 37.540 1.00 97.65 C -ANISOU 619 CA ASN A 78 14816 11251 11037 3815 -234 -3650 C -ATOM 620 C ASN A 78 38.639 86.124 36.424 1.00102.87 C -ANISOU 620 C ASN A 78 15484 11531 12069 3428 -199 -3591 C -ATOM 621 O ASN A 78 37.901 86.517 35.517 1.00101.70 O -ANISOU 621 O ASN A 78 15451 11153 12038 3465 -27 -3317 O -ATOM 622 CB ASN A 78 37.726 86.085 38.770 1.00100.70 C -ANISOU 622 CB ASN A 78 15468 11513 11280 4060 -341 -4013 C -ATOM 623 CG ASN A 78 36.748 85.451 39.731 1.00121.68 C -ANISOU 623 CG ASN A 78 18190 14494 13551 4503 -264 -3979 C -ATOM 624 OD1 ASN A 78 36.867 85.604 40.949 1.00121.15 O -ANISOU 624 OD1 ASN A 78 18241 14556 13235 4715 -399 -4293 O -ATOM 625 ND2 ASN A 78 35.727 84.769 39.219 1.00108.96 N -ANISOU 625 ND2 ASN A 78 16500 13031 11868 4648 -37 -3614 N -ATOM 626 N LEU A 79 39.966 86.395 36.481 1.00101.42 N -ANISOU 626 N LEU A 79 15163 11319 12053 3061 -353 -3840 N -ATOM 627 CA LEU A 79 40.700 87.181 35.491 1.00103.34 C -ANISOU 627 CA LEU A 79 15381 11233 12649 2604 -289 -3789 C -ATOM 628 C LEU A 79 40.628 86.482 34.133 1.00105.77 C -ANISOU 628 C LEU A 79 15497 11684 13004 2520 -94 -3343 C -ATOM 629 O LEU A 79 40.339 87.132 33.129 1.00106.26 O -ANISOU 629 O LEU A 79 15712 11418 13245 2398 80 -3090 O -ATOM 630 CB LEU A 79 42.162 87.379 35.937 1.00106.44 C -ANISOU 630 CB LEU A 79 15539 11729 13176 2216 -494 -4180 C -ATOM 631 CG LEU A 79 43.061 88.196 35.005 1.00114.12 C -ANISOU 631 CG LEU A 79 16434 12395 14530 1644 -397 -4155 C -ATOM 632 CD1 LEU A 79 42.938 89.676 35.277 1.00119.46 C -ANISOU 632 CD1 LEU A 79 17503 12439 15449 1451 -410 -4382 C -ATOM 633 CD2 LEU A 79 44.504 87.776 35.140 1.00118.25 C -ANISOU 633 CD2 LEU A 79 16491 13319 15118 1300 -550 -4419 C -ATOM 634 N PHE A 80 40.853 85.154 34.122 1.00100.35 N -ANISOU 634 N PHE A 80 14523 11476 12130 2631 -130 -3250 N -ATOM 635 CA PHE A 80 40.799 84.289 32.945 1.00 97.42 C -ANISOU 635 CA PHE A 80 13957 11309 11750 2611 12 -2891 C -ATOM 636 C PHE A 80 39.397 84.341 32.327 1.00 98.80 C -ANISOU 636 C PHE A 80 14326 11336 11875 2868 188 -2572 C -ATOM 637 O PHE A 80 39.275 84.536 31.120 1.00 98.24 O -ANISOU 637 O PHE A 80 14254 11157 11915 2767 334 -2301 O -ATOM 638 CB PHE A 80 41.205 82.855 33.343 1.00 97.40 C -ANISOU 638 CB PHE A 80 13705 11782 11519 2769 -103 -2925 C -ATOM 639 CG PHE A 80 40.838 81.743 32.386 1.00 96.06 C -ANISOU 639 CG PHE A 80 13407 11821 11268 2876 13 -2598 C -ATOM 640 CD1 PHE A 80 41.662 81.429 31.312 1.00 99.55 C -ANISOU 640 CD1 PHE A 80 13605 12411 11808 2666 58 -2489 C -ATOM 641 CD2 PHE A 80 39.695 80.978 32.589 1.00 96.23 C -ANISOU 641 CD2 PHE A 80 13535 11920 11107 3177 76 -2430 C -ATOM 642 CE1 PHE A 80 41.335 80.386 30.442 1.00 98.15 C -ANISOU 642 CE1 PHE A 80 13331 12424 11538 2793 135 -2240 C -ATOM 643 CE2 PHE A 80 39.358 79.946 31.710 1.00 96.85 C -ANISOU 643 CE2 PHE A 80 13502 12162 11133 3240 157 -2182 C -ATOM 644 CZ PHE A 80 40.189 79.646 30.652 1.00 95.00 C -ANISOU 644 CZ PHE A 80 13062 12049 10984 3070 169 -2103 C -ATOM 645 N ASP A 81 38.350 84.204 33.162 1.00 94.56 N -ANISOU 645 N ASP A 81 13941 10834 11154 3214 177 -2618 N -ATOM 646 CA ASP A 81 36.947 84.264 32.751 1.00 93.36 C -ANISOU 646 CA ASP A 81 13912 10627 10934 3497 322 -2388 C -ATOM 647 C ASP A 81 36.605 85.626 32.177 1.00 99.00 C -ANISOU 647 C ASP A 81 14895 10899 11823 3489 400 -2326 C -ATOM 648 O ASP A 81 35.859 85.698 31.200 1.00 97.75 O -ANISOU 648 O ASP A 81 14768 10701 11671 3619 521 -2054 O -ATOM 649 CB ASP A 81 36.014 83.947 33.935 1.00 95.67 C -ANISOU 649 CB ASP A 81 14278 11086 10988 3836 312 -2504 C -ATOM 650 CG ASP A 81 35.876 82.469 34.254 1.00105.36 C -ANISOU 650 CG ASP A 81 15311 12710 12011 3917 323 -2412 C -ATOM 651 OD1 ASP A 81 36.073 81.643 33.335 1.00103.34 O -ANISOU 651 OD1 ASP A 81 14875 12589 11800 3796 360 -2210 O -ATOM 652 OD2 ASP A 81 35.517 82.140 35.411 1.00112.30 O -ANISOU 652 OD2 ASP A 81 16253 13748 12669 4118 310 -2530 O -ATOM 653 N PHE A 82 37.159 86.703 32.787 1.00 98.73 N -ANISOU 653 N PHE A 82 15078 10517 11920 3349 315 -2591 N -ATOM 654 CA PHE A 82 36.961 88.091 32.365 1.00101.54 C -ANISOU 654 CA PHE A 82 15788 10332 12462 3317 379 -2561 C -ATOM 655 C PHE A 82 37.613 88.318 31.006 1.00106.46 C -ANISOU 655 C PHE A 82 16380 10791 13278 2976 509 -2276 C -ATOM 656 O PHE A 82 36.938 88.796 30.099 1.00106.88 O -ANISOU 656 O PHE A 82 16634 10632 13345 3135 641 -1990 O -ATOM 657 CB PHE A 82 37.494 89.093 33.417 1.00106.99 C -ANISOU 657 CB PHE A 82 16721 10668 13261 3196 236 -2972 C -ATOM 658 CG PHE A 82 37.535 90.529 32.941 1.00112.48 C -ANISOU 658 CG PHE A 82 17835 10698 14205 3058 301 -2950 C -ATOM 659 CD1 PHE A 82 36.380 91.302 32.910 1.00116.98 C -ANISOU 659 CD1 PHE A 82 18786 10944 14715 3486 354 -2884 C -ATOM 660 CD2 PHE A 82 38.725 91.103 32.509 1.00116.96 C -ANISOU 660 CD2 PHE A 82 18421 10957 15060 2505 321 -2992 C -ATOM 661 CE1 PHE A 82 36.415 92.619 32.448 1.00122.44 C -ANISOU 661 CE1 PHE A 82 19948 10951 15623 3398 415 -2837 C -ATOM 662 CE2 PHE A 82 38.759 92.419 32.046 1.00124.40 C -ANISOU 662 CE2 PHE A 82 19814 11210 16243 2338 415 -2931 C -ATOM 663 CZ PHE A 82 37.605 93.167 32.019 1.00124.33 C -ANISOU 663 CZ PHE A 82 20256 10821 16162 2803 455 -2844 C -ATOM 664 N VAL A 83 38.913 87.970 30.870 1.00103.01 N -ANISOU 664 N VAL A 83 15681 10501 12959 2547 476 -2355 N -ATOM 665 CA VAL A 83 39.693 88.118 29.638 1.00104.09 C -ANISOU 665 CA VAL A 83 15725 10570 13256 2178 629 -2104 C -ATOM 666 C VAL A 83 39.018 87.386 28.467 1.00106.03 C -ANISOU 666 C VAL A 83 15871 11071 13346 2414 763 -1707 C -ATOM 667 O VAL A 83 38.864 87.979 27.402 1.00107.36 O -ANISOU 667 O VAL A 83 16231 10991 13570 2378 929 -1408 O -ATOM 668 CB VAL A 83 41.184 87.721 29.848 1.00108.62 C -ANISOU 668 CB VAL A 83 15923 11411 13936 1734 552 -2323 C -ATOM 669 CG1 VAL A 83 41.920 87.509 28.523 1.00108.62 C -ANISOU 669 CG1 VAL A 83 15711 11543 14016 1426 744 -2031 C -ATOM 670 CG2 VAL A 83 41.909 88.758 30.707 1.00113.26 C -ANISOU 670 CG2 VAL A 83 16637 11654 14743 1402 440 -2709 C -ATOM 671 N ILE A 84 38.555 86.140 28.693 1.00 99.86 N -ANISOU 671 N ILE A 84 14833 10753 12357 2673 686 -1712 N -ATOM 672 CA ILE A 84 37.886 85.306 27.690 1.00 97.32 C -ANISOU 672 CA ILE A 84 14377 10715 11885 2891 765 -1422 C -ATOM 673 C ILE A 84 36.592 85.958 27.156 1.00102.66 C -ANISOU 673 C ILE A 84 15327 11176 12501 3236 847 -1214 C -ATOM 674 O ILE A 84 36.376 85.935 25.939 1.00102.29 O -ANISOU 674 O ILE A 84 15290 11170 12406 3299 950 -931 O -ATOM 675 CB ILE A 84 37.682 83.855 28.215 1.00 96.89 C -ANISOU 675 CB ILE A 84 14040 11118 11655 3046 657 -1520 C -ATOM 676 CG1 ILE A 84 38.956 83.014 27.929 1.00 96.57 C -ANISOU 676 CG1 ILE A 84 13697 11372 11625 2792 619 -1559 C -ATOM 677 CG2 ILE A 84 36.404 83.192 27.664 1.00 95.61 C -ANISOU 677 CG2 ILE A 84 13834 11152 11341 3370 699 -1335 C -ATOM 678 CD1 ILE A 84 38.836 81.483 27.982 1.00101.52 C -ANISOU 678 CD1 ILE A 84 14100 12393 12079 2950 542 -1566 C -ATOM 679 N VAL A 85 35.762 86.556 28.038 1.00101.22 N -ANISOU 679 N VAL A 85 15366 10801 12294 3500 794 -1366 N -ATOM 680 CA VAL A 85 34.513 87.200 27.603 1.00102.99 C -ANISOU 680 CA VAL A 85 15827 10867 12437 3906 848 -1210 C -ATOM 681 C VAL A 85 34.756 88.621 27.064 1.00112.18 C -ANISOU 681 C VAL A 85 17428 11452 13744 3846 936 -1074 C -ATOM 682 O VAL A 85 34.114 89.001 26.088 1.00113.69 O -ANISOU 682 O VAL A 85 17790 11552 13855 4106 1015 -801 O -ATOM 683 CB VAL A 85 33.352 87.158 28.637 1.00106.86 C -ANISOU 683 CB VAL A 85 16327 11484 12791 4301 783 -1404 C -ATOM 684 CG1 VAL A 85 32.961 85.723 28.963 1.00102.92 C -ANISOU 684 CG1 VAL A 85 15436 11525 12144 4345 755 -1443 C -ATOM 685 CG2 VAL A 85 33.682 87.930 29.911 1.00109.44 C -ANISOU 685 CG2 VAL A 85 16887 11507 13188 4263 706 -1720 C -ATOM 686 N ALA A 86 35.680 89.387 27.684 1.00111.46 N -ANISOU 686 N ALA A 86 17530 10966 13854 3505 918 -1268 N -ATOM 687 CA ALA A 86 36.014 90.757 27.286 1.00116.44 C -ANISOU 687 CA ALA A 86 18628 10947 14668 3351 1018 -1163 C -ATOM 688 C ALA A 86 36.683 90.833 25.919 1.00121.26 C -ANISOU 688 C ALA A 86 19248 11490 15334 3056 1208 -789 C -ATOM 689 O ALA A 86 36.440 91.799 25.191 1.00124.90 O -ANISOU 689 O ALA A 86 20146 11484 15826 3140 1341 -523 O -ATOM 690 CB ALA A 86 36.890 91.423 28.336 1.00120.24 C -ANISOU 690 CB ALA A 86 19241 11071 15373 2982 932 -1529 C -ATOM 691 N ILE A 87 37.510 89.824 25.561 1.00114.70 N -ANISOU 691 N ILE A 87 17969 11126 14487 2754 1233 -757 N -ATOM 692 CA ILE A 87 38.208 89.790 24.272 1.00116.00 C -ANISOU 692 CA ILE A 87 18080 11334 14660 2482 1435 -419 C -ATOM 693 C ILE A 87 37.210 89.626 23.102 1.00120.26 C -ANISOU 693 C ILE A 87 18735 12012 14948 2944 1510 -47 C -ATOM 694 O ILE A 87 37.433 90.197 22.034 1.00122.84 O -ANISOU 694 O ILE A 87 19309 12116 15249 2875 1707 302 O -ATOM 695 CB ILE A 87 39.382 88.763 24.255 1.00116.55 C -ANISOU 695 CB ILE A 87 17624 11901 14759 2093 1425 -538 C -ATOM 696 CG1 ILE A 87 40.491 89.184 23.270 1.00120.80 C -ANISOU 696 CG1 ILE A 87 18147 12342 15409 1625 1675 -292 C -ATOM 697 CG2 ILE A 87 38.932 87.312 24.030 1.00111.25 C -ANISOU 697 CG2 ILE A 87 16569 11853 13848 2398 1320 -534 C -ATOM 698 CD1 ILE A 87 41.440 90.298 23.788 1.00133.73 C -ANISOU 698 CD1 ILE A 87 19951 13486 17374 1063 1753 -454 C -ATOM 699 N ALA A 88 36.084 88.917 23.344 1.00114.49 N -ANISOU 699 N ALA A 88 17842 11635 14024 3416 1357 -133 N -ATOM 700 CA ALA A 88 35.002 88.690 22.384 1.00114.34 C -ANISOU 700 CA ALA A 88 17851 11838 13754 3903 1358 113 C -ATOM 701 C ALA A 88 34.259 89.985 22.036 1.00125.89 C -ANISOU 701 C ALA A 88 19857 12804 15173 4264 1417 317 C -ATOM 702 O ALA A 88 33.662 90.072 20.961 1.00126.91 O -ANISOU 702 O ALA A 88 20101 13033 15087 4617 1460 606 O -ATOM 703 CB ALA A 88 34.027 87.667 22.938 1.00110.82 C -ANISOU 703 CB ALA A 88 17062 11870 13176 4219 1183 -105 C -ATOM 704 N LEU A 89 34.305 90.988 22.941 1.00127.83 N -ANISOU 704 N LEU A 89 20460 12512 15599 4215 1400 151 N -ATOM 705 CA LEU A 89 33.666 92.297 22.767 1.00133.89 C -ANISOU 705 CA LEU A 89 21827 12697 16348 4576 1441 302 C -ATOM 706 C LEU A 89 34.570 93.313 22.048 1.00145.83 C -ANISOU 706 C LEU A 89 23814 13590 18005 4205 1670 617 C -ATOM 707 O LEU A 89 34.201 94.482 21.920 1.00150.39 O -ANISOU 707 O LEU A 89 24993 13547 18600 4442 1726 765 O -ATOM 708 CB LEU A 89 33.175 92.846 24.121 1.00135.04 C -ANISOU 708 CB LEU A 89 22151 12566 16593 4765 1298 -71 C -ATOM 709 CG LEU A 89 32.038 92.075 24.798 1.00136.11 C -ANISOU 709 CG LEU A 89 21916 13256 16545 5224 1128 -323 C -ATOM 710 CD1 LEU A 89 31.932 92.444 26.261 1.00137.08 C -ANISOU 710 CD1 LEU A 89 22129 13186 16768 5253 1020 -730 C -ATOM 711 CD2 LEU A 89 30.707 92.303 24.090 1.00140.09 C -ANISOU 711 CD2 LEU A 89 22528 13910 16790 5918 1094 -139 C -ATOM 712 N MET A 90 35.741 92.857 21.559 1.00144.38 N -ANISOU 712 N MET A 90 23365 13580 17914 3636 1819 728 N -ATOM 713 CA MET A 90 36.710 93.676 20.829 1.00150.80 C -ANISOU 713 CA MET A 90 24519 13910 18866 3170 2097 1046 C -ATOM 714 C MET A 90 36.764 93.263 19.340 1.00155.84 C -ANISOU 714 C MET A 90 25089 14896 19227 3285 2279 1502 C -ATOM 715 O MET A 90 37.450 92.293 18.995 1.00152.11 O -ANISOU 715 O MET A 90 24112 14971 18714 2998 2323 1485 O -ATOM 716 CB MET A 90 38.097 93.618 21.494 1.00153.93 C -ANISOU 716 CB MET A 90 24642 14254 19592 2395 2149 777 C -ATOM 717 CG MET A 90 38.189 94.444 22.754 1.00160.89 C -ANISOU 717 CG MET A 90 25787 14590 20753 2227 2021 392 C -ATOM 718 SD MET A 90 39.516 93.885 23.845 1.00163.97 S -ANISOU 718 SD MET A 90 25602 15279 21419 1541 1907 -114 S -ATOM 719 CE MET A 90 39.261 94.980 25.232 1.00164.45 C -ANISOU 719 CE MET A 90 26107 14664 21713 1556 1716 -561 C -ATOM 720 N PRO A 91 36.024 93.964 18.445 1.00157.08 N -ANISOU 720 N PRO A 91 25758 14774 19152 3768 2368 1897 N -ATOM 721 CA PRO A 91 36.045 93.579 17.023 1.00162.00 C -ANISOU 721 CA PRO A 91 26334 15769 19449 3939 2525 2319 C -ATOM 722 C PRO A 91 37.202 94.198 16.239 1.00203.42 C -ANISOU 722 C PRO A 91 31858 20661 24773 3386 2911 2719 C -ATOM 723 O PRO A 91 37.556 95.359 16.440 1.00173.01 O -ANISOU 723 O PRO A 91 28555 16037 21143 3104 3087 2859 O -ATOM 724 CB PRO A 91 34.678 94.043 16.505 1.00165.32 C -ANISOU 724 CB PRO A 91 27164 16102 19547 4776 2410 2526 C -ATOM 725 CG PRO A 91 34.140 95.007 17.556 1.00170.69 C -ANISOU 725 CG PRO A 91 28266 16159 20431 4965 2285 2304 C -ATOM 726 CD PRO A 91 35.138 95.124 18.669 1.00164.54 C -ANISOU 726 CD PRO A 91 27361 15079 20078 4246 2315 1968 C -ATOM 727 N ARG A 100 38.832 86.408 19.188 1.00128.23 N -ANISOU 727 N ARG A 100 18618 14755 15347 2765 1824 620 N -ATOM 728 CA ARG A 100 39.846 86.599 18.158 1.00131.02 C -ANISOU 728 CA ARG A 100 18935 15195 15653 2475 2084 884 C -ATOM 729 C ARG A 100 39.849 85.415 17.169 1.00132.07 C -ANISOU 729 C ARG A 100 18748 15936 15497 2705 2060 944 C -ATOM 730 O ARG A 100 40.843 84.688 17.070 1.00131.23 O -ANISOU 730 O ARG A 100 18270 16197 15394 2466 2093 825 O -ATOM 731 CB ARG A 100 41.228 86.830 18.797 1.00133.12 C -ANISOU 731 CB ARG A 100 18997 15386 16198 1873 2178 701 C -ATOM 732 N THR A 101 38.712 85.243 16.438 1.00126.76 N -ANISOU 732 N THR A 101 18218 15383 14561 3204 1981 1096 N -ATOM 733 CA THR A 101 38.379 84.205 15.430 1.00124.17 C -ANISOU 733 CA THR A 101 17671 15588 13922 3531 1904 1127 C -ATOM 734 C THR A 101 38.093 82.831 16.088 1.00120.72 C -ANISOU 734 C THR A 101 16853 15500 13514 3620 1626 739 C -ATOM 735 O THR A 101 37.071 82.214 15.759 1.00119.22 O -ANISOU 735 O THR A 101 16607 15532 13160 3987 1451 670 O -ATOM 736 CB THR A 101 39.385 84.100 14.250 1.00135.41 C -ANISOU 736 CB THR A 101 19003 17293 15154 3386 2153 1367 C -ATOM 737 OG1 THR A 101 40.616 83.510 14.676 1.00134.37 O -ANISOU 737 OG1 THR A 101 18495 17387 15174 2992 2191 1153 O -ATOM 738 CG2 THR A 101 39.625 85.436 13.539 1.00139.14 C -ANISOU 738 CG2 THR A 101 19905 17395 15569 3284 2475 1816 C -ATOM 739 N PHE A 102 38.986 82.369 17.012 1.00112.05 N -ANISOU 739 N PHE A 102 15510 14444 12621 3287 1587 486 N -ATOM 740 CA PHE A 102 38.879 81.114 17.774 1.00105.73 C -ANISOU 740 CA PHE A 102 14427 13885 11859 3335 1355 151 C -ATOM 741 C PHE A 102 38.007 81.269 19.047 1.00100.38 C -ANISOU 741 C PHE A 102 13854 12949 11338 3400 1204 -27 C -ATOM 742 O PHE A 102 38.497 81.182 20.179 1.00 97.75 O -ANISOU 742 O PHE A 102 13452 12515 11174 3195 1145 -233 O -ATOM 743 CB PHE A 102 40.271 80.518 18.091 1.00107.97 C -ANISOU 743 CB PHE A 102 14418 14385 12222 3043 1373 -23 C -ATOM 744 CG PHE A 102 41.398 81.468 18.452 1.00113.59 C -ANISOU 744 CG PHE A 102 15128 14901 13128 2624 1549 11 C -ATOM 745 CD1 PHE A 102 41.215 82.470 19.406 1.00118.41 C -ANISOU 745 CD1 PHE A 102 15962 15067 13962 2453 1549 -32 C -ATOM 746 CD2 PHE A 102 42.666 81.308 17.901 1.00118.78 C -ANISOU 746 CD2 PHE A 102 15525 15851 13755 2388 1703 32 C -ATOM 747 CE1 PHE A 102 42.261 83.334 19.752 1.00123.21 C -ANISOU 747 CE1 PHE A 102 16557 15475 14781 2013 1691 -55 C -ATOM 748 CE2 PHE A 102 43.717 82.165 18.257 1.00125.47 C -ANISOU 748 CE2 PHE A 102 16305 16553 14814 1934 1868 21 C -ATOM 749 CZ PHE A 102 43.506 83.174 19.177 1.00124.90 C -ANISOU 749 CZ PHE A 102 16476 15992 14987 1727 1853 -29 C -ATOM 750 N ARG A 103 36.696 81.489 18.830 1.00 92.40 N -ANISOU 750 N ARG A 103 12986 11887 10234 3725 1139 42 N -ATOM 751 CA ARG A 103 35.653 81.682 19.852 1.00 88.59 C -ANISOU 751 CA ARG A 103 12584 11235 9840 3869 1029 -98 C -ATOM 752 C ARG A 103 35.434 80.429 20.705 1.00 85.64 C -ANISOU 752 C ARG A 103 11965 11071 9502 3842 875 -368 C -ATOM 753 O ARG A 103 34.882 80.522 21.804 1.00 84.83 O -ANISOU 753 O ARG A 103 11900 10845 9485 3866 824 -506 O -ATOM 754 CB ARG A 103 34.317 82.070 19.185 1.00 87.65 C -ANISOU 754 CB ARG A 103 12587 11152 9565 4273 992 30 C -ATOM 755 CG ARG A 103 34.420 83.188 18.159 1.00 97.48 C -ANISOU 755 CG ARG A 103 14137 12205 10696 4398 1141 355 C -ATOM 756 CD ARG A 103 33.075 83.502 17.544 1.00105.14 C -ANISOU 756 CD ARG A 103 15210 13269 11470 4887 1057 448 C -ATOM 757 NE ARG A 103 32.743 82.609 16.432 1.00104.43 N -ANISOU 757 NE ARG A 103 14895 13645 11139 5098 961 450 N -ATOM 758 CZ ARG A 103 31.595 82.640 15.765 1.00110.62 C -ANISOU 758 CZ ARG A 103 15662 14659 11710 5540 837 471 C -ATOM 759 NH1 ARG A 103 30.644 83.504 16.105 1.00 95.46 N -ANISOU 759 NH1 ARG A 103 13926 12562 9781 5854 804 506 N -ATOM 760 NH2 ARG A 103 31.378 81.796 14.766 1.00 92.79 N -ANISOU 760 NH2 ARG A 103 13186 12835 9234 5701 725 418 N -ATOM 761 N ILE A 104 35.842 79.259 20.183 1.00 78.02 N -ANISOU 761 N ILE A 104 10784 10410 8450 3815 815 -436 N -ATOM 762 CA ILE A 104 35.701 77.949 20.815 1.00 73.86 C -ANISOU 762 CA ILE A 104 10085 10041 7936 3792 683 -653 C -ATOM 763 C ILE A 104 36.529 77.855 22.105 1.00 76.98 C -ANISOU 763 C ILE A 104 10484 10308 8456 3587 666 -798 C -ATOM 764 O ILE A 104 36.159 77.080 22.981 1.00 74.29 O -ANISOU 764 O ILE A 104 10111 9989 8129 3601 584 -939 O -ATOM 765 CB ILE A 104 35.981 76.791 19.795 1.00 75.27 C -ANISOU 765 CB ILE A 104 10098 10523 7977 3855 614 -695 C -ATOM 766 CG1 ILE A 104 35.515 75.399 20.321 1.00 73.12 C -ANISOU 766 CG1 ILE A 104 9724 10337 7720 3862 473 -902 C -ATOM 767 CG2 ILE A 104 37.441 76.756 19.322 1.00 75.51 C -ANISOU 767 CG2 ILE A 104 10061 10660 7971 3724 687 -659 C -ATOM 768 CD1 ILE A 104 33.992 75.157 20.416 1.00 73.33 C -ANISOU 768 CD1 ILE A 104 9708 10399 7754 3971 415 -957 C -ATOM 769 N PHE A 105 37.604 78.678 22.248 1.00 76.39 N -ANISOU 769 N PHE A 105 10455 10105 8465 3392 748 -767 N -ATOM 770 CA PHE A 105 38.453 78.710 23.447 1.00 76.78 C -ANISOU 770 CA PHE A 105 10479 10079 8617 3214 698 -949 C -ATOM 771 C PHE A 105 37.667 79.096 24.696 1.00 81.24 C -ANISOU 771 C PHE A 105 11197 10436 9235 3279 655 -1049 C -ATOM 772 O PHE A 105 38.166 78.919 25.807 1.00 80.61 O -ANISOU 772 O PHE A 105 11109 10339 9179 3210 577 -1227 O -ATOM 773 CB PHE A 105 39.678 79.628 23.271 1.00 81.43 C -ANISOU 773 CB PHE A 105 11042 10586 9311 2942 798 -927 C -ATOM 774 CG PHE A 105 40.895 79.016 22.612 1.00 84.31 C -ANISOU 774 CG PHE A 105 11151 11262 9622 2831 821 -949 C -ATOM 775 CD1 PHE A 105 41.469 77.854 23.111 1.00 86.56 C -ANISOU 775 CD1 PHE A 105 11251 11799 9838 2903 674 -1149 C -ATOM 776 CD2 PHE A 105 41.518 79.649 21.542 1.00 89.93 C -ANISOU 776 CD2 PHE A 105 11819 12014 10336 2669 1007 -766 C -ATOM 777 CE1 PHE A 105 42.617 77.312 22.523 1.00 89.07 C -ANISOU 777 CE1 PHE A 105 11312 12443 10087 2860 687 -1202 C -ATOM 778 CE2 PHE A 105 42.663 79.101 20.948 1.00 93.94 C -ANISOU 778 CE2 PHE A 105 12042 12877 10772 2580 1055 -802 C -ATOM 779 CZ PHE A 105 43.206 77.939 21.445 1.00 90.59 C -ANISOU 779 CZ PHE A 105 11404 12736 10280 2695 883 -1040 C -ATOM 780 N ARG A 106 36.421 79.576 24.519 1.00 79.12 N -ANISOU 780 N ARG A 106 11052 10063 8947 3460 696 -950 N -ATOM 781 CA ARG A 106 35.568 79.941 25.636 1.00 79.68 C -ANISOU 781 CA ARG A 106 11243 9997 9033 3574 679 -1048 C -ATOM 782 C ARG A 106 34.871 78.695 26.243 1.00 82.52 C -ANISOU 782 C ARG A 106 11486 10561 9305 3664 625 -1137 C -ATOM 783 O ARG A 106 34.221 78.806 27.282 1.00 83.10 O -ANISOU 783 O ARG A 106 11624 10595 9355 3749 637 -1221 O -ATOM 784 CB ARG A 106 34.617 81.100 25.276 1.00 82.04 C -ANISOU 784 CB ARG A 106 11722 10105 9342 3765 749 -931 C -ATOM 785 CG ARG A 106 33.258 80.791 24.672 1.00 90.21 C -ANISOU 785 CG ARG A 106 12672 11332 10273 4038 746 -852 C -ATOM 786 CD ARG A 106 32.420 82.072 24.656 1.00 91.77 C -ANISOU 786 CD ARG A 106 13082 11321 10465 4298 788 -790 C -ATOM 787 NE ARG A 106 32.924 83.056 23.693 1.00 89.35 N -ANISOU 787 NE ARG A 106 13002 10771 10177 4299 855 -587 N -ATOM 788 CZ ARG A 106 32.206 83.583 22.707 1.00101.35 C -ANISOU 788 CZ ARG A 106 14621 12300 11586 4591 874 -407 C -ATOM 789 NH1 ARG A 106 30.927 83.255 22.556 1.00 81.99 N -ANISOU 789 NH1 ARG A 106 12004 10131 9015 4910 804 -453 N -ATOM 790 NH2 ARG A 106 32.755 84.455 21.872 1.00 95.22 N -ANISOU 790 NH2 ARG A 106 14108 11265 10807 4569 969 -179 N -ATOM 791 N VAL A 107 35.094 77.501 25.652 1.00 77.16 N -ANISOU 791 N VAL A 107 10661 10083 8575 3628 578 -1126 N -ATOM 792 CA VAL A 107 34.612 76.220 26.191 1.00 75.63 C -ANISOU 792 CA VAL A 107 10408 10007 8321 3645 541 -1194 C -ATOM 793 C VAL A 107 35.570 75.825 27.360 1.00 80.65 C -ANISOU 793 C VAL A 107 11121 10601 8923 3580 483 -1310 C -ATOM 794 O VAL A 107 35.164 75.093 28.272 1.00 80.21 O -ANISOU 794 O VAL A 107 11124 10555 8796 3611 488 -1346 O -ATOM 795 CB VAL A 107 34.409 75.139 25.083 1.00 77.67 C -ANISOU 795 CB VAL A 107 10535 10432 8542 3653 494 -1166 C -ATOM 796 CG1 VAL A 107 34.066 73.765 25.654 1.00 76.70 C -ANISOU 796 CG1 VAL A 107 10416 10338 8390 3609 464 -1236 C -ATOM 797 CG2 VAL A 107 33.324 75.580 24.113 1.00 77.86 C -ANISOU 797 CG2 VAL A 107 10474 10551 8559 3771 520 -1092 C -ATOM 798 N MET A 108 36.795 76.431 27.391 1.00 78.29 N -ANISOU 798 N MET A 108 10821 10262 8664 3493 440 -1369 N -ATOM 799 CA MET A 108 37.778 76.280 28.475 1.00 79.38 C -ANISOU 799 CA MET A 108 10992 10411 8757 3466 345 -1527 C -ATOM 800 C MET A 108 37.177 76.763 29.802 1.00 81.12 C -ANISOU 800 C MET A 108 11371 10522 8931 3542 363 -1606 C -ATOM 801 O MET A 108 37.661 76.363 30.858 1.00 82.61 O -ANISOU 801 O MET A 108 11624 10757 9006 3600 280 -1728 O -ATOM 802 CB MET A 108 39.058 77.080 28.187 1.00 84.38 C -ANISOU 802 CB MET A 108 11528 11050 9484 3305 312 -1608 C -ATOM 803 CG MET A 108 39.987 76.422 27.186 1.00 90.34 C -ANISOU 803 CG MET A 108 12090 12014 10222 3261 287 -1585 C -ATOM 804 SD MET A 108 41.219 77.572 26.494 1.00 99.40 S -ANISOU 804 SD MET A 108 13070 13187 11512 2987 358 -1602 S -ATOM 805 CE MET A 108 42.405 77.664 27.865 1.00 98.10 C -ANISOU 805 CE MET A 108 12807 13116 11351 2911 187 -1918 C -ATOM 806 N ARG A 109 36.116 77.611 29.745 1.00 88.18 N -ANISOU 806 N ARG A 109 11665 12289 9549 3521 907 -1429 N -ATOM 807 CA ARG A 109 35.390 78.137 30.901 1.00 88.60 C -ANISOU 807 CA ARG A 109 11747 12496 9422 3765 996 -1507 C -ATOM 808 C ARG A 109 34.780 77.023 31.740 1.00 89.98 C -ANISOU 808 C ARG A 109 11572 13016 9600 3643 1104 -1470 C -ATOM 809 O ARG A 109 34.531 77.245 32.918 1.00 91.30 O -ANISOU 809 O ARG A 109 11777 13278 9635 3736 1182 -1515 O -ATOM 810 CB ARG A 109 34.296 79.132 30.484 1.00 90.04 C -ANISOU 810 CB ARG A 109 11970 12777 9466 4195 1001 -1589 C -ATOM 811 CG ARG A 109 34.819 80.514 30.117 1.00 96.43 C -ANISOU 811 CG ARG A 109 13229 13217 10192 4383 922 -1649 C -ATOM 812 CD ARG A 109 33.794 81.596 30.397 1.00102.72 C -ANISOU 812 CD ARG A 109 14144 14104 10781 4846 960 -1753 C -ATOM 813 NE ARG A 109 33.721 81.891 31.829 1.00107.72 N -ANISOU 813 NE ARG A 109 14878 14781 11269 4925 1041 -1818 N -ATOM 814 CZ ARG A 109 32.603 82.168 32.490 1.00117.93 C -ANISOU 814 CZ ARG A 109 16046 16363 12399 5242 1131 -1887 C -ATOM 815 NH1 ARG A 109 31.440 82.208 31.854 1.00101.75 N -ANISOU 815 NH1 ARG A 109 13753 14599 10308 5518 1150 -1903 N -ATOM 816 NH2 ARG A 109 32.639 82.408 33.794 1.00105.02 N -ANISOU 816 NH2 ARG A 109 14521 14749 10632 5292 1203 -1944 N -ATOM 817 N LEU A 110 34.553 75.827 31.149 1.00 83.57 N -ANISOU 817 N LEU A 110 10437 12383 8932 3424 1109 -1388 N -ATOM 818 CA LEU A 110 34.034 74.648 31.853 1.00 82.73 C -ANISOU 818 CA LEU A 110 10008 12582 8843 3249 1210 -1336 C -ATOM 819 C LEU A 110 34.967 74.285 32.991 1.00 85.44 C -ANISOU 819 C LEU A 110 10489 12791 9181 3023 1237 -1303 C -ATOM 820 O LEU A 110 34.503 73.923 34.072 1.00 87.04 O -ANISOU 820 O LEU A 110 10575 13203 9293 3019 1341 -1303 O -ATOM 821 CB LEU A 110 33.910 73.436 30.915 1.00 80.96 C -ANISOU 821 CB LEU A 110 9494 12479 8789 3002 1188 -1251 C -ATOM 822 CG LEU A 110 32.702 73.362 29.997 1.00 86.23 C -ANISOU 822 CG LEU A 110 9882 13429 9455 3167 1193 -1273 C -ATOM 823 CD1 LEU A 110 32.774 72.124 29.141 1.00 84.27 C -ANISOU 823 CD1 LEU A 110 9395 13248 9377 2872 1162 -1190 C -ATOM 824 CD2 LEU A 110 31.390 73.361 30.783 1.00 90.41 C -ANISOU 824 CD2 LEU A 110 10164 14353 9835 3356 1316 -1319 C -ATOM 825 N VAL A 111 36.283 74.409 32.745 1.00 79.46 N -ANISOU 825 N VAL A 111 9982 11699 8512 2844 1143 -1275 N -ATOM 826 CA VAL A 111 37.349 74.144 33.702 1.00 78.53 C -ANISOU 826 CA VAL A 111 10022 11424 8392 2631 1141 -1247 C -ATOM 827 C VAL A 111 37.229 75.099 34.888 1.00 85.57 C -ANISOU 827 C VAL A 111 11124 12295 9092 2835 1189 -1337 C -ATOM 828 O VAL A 111 37.166 74.632 36.023 1.00 87.30 O -ANISOU 828 O VAL A 111 11282 12645 9243 2762 1267 -1322 O -ATOM 829 CB VAL A 111 38.746 74.187 33.024 1.00 79.87 C -ANISOU 829 CB VAL A 111 10398 11263 8688 2422 1021 -1210 C -ATOM 830 CG1 VAL A 111 39.872 74.244 34.054 1.00 79.07 C -ANISOU 830 CG1 VAL A 111 10506 10992 8546 2263 1004 -1209 C -ATOM 831 CG2 VAL A 111 38.929 73.005 32.080 1.00 77.37 C -ANISOU 831 CG2 VAL A 111 9857 10989 8552 2185 989 -1113 C -ATOM 832 N SER A 112 37.147 76.421 34.627 1.00 82.48 N -ANISOU 832 N SER A 112 10988 11745 8605 3101 1146 -1429 N -ATOM 833 CA SER A 112 37.020 77.449 35.671 1.00 83.45 C -ANISOU 833 CA SER A 112 11355 11819 8533 3325 1183 -1530 C -ATOM 834 C SER A 112 35.690 77.402 36.419 1.00 89.35 C -ANISOU 834 C SER A 112 11893 12920 9137 3563 1312 -1571 C -ATOM 835 O SER A 112 35.670 77.696 37.612 1.00 91.67 O -ANISOU 835 O SER A 112 12293 13250 9287 3633 1373 -1619 O -ATOM 836 CB SER A 112 37.241 78.840 35.093 1.00 86.20 C -ANISOU 836 CB SER A 112 12050 11887 8816 3547 1103 -1614 C -ATOM 837 OG SER A 112 36.311 79.093 34.058 1.00 94.00 O -ANISOU 837 OG SER A 112 12915 12987 9815 3777 1097 -1626 O -ATOM 838 N VAL A 113 34.588 77.044 35.729 1.00 84.59 N -ANISOU 838 N VAL A 113 10988 12591 8563 3685 1352 -1555 N -ATOM 839 CA VAL A 113 33.237 76.980 36.305 1.00 85.82 C -ANISOU 839 CA VAL A 113 10893 13133 8581 3915 1477 -1593 C -ATOM 840 C VAL A 113 33.010 75.673 37.121 1.00 88.28 C -ANISOU 840 C VAL A 113 10905 13717 8919 3658 1584 -1511 C -ATOM 841 O VAL A 113 32.312 75.728 38.125 1.00 89.98 O -ANISOU 841 O VAL A 113 11031 14174 8982 3793 1698 -1548 O -ATOM 842 CB VAL A 113 32.153 77.243 35.217 1.00 90.53 C -ANISOU 842 CB VAL A 113 11295 13924 9179 4167 1468 -1620 C -ATOM 843 CG1 VAL A 113 30.751 76.847 35.675 1.00 92.69 C -ANISOU 843 CG1 VAL A 113 11199 14671 9347 4321 1600 -1637 C -ATOM 844 CG2 VAL A 113 32.178 78.707 34.780 1.00 91.39 C -ANISOU 844 CG2 VAL A 113 11742 13798 9185 4511 1396 -1718 C -ATOM 845 N ILE A 114 33.613 74.529 36.730 1.00 82.53 N -ANISOU 845 N ILE A 114 10047 12942 8370 3298 1552 -1402 N -ATOM 846 CA ILE A 114 33.449 73.271 37.485 1.00 81.60 C -ANISOU 846 CA ILE A 114 9687 13044 8272 3043 1650 -1316 C -ATOM 847 C ILE A 114 34.590 73.113 38.524 1.00 84.77 C -ANISOU 847 C ILE A 114 10322 13236 8651 2856 1640 -1288 C -ATOM 848 O ILE A 114 35.745 72.956 38.125 1.00 82.32 O -ANISOU 848 O ILE A 114 10177 12641 8462 2660 1535 -1247 O -ATOM 849 CB ILE A 114 33.251 72.027 36.566 1.00 82.30 C -ANISOU 849 CB ILE A 114 9480 13252 8538 2782 1640 -1217 C -ATOM 850 CG1 ILE A 114 31.963 72.177 35.720 1.00 83.09 C -ANISOU 850 CG1 ILE A 114 9311 13636 8624 2984 1665 -1256 C -ATOM 851 CG2 ILE A 114 33.233 70.727 37.390 1.00 82.06 C -ANISOU 851 CG2 ILE A 114 9269 13386 8525 2492 1737 -1120 C -ATOM 852 CD1 ILE A 114 31.852 71.278 34.516 1.00 84.91 C -ANISOU 852 CD1 ILE A 114 9323 13908 9031 2779 1611 -1188 C -ATOM 853 N PRO A 115 34.280 73.157 39.850 1.00 83.08 N -ANISOU 853 N PRO A 115 10118 13175 8274 2922 1746 -1311 N -ATOM 854 CA PRO A 115 35.347 73.105 40.877 1.00 82.39 C -ANISOU 854 CA PRO A 115 10268 12897 8141 2776 1728 -1297 C -ATOM 855 C PRO A 115 36.300 71.899 40.842 1.00 84.35 C -ANISOU 855 C PRO A 115 10477 13035 8537 2403 1687 -1174 C -ATOM 856 O PRO A 115 37.494 72.086 41.085 1.00 82.54 O -ANISOU 856 O PRO A 115 10492 12541 8328 2292 1598 -1173 O -ATOM 857 CB PRO A 115 34.580 73.179 42.204 1.00 86.19 C -ANISOU 857 CB PRO A 115 10687 13640 8419 2916 1870 -1332 C -ATOM 858 CG PRO A 115 33.157 72.916 41.862 1.00 91.86 C -ANISOU 858 CG PRO A 115 11068 14723 9111 3046 1975 -1332 C -ATOM 859 CD PRO A 115 32.963 73.399 40.474 1.00 86.92 C -ANISOU 859 CD PRO A 115 10421 14014 8590 3167 1882 -1366 C -ATOM 860 N THR A 116 35.799 70.686 40.539 1.00 81.05 N -ANISOU 860 N THR A 116 9767 12815 8214 2214 1746 -1075 N -ATOM 861 CA THR A 116 36.645 69.489 40.442 1.00 79.13 C -ANISOU 861 CA THR A 116 9496 12463 8107 1880 1708 -955 C -ATOM 862 C THR A 116 37.613 69.584 39.253 1.00 82.47 C -ANISOU 862 C THR A 116 10037 12598 8700 1784 1558 -944 C -ATOM 863 O THR A 116 38.768 69.178 39.381 1.00 81.36 O -ANISOU 863 O THR A 116 10037 12253 8621 1599 1485 -895 O -ATOM 864 CB THR A 116 35.819 68.197 40.401 1.00 86.78 C -ANISOU 864 CB THR A 116 10153 13698 9120 1699 1813 -857 C -ATOM 865 OG1 THR A 116 34.929 68.231 39.286 1.00 90.18 O -ANISOU 865 OG1 THR A 116 10368 14269 9628 1769 1811 -877 O -ATOM 866 CG2 THR A 116 35.053 67.941 41.692 1.00 86.89 C -ANISOU 866 CG2 THR A 116 10066 13987 8962 1735 1968 -848 C -ATOM 867 N MET A 117 37.150 70.132 38.110 1.00 79.76 N -ANISOU 867 N MET A 117 9637 12248 8420 1922 1512 -991 N -ATOM 868 CA MET A 117 37.976 70.315 36.910 1.00 78.10 C -ANISOU 868 CA MET A 117 9538 11779 8359 1853 1378 -984 C -ATOM 869 C MET A 117 39.015 71.408 37.131 1.00 79.15 C -ANISOU 869 C MET A 117 10009 11623 8440 1928 1287 -1053 C -ATOM 870 O MET A 117 40.167 71.261 36.719 1.00 77.25 O -ANISOU 870 O MET A 117 9897 11154 8301 1757 1189 -1019 O -ATOM 871 CB MET A 117 37.113 70.581 35.670 1.00 81.50 C -ANISOU 871 CB MET A 117 9815 12301 8851 1991 1359 -1014 C -ATOM 872 CG MET A 117 36.668 69.309 34.986 1.00 86.05 C -ANISOU 872 CG MET A 117 10103 13034 9556 1789 1382 -926 C -ATOM 873 SD MET A 117 35.593 69.597 33.556 1.00 93.26 S -ANISOU 873 SD MET A 117 10810 14100 10526 1952 1356 -966 S -ATOM 874 CE MET A 117 36.809 69.812 32.251 1.00 87.21 C -ANISOU 874 CE MET A 117 10243 12977 9917 1865 1197 -950 C -ATOM 875 N ARG A 118 38.618 72.463 37.849 1.00 76.11 N -ANISOU 875 N ARG A 118 9768 11262 7888 2170 1325 -1151 N -ATOM 876 CA ARG A 118 39.454 73.589 38.248 1.00 75.83 C -ANISOU 876 CA ARG A 118 10074 10972 7767 2253 1255 -1233 C -ATOM 877 C ARG A 118 40.617 73.081 39.120 1.00 78.92 C -ANISOU 877 C ARG A 118 10576 11252 8156 2016 1225 -1187 C -ATOM 878 O ARG A 118 41.756 73.495 38.904 1.00 77.56 O -ANISOU 878 O ARG A 118 10622 10827 8020 1919 1119 -1205 O -ATOM 879 CB ARG A 118 38.593 74.606 39.015 1.00 78.28 C -ANISOU 879 CB ARG A 118 10480 11386 7876 2567 1328 -1343 C -ATOM 880 CG ARG A 118 39.246 75.964 39.227 1.00 89.57 C -ANISOU 880 CG ARG A 118 12291 12538 9202 2698 1253 -1450 C -ATOM 881 CD ARG A 118 38.275 77.034 39.708 1.00 95.58 C -ANISOU 881 CD ARG A 118 13158 13384 9773 3060 1317 -1566 C -ATOM 882 NE ARG A 118 37.686 76.709 41.008 1.00 99.68 N -ANISOU 882 NE ARG A 118 13573 14154 10147 3125 1439 -1577 N -ATOM 883 CZ ARG A 118 36.380 76.683 41.254 1.00110.51 C -ANISOU 883 CZ ARG A 118 14733 15833 11422 3347 1555 -1600 C -ATOM 884 NH1 ARG A 118 35.511 76.982 40.299 1.00 93.36 N -ANISOU 884 NH1 ARG A 118 12431 13764 9280 3542 1559 -1620 N -ATOM 885 NH2 ARG A 118 35.934 76.370 42.461 1.00 99.74 N -ANISOU 885 NH2 ARG A 118 13283 14694 9921 3381 1669 -1604 N -ATOM 886 N ARG A 119 40.329 72.144 40.060 1.00 75.62 N -ANISOU 886 N ARG A 119 10001 11036 7694 1917 1317 -1124 N -ATOM 887 CA ARG A 119 41.314 71.558 40.968 1.00 74.35 C -ANISOU 887 CA ARG A 119 9925 10812 7513 1716 1298 -1071 C -ATOM 888 C ARG A 119 42.361 70.677 40.258 1.00 76.35 C -ANISOU 888 C ARG A 119 10142 10925 7941 1451 1206 -975 C -ATOM 889 O ARG A 119 43.531 70.695 40.661 1.00 76.05 O -ANISOU 889 O ARG A 119 10267 10730 7898 1325 1127 -970 O -ATOM 890 CB ARG A 119 40.637 70.830 42.127 1.00 74.11 C -ANISOU 890 CB ARG A 119 9752 11035 7369 1704 1430 -1026 C -ATOM 891 CG ARG A 119 40.374 71.797 43.281 1.00 82.14 C -ANISOU 891 CG ARG A 119 10940 12095 8175 1914 1481 -1131 C -ATOM 892 CD ARG A 119 39.816 71.143 44.531 1.00 83.39 C -ANISOU 892 CD ARG A 119 10989 12495 8199 1900 1612 -1087 C -ATOM 893 NE ARG A 119 38.456 70.635 44.341 1.00 86.93 N -ANISOU 893 NE ARG A 119 11147 13238 8646 1961 1742 -1050 N -ATOM 894 CZ ARG A 119 37.348 71.351 44.512 1.00104.70 C -ANISOU 894 CZ ARG A 119 13333 15674 10773 2222 1831 -1133 C -ATOM 895 NH1 ARG A 119 37.421 72.632 44.861 1.00 97.72 N -ANISOU 895 NH1 ARG A 119 12685 14689 9757 2464 1803 -1260 N -ATOM 896 NH2 ARG A 119 36.159 70.796 44.325 1.00 89.82 N -ANISOU 896 NH2 ARG A 119 11152 14085 8890 2245 1946 -1094 N -ATOM 897 N VAL A 120 41.957 69.950 39.190 1.00 70.81 N -ANISOU 897 N VAL A 120 9233 10286 7387 1376 1211 -908 N -ATOM 898 CA VAL A 120 42.847 69.116 38.364 1.00 68.36 C -ANISOU 898 CA VAL A 120 8881 9849 7245 1154 1127 -823 C -ATOM 899 C VAL A 120 43.878 70.024 37.669 1.00 71.88 C -ANISOU 899 C VAL A 120 9537 10034 7740 1155 998 -878 C -ATOM 900 O VAL A 120 45.079 69.767 37.766 1.00 70.33 O -ANISOU 900 O VAL A 120 9437 9702 7581 994 921 -846 O -ATOM 901 CB VAL A 120 42.067 68.257 37.327 1.00 70.94 C -ANISOU 901 CB VAL A 120 8955 10297 7703 1096 1160 -758 C -ATOM 902 CG1 VAL A 120 43.023 67.555 36.370 1.00 68.54 C -ANISOU 902 CG1 VAL A 120 8643 9836 7563 900 1064 -687 C -ATOM 903 CG2 VAL A 120 41.168 67.234 38.016 1.00 71.58 C -ANISOU 903 CG2 VAL A 120 8831 10628 7739 1034 1287 -691 C -ATOM 904 N VAL A 121 43.393 71.093 36.998 1.00 69.01 N -ANISOU 904 N VAL A 121 9247 9611 7362 1339 979 -961 N -ATOM 905 CA VAL A 121 44.216 72.070 36.293 1.00 68.41 C -ANISOU 905 CA VAL A 121 9389 9287 7318 1350 871 -1017 C -ATOM 906 C VAL A 121 45.146 72.834 37.255 1.00 74.58 C -ANISOU 906 C VAL A 121 10435 9922 7981 1328 824 -1082 C -ATOM 907 O VAL A 121 46.338 72.923 36.961 1.00 73.40 O -ANISOU 907 O VAL A 121 10403 9600 7887 1170 728 -1072 O -ATOM 908 CB VAL A 121 43.367 72.995 35.391 1.00 72.80 C -ANISOU 908 CB VAL A 121 9973 9821 7868 1573 871 -1083 C -ATOM 909 CG1 VAL A 121 44.199 74.141 34.807 1.00 72.30 C -ANISOU 909 CG1 VAL A 121 10190 9480 7800 1594 770 -1146 C -ATOM 910 CG2 VAL A 121 42.728 72.186 34.268 1.00 71.59 C -ANISOU 910 CG2 VAL A 121 9564 9783 7853 1540 883 -1015 C -ATOM 911 N GLN A 122 44.647 73.317 38.419 1.00 74.21 N -ANISOU 911 N GLN A 122 10472 9957 7766 1470 889 -1146 N -ATOM 912 CA GLN A 122 45.536 74.020 39.357 1.00 74.72 C -ANISOU 912 CA GLN A 122 10794 9885 7710 1438 838 -1216 C -ATOM 913 C GLN A 122 46.582 73.079 39.980 1.00 77.92 C -ANISOU 913 C GLN A 122 11159 10307 8142 1199 801 -1141 C -ATOM 914 O GLN A 122 47.692 73.529 40.249 1.00 77.63 O -ANISOU 914 O GLN A 122 11305 10118 8073 1091 711 -1180 O -ATOM 915 CB GLN A 122 44.811 74.876 40.409 1.00 78.00 C -ANISOU 915 CB GLN A 122 11348 10361 7927 1664 907 -1318 C -ATOM 916 CG GLN A 122 43.785 74.177 41.261 1.00 93.12 C -ANISOU 916 CG GLN A 122 13067 12553 9762 1749 1037 -1284 C -ATOM 917 CD GLN A 122 42.970 75.137 42.110 1.00106.57 C -ANISOU 917 CD GLN A 122 14902 14323 11269 2016 1110 -1395 C -ATOM 918 OE1 GLN A 122 42.671 76.278 41.722 1.00100.15 O -ANISOU 918 OE1 GLN A 122 14264 13389 10399 2213 1087 -1491 O -ATOM 919 NE2 GLN A 122 42.533 74.664 43.268 1.00 91.97 N -ANISOU 919 NE2 GLN A 122 12966 12675 9302 2044 1207 -1379 N -ATOM 920 N GLY A 123 46.265 71.788 40.097 1.00 73.96 N -ANISOU 920 N GLY A 123 10423 9978 7702 1112 861 -1035 N -ATOM 921 CA GLY A 123 47.219 70.778 40.540 1.00 73.03 C -ANISOU 921 CA GLY A 123 10257 9873 7618 905 824 -949 C -ATOM 922 C GLY A 123 48.348 70.621 39.527 1.00 76.87 C -ANISOU 922 C GLY A 123 10758 10200 8247 741 709 -915 C -ATOM 923 O GLY A 123 49.516 70.540 39.910 1.00 76.01 O -ANISOU 923 O GLY A 123 10735 10024 8122 607 629 -908 O -ATOM 924 N MET A 124 48.003 70.624 38.216 1.00 73.61 N -ANISOU 924 N MET A 124 10261 9741 7966 760 697 -899 N -ATOM 925 CA MET A 124 48.922 70.527 37.079 1.00 72.53 C -ANISOU 925 CA MET A 124 10127 9465 7967 627 601 -869 C -ATOM 926 C MET A 124 49.817 71.769 36.990 1.00 77.51 C -ANISOU 926 C MET A 124 11000 9903 8547 607 509 -960 C -ATOM 927 O MET A 124 51.024 71.627 36.807 1.00 77.52 O -ANISOU 927 O MET A 124 11041 9824 8589 442 424 -941 O -ATOM 928 CB MET A 124 48.142 70.322 35.766 1.00 74.50 C -ANISOU 928 CB MET A 124 10235 9728 8343 681 623 -840 C -ATOM 929 CG MET A 124 47.923 68.852 35.398 1.00 77.49 C -ANISOU 929 CG MET A 124 10383 10225 8835 573 656 -727 C -ATOM 930 SD MET A 124 46.372 68.444 34.514 1.00 82.14 S -ANISOU 930 SD MET A 124 10750 10959 9498 677 740 -704 S -ATOM 931 CE MET A 124 46.495 69.540 33.065 1.00 78.63 C -ANISOU 931 CE MET A 124 10404 10347 9123 765 661 -767 C -ATOM 932 N LEU A 125 49.242 72.974 37.148 1.00 74.66 N -ANISOU 932 N LEU A 125 10807 9473 8086 773 528 -1060 N -ATOM 933 CA LEU A 125 49.992 74.238 37.119 1.00 75.18 C -ANISOU 933 CA LEU A 125 11144 9336 8083 754 450 -1155 C -ATOM 934 C LEU A 125 50.972 74.381 38.299 1.00 78.94 C -ANISOU 934 C LEU A 125 11749 9798 8448 634 401 -1193 C -ATOM 935 O LEU A 125 52.107 74.812 38.091 1.00 78.65 O -ANISOU 935 O LEU A 125 11836 9630 8419 476 307 -1219 O -ATOM 936 CB LEU A 125 49.044 75.457 37.076 1.00 77.01 C -ANISOU 936 CB LEU A 125 11549 9496 8216 991 490 -1255 C -ATOM 937 CG LEU A 125 48.097 75.570 35.868 1.00 81.71 C -ANISOU 937 CG LEU A 125 12054 10094 8899 1137 521 -1237 C -ATOM 938 CD1 LEU A 125 46.953 76.537 36.170 1.00 84.02 C -ANISOU 938 CD1 LEU A 125 12465 10398 9062 1423 584 -1326 C -ATOM 939 CD2 LEU A 125 48.847 75.934 34.568 1.00 80.79 C -ANISOU 939 CD2 LEU A 125 12022 9785 8889 1026 435 -1223 C -ATOM 940 N LEU A 126 50.533 74.030 39.534 1.00 75.08 N -ANISOU 940 N LEU A 126 11227 9455 7846 702 464 -1196 N -ATOM 941 CA LEU A 126 51.366 74.108 40.738 1.00 74.71 C -ANISOU 941 CA LEU A 126 11291 9423 7674 609 421 -1232 C -ATOM 942 C LEU A 126 52.517 73.099 40.723 1.00 77.59 C -ANISOU 942 C LEU A 126 11530 9836 8116 395 352 -1144 C -ATOM 943 O LEU A 126 53.513 73.302 41.421 1.00 78.04 O -ANISOU 943 O LEU A 126 11690 9872 8089 280 276 -1181 O -ATOM 944 CB LEU A 126 50.524 73.935 42.011 1.00 75.88 C -ANISOU 944 CB LEU A 126 11424 9729 7679 752 518 -1247 C -ATOM 945 CG LEU A 126 49.514 75.042 42.373 1.00 81.02 C -ANISOU 945 CG LEU A 126 12237 10350 8196 987 582 -1358 C -ATOM 946 CD1 LEU A 126 48.595 74.574 43.470 1.00 80.68 C -ANISOU 946 CD1 LEU A 126 12097 10518 8039 1120 698 -1342 C -ATOM 947 CD2 LEU A 126 50.205 76.322 42.798 1.00 84.55 C -ANISOU 947 CD2 LEU A 126 12999 10613 8513 973 503 -1487 C -ATOM 948 N ALA A 127 52.381 72.023 39.922 1.00 72.75 N -ANISOU 948 N ALA A 127 10697 9293 7653 348 373 -1032 N -ATOM 949 CA ALA A 127 53.378 70.963 39.770 1.00 71.29 C -ANISOU 949 CA ALA A 127 10382 9156 7549 180 315 -940 C -ATOM 950 C ALA A 127 54.478 71.334 38.768 1.00 75.38 C -ANISOU 950 C ALA A 127 10940 9545 8156 37 209 -953 C -ATOM 951 O ALA A 127 55.519 70.665 38.741 1.00 75.24 O -ANISOU 951 O ALA A 127 10846 9568 8174 -101 143 -901 O -ATOM 952 CB ALA A 127 52.702 69.672 39.336 1.00 70.72 C -ANISOU 952 CB ALA A 127 10087 9196 7588 197 386 -822 C -ATOM 953 N LEU A 128 54.241 72.376 37.931 1.00 71.24 N -ANISOU 953 N LEU A 128 10534 8873 7661 77 198 -1019 N -ATOM 954 CA LEU A 128 55.179 72.816 36.885 1.00 69.33 C -ANISOU 954 CA LEU A 128 10342 8502 7500 -60 113 -1030 C -ATOM 955 C LEU A 128 56.472 73.440 37.436 1.00 74.06 C -ANISOU 955 C LEU A 128 11084 9049 8005 -224 16 -1097 C -ATOM 956 O LEU A 128 57.524 73.004 36.986 1.00 73.22 O -ANISOU 956 O LEU A 128 10888 8968 7964 -382 -52 -1054 O -ATOM 957 CB LEU A 128 54.526 73.733 35.835 1.00 68.85 C -ANISOU 957 CB LEU A 128 10385 8291 7482 34 133 -1073 C -ATOM 958 CG LEU A 128 53.469 73.118 34.904 1.00 71.34 C -ANISOU 958 CG LEU A 128 10530 8658 7919 153 201 -1004 C -ATOM 959 CD1 LEU A 128 52.955 74.154 33.941 1.00 72.18 C -ANISOU 959 CD1 LEU A 128 10771 8613 8041 255 204 -1056 C -ATOM 960 CD2 LEU A 128 54.019 71.969 34.101 1.00 69.63 C -ANISOU 960 CD2 LEU A 128 10110 8499 7845 29 173 -902 C -ATOM 961 N PRO A 129 56.484 74.387 38.415 1.00 72.56 N -ANISOU 961 N PRO A 129 11103 8807 7659 -200 3 -1201 N -ATOM 962 CA PRO A 129 57.778 74.900 38.915 1.00 72.89 C -ANISOU 962 CA PRO A 129 11262 8820 7613 -390 -99 -1265 C -ATOM 963 C PRO A 129 58.782 73.821 39.365 1.00 77.95 C -ANISOU 963 C PRO A 129 11718 9636 8265 -518 -157 -1196 C -ATOM 964 O PRO A 129 59.976 73.947 39.081 1.00 79.24 O -ANISOU 964 O PRO A 129 11871 9799 8438 -703 -247 -1207 O -ATOM 965 CB PRO A 129 57.365 75.814 40.071 1.00 75.55 C -ANISOU 965 CB PRO A 129 11825 9109 7771 -300 -84 -1378 C -ATOM 966 CG PRO A 129 56.021 76.258 39.719 1.00 79.85 C -ANISOU 966 CG PRO A 129 12440 9575 8326 -83 8 -1397 C -ATOM 967 CD PRO A 129 55.365 75.059 39.113 1.00 74.57 C -ANISOU 967 CD PRO A 129 11501 9033 7798 -4 77 -1274 C -ATOM 968 N GLY A 130 58.284 72.757 40.005 1.00 73.05 N -ANISOU 968 N GLY A 130 10951 9166 7638 -417 -101 -1120 N -ATOM 969 CA GLY A 130 59.086 71.649 40.511 1.00 71.97 C -ANISOU 969 CA GLY A 130 10657 9194 7496 -491 -145 -1043 C -ATOM 970 C GLY A 130 59.734 70.747 39.478 1.00 75.66 C -ANISOU 970 C GLY A 130 10935 9703 8111 -576 -180 -947 C -ATOM 971 O GLY A 130 60.434 69.806 39.863 1.00 76.65 O -ANISOU 971 O GLY A 130 10938 9961 8223 -621 -223 -885 O -ATOM 972 N VAL A 131 59.495 70.993 38.165 1.00 69.77 N -ANISOU 972 N VAL A 131 10166 8848 7496 -581 -160 -933 N -ATOM 973 CA VAL A 131 60.083 70.202 37.068 1.00 67.96 C -ANISOU 973 CA VAL A 131 9767 8647 7406 -651 -188 -848 C -ATOM 974 C VAL A 131 60.880 71.077 36.066 1.00 70.42 C -ANISOU 974 C VAL A 131 10140 8856 7761 -796 -253 -898 C -ATOM 975 O VAL A 131 61.345 70.562 35.044 1.00 68.88 O -ANISOU 975 O VAL A 131 9817 8677 7678 -852 -272 -838 O -ATOM 976 CB VAL A 131 59.063 69.282 36.329 1.00 70.98 C -ANISOU 976 CB VAL A 131 10018 9033 7917 -533 -102 -757 C -ATOM 977 CG1 VAL A 131 58.528 68.178 37.236 1.00 70.85 C -ANISOU 977 CG1 VAL A 131 9916 9139 7865 -441 -44 -685 C -ATOM 978 CG2 VAL A 131 57.929 70.085 35.689 1.00 70.85 C -ANISOU 978 CG2 VAL A 131 10092 8888 7938 -435 -37 -802 C -ATOM 979 N GLY A 132 61.008 72.374 36.369 1.00 66.71 N -ANISOU 979 N GLY A 132 9875 8277 7195 -855 -281 -1006 N -ATOM 980 CA GLY A 132 61.700 73.363 35.548 1.00 66.33 C -ANISOU 980 CA GLY A 132 9936 8107 7160 -1011 -334 -1062 C -ATOM 981 C GLY A 132 63.134 73.032 35.176 1.00 69.60 C -ANISOU 981 C GLY A 132 10218 8628 7597 -1204 -420 -1038 C -ATOM 982 O GLY A 132 63.562 73.343 34.066 1.00 68.80 O -ANISOU 982 O GLY A 132 10108 8462 7572 -1306 -435 -1028 O -ATOM 983 N SER A 133 63.888 72.401 36.088 1.00 67.15 N -ANISOU 983 N SER A 133 9803 8497 7215 -1249 -475 -1027 N -ATOM 984 CA SER A 133 65.271 71.994 35.824 1.00 67.06 C -ANISOU 984 CA SER A 133 9636 8634 7211 -1408 -559 -1003 C -ATOM 985 C SER A 133 65.374 70.820 34.845 1.00 68.08 C -ANISOU 985 C SER A 133 9548 8839 7481 -1348 -537 -889 C -ATOM 986 O SER A 133 66.326 70.780 34.075 1.00 69.02 O -ANISOU 986 O SER A 133 9569 9015 7642 -1475 -583 -875 O -ATOM 987 CB SER A 133 66.006 71.694 37.123 1.00 72.50 C -ANISOU 987 CB SER A 133 10281 9501 7764 -1449 -632 -1030 C -ATOM 988 OG SER A 133 66.178 72.909 37.835 1.00 86.43 O -ANISOU 988 OG SER A 133 12253 11189 9396 -1555 -670 -1152 O -ATOM 989 N VAL A 134 64.397 69.882 34.863 1.00 61.37 N -ANISOU 989 N VAL A 134 8631 7990 6697 -1165 -464 -810 N -ATOM 990 CA VAL A 134 64.316 68.737 33.948 1.00 59.06 C -ANISOU 990 CA VAL A 134 8165 7739 6536 -1093 -435 -706 C -ATOM 991 C VAL A 134 63.918 69.279 32.551 1.00 61.89 C -ANISOU 991 C VAL A 134 8561 7947 7006 -1115 -398 -709 C -ATOM 992 O VAL A 134 64.505 68.877 31.542 1.00 60.86 O -ANISOU 992 O VAL A 134 8316 7850 6958 -1166 -416 -664 O -ATOM 993 CB VAL A 134 63.347 67.613 34.465 1.00 61.74 C -ANISOU 993 CB VAL A 134 8449 8112 6897 -917 -366 -627 C -ATOM 994 CG1 VAL A 134 63.172 66.489 33.439 1.00 59.89 C -ANISOU 994 CG1 VAL A 134 8070 7888 6799 -853 -333 -529 C -ATOM 995 CG2 VAL A 134 63.831 67.030 35.785 1.00 62.11 C -ANISOU 995 CG2 VAL A 134 8468 8307 6825 -894 -404 -612 C -ATOM 996 N ALA A 135 62.944 70.212 32.511 1.00 58.46 N -ANISOU 996 N ALA A 135 8297 7354 6561 -1066 -348 -764 N -ATOM 997 CA ALA A 135 62.451 70.839 31.288 1.00 57.32 C -ANISOU 997 CA ALA A 135 8223 7056 6499 -1060 -313 -771 C -ATOM 998 C ALA A 135 63.546 71.692 30.624 1.00 62.86 C -ANISOU 998 C ALA A 135 8981 7716 7188 -1257 -372 -813 C -ATOM 999 O ALA A 135 63.658 71.679 29.394 1.00 63.08 O -ANISOU 999 O ALA A 135 8964 7697 7307 -1286 -362 -777 O -ATOM 1000 CB ALA A 135 61.223 71.673 31.587 1.00 58.23 C -ANISOU 1000 CB ALA A 135 8520 7031 6574 -942 -255 -828 C -ATOM 1001 N ALA A 136 64.379 72.382 31.431 1.00 60.01 N -ANISOU 1001 N ALA A 136 8707 7385 6708 -1403 -434 -887 N -ATOM 1002 CA ALA A 136 65.511 73.187 30.943 1.00 60.66 C -ANISOU 1002 CA ALA A 136 8836 7453 6758 -1631 -493 -931 C -ATOM 1003 C ALA A 136 66.577 72.259 30.357 1.00 65.03 C -ANISOU 1003 C ALA A 136 9143 8196 7369 -1708 -532 -863 C -ATOM 1004 O ALA A 136 67.126 72.557 29.301 1.00 64.75 O -ANISOU 1004 O ALA A 136 9083 8139 7379 -1828 -538 -851 O -ATOM 1005 CB ALA A 136 66.105 74.017 32.071 1.00 62.80 C -ANISOU 1005 CB ALA A 136 9246 7738 6879 -1773 -555 -1030 C -ATOM 1006 N LEU A 137 66.836 71.117 31.019 1.00 62.43 N -ANISOU 1006 N LEU A 137 8638 8050 7032 -1624 -553 -814 N -ATOM 1007 CA LEU A 137 67.784 70.101 30.563 1.00 63.32 C -ANISOU 1007 CA LEU A 137 8517 8352 7188 -1644 -589 -747 C -ATOM 1008 C LEU A 137 67.341 69.598 29.179 1.00 65.73 C -ANISOU 1008 C LEU A 137 8753 8588 7635 -1564 -533 -674 C -ATOM 1009 O LEU A 137 68.157 69.541 28.259 1.00 66.05 O -ANISOU 1009 O LEU A 137 8692 8693 7711 -1662 -552 -654 O -ATOM 1010 CB LEU A 137 67.797 68.948 31.573 1.00 64.29 C -ANISOU 1010 CB LEU A 137 8524 8630 7274 -1507 -606 -699 C -ATOM 1011 CG LEU A 137 68.942 67.954 31.486 1.00 70.70 C -ANISOU 1011 CG LEU A 137 9116 9669 8076 -1514 -665 -648 C -ATOM 1012 CD1 LEU A 137 70.202 68.535 32.110 1.00 73.57 C -ANISOU 1012 CD1 LEU A 137 9444 10195 8313 -1695 -758 -719 C -ATOM 1013 CD2 LEU A 137 68.582 66.673 32.220 1.00 72.36 C -ANISOU 1013 CD2 LEU A 137 9255 9961 8279 -1324 -654 -575 C -ATOM 1014 N LEU A 138 66.030 69.317 29.022 1.00 59.04 N -ANISOU 1014 N LEU A 138 7963 7612 6857 -1396 -462 -642 N -ATOM 1015 CA LEU A 138 65.432 68.898 27.765 1.00 56.76 C -ANISOU 1015 CA LEU A 138 7627 7245 6693 -1313 -410 -584 C -ATOM 1016 C LEU A 138 65.606 69.974 26.693 1.00 61.32 C -ANISOU 1016 C LEU A 138 8309 7698 7292 -1432 -404 -618 C -ATOM 1017 O LEU A 138 65.990 69.668 25.571 1.00 61.64 O -ANISOU 1017 O LEU A 138 8257 7762 7402 -1461 -400 -576 O -ATOM 1018 CB LEU A 138 63.946 68.564 27.988 1.00 55.88 C -ANISOU 1018 CB LEU A 138 7566 7038 6627 -1131 -340 -562 C -ATOM 1019 CG LEU A 138 63.179 68.002 26.788 1.00 58.35 C -ANISOU 1019 CG LEU A 138 7819 7287 7065 -1031 -289 -505 C -ATOM 1020 CD1 LEU A 138 63.731 66.652 26.338 1.00 56.51 C -ANISOU 1020 CD1 LEU A 138 7400 7176 6893 -1001 -304 -428 C -ATOM 1021 CD2 LEU A 138 61.702 67.931 27.091 1.00 60.60 C -ANISOU 1021 CD2 LEU A 138 8161 7495 7371 -882 -223 -503 C -ATOM 1022 N THR A 139 65.357 71.229 27.051 1.00 59.36 N -ANISOU 1022 N THR A 139 8267 7315 6971 -1499 -404 -693 N -ATOM 1023 CA THR A 139 65.522 72.398 26.186 1.00 59.39 C -ANISOU 1023 CA THR A 139 8427 7171 6969 -1624 -399 -729 C -ATOM 1024 C THR A 139 66.971 72.473 25.688 1.00 62.31 C -ANISOU 1024 C THR A 139 8693 7662 7319 -1838 -447 -725 C -ATOM 1025 O THR A 139 67.188 72.628 24.490 1.00 62.51 O -ANISOU 1025 O THR A 139 8705 7647 7400 -1892 -428 -693 O -ATOM 1026 CB THR A 139 65.071 73.659 26.953 1.00 68.48 C -ANISOU 1026 CB THR A 139 9841 8160 8019 -1650 -398 -818 C -ATOM 1027 OG1 THR A 139 63.683 73.528 27.256 1.00 69.69 O -ANISOU 1027 OG1 THR A 139 10058 8226 8197 -1428 -342 -815 O -ATOM 1028 CG2 THR A 139 65.282 74.928 26.172 1.00 69.25 C -ANISOU 1028 CG2 THR A 139 10146 8079 8087 -1791 -396 -858 C -ATOM 1029 N VAL A 140 67.946 72.350 26.607 1.00 58.34 N -ANISOU 1029 N VAL A 140 8108 7328 6732 -1954 -509 -756 N -ATOM 1030 CA VAL A 140 69.385 72.388 26.319 1.00 58.68 C -ANISOU 1030 CA VAL A 140 8017 7544 6736 -2161 -562 -761 C -ATOM 1031 C VAL A 140 69.782 71.266 25.335 1.00 62.62 C -ANISOU 1031 C VAL A 140 8279 8186 7328 -2088 -549 -674 C -ATOM 1032 O VAL A 140 70.459 71.550 24.337 1.00 63.25 O -ANISOU 1032 O VAL A 140 8311 8297 7424 -2221 -544 -661 O -ATOM 1033 CB VAL A 140 70.237 72.414 27.623 1.00 62.82 C -ANISOU 1033 CB VAL A 140 8488 8242 7138 -2270 -638 -818 C -ATOM 1034 CG1 VAL A 140 71.719 72.169 27.349 1.00 63.07 C -ANISOU 1034 CG1 VAL A 140 8310 8521 7131 -2448 -695 -814 C -ATOM 1035 CG2 VAL A 140 70.042 73.729 28.371 1.00 63.79 C -ANISOU 1035 CG2 VAL A 140 8874 8208 7158 -2396 -654 -917 C -ATOM 1036 N VAL A 141 69.312 70.021 25.585 1.00 57.77 N -ANISOU 1036 N VAL A 141 7538 7643 6770 -1877 -537 -616 N -ATOM 1037 CA VAL A 141 69.580 68.859 24.727 1.00 56.49 C -ANISOU 1037 CA VAL A 141 7179 7593 6691 -1775 -525 -538 C -ATOM 1038 C VAL A 141 69.033 69.100 23.321 1.00 61.77 C -ANISOU 1038 C VAL A 141 7904 8112 7452 -1756 -467 -508 C -ATOM 1039 O VAL A 141 69.759 68.890 22.347 1.00 62.42 O -ANISOU 1039 O VAL A 141 7875 8282 7561 -1817 -467 -478 O -ATOM 1040 CB VAL A 141 69.116 67.521 25.353 1.00 58.95 C -ANISOU 1040 CB VAL A 141 7394 7971 7033 -1563 -521 -484 C -ATOM 1041 CG1 VAL A 141 69.251 66.359 24.366 1.00 57.56 C -ANISOU 1041 CG1 VAL A 141 7064 7862 6945 -1447 -502 -408 C -ATOM 1042 CG2 VAL A 141 69.900 67.225 26.635 1.00 59.61 C -ANISOU 1042 CG2 VAL A 141 7402 8238 7009 -1584 -587 -504 C -ATOM 1043 N PHE A 142 67.796 69.617 23.212 1.00 57.83 N -ANISOU 1043 N PHE A 142 7581 7400 6990 -1673 -420 -520 N -ATOM 1044 CA PHE A 142 67.212 69.950 21.911 1.00 56.43 C -ANISOU 1044 CA PHE A 142 7478 7076 6887 -1644 -372 -496 C -ATOM 1045 C PHE A 142 67.993 71.043 21.187 1.00 60.69 C -ANISOU 1045 C PHE A 142 8103 7573 7382 -1854 -377 -522 C -ATOM 1046 O PHE A 142 68.307 70.862 20.015 1.00 61.67 O -ANISOU 1046 O PHE A 142 8158 7720 7553 -1878 -357 -481 O -ATOM 1047 CB PHE A 142 65.742 70.337 22.048 1.00 57.80 C -ANISOU 1047 CB PHE A 142 7818 7056 7087 -1502 -329 -512 C -ATOM 1048 CG PHE A 142 64.808 69.239 21.620 1.00 58.19 C -ANISOU 1048 CG PHE A 142 7767 7107 7235 -1305 -293 -455 C -ATOM 1049 CD1 PHE A 142 64.464 68.215 22.499 1.00 60.90 C -ANISOU 1049 CD1 PHE A 142 8013 7537 7588 -1193 -293 -432 C -ATOM 1050 CD2 PHE A 142 64.244 69.240 20.348 1.00 58.78 C -ANISOU 1050 CD2 PHE A 142 7857 7092 7385 -1241 -259 -425 C -ATOM 1051 CE1 PHE A 142 63.597 67.188 22.098 1.00 60.26 C -ANISOU 1051 CE1 PHE A 142 7851 7451 7594 -1039 -259 -381 C -ATOM 1052 CE2 PHE A 142 63.369 68.225 19.955 1.00 60.61 C -ANISOU 1052 CE2 PHE A 142 7997 7331 7702 -1079 -231 -381 C -ATOM 1053 CZ PHE A 142 63.057 67.199 20.831 1.00 58.22 C -ANISOU 1053 CZ PHE A 142 7599 7111 7411 -989 -231 -360 C -ATOM 1054 N TYR A 143 68.344 72.150 21.874 1.00 56.47 N -ANISOU 1054 N TYR A 143 7723 6983 6751 -2019 -402 -590 N -ATOM 1055 CA TYR A 143 69.101 73.229 21.236 1.00 56.54 C -ANISOU 1055 CA TYR A 143 7837 6940 6706 -2252 -404 -615 C -ATOM 1056 C TYR A 143 70.455 72.741 20.691 1.00 59.68 C -ANISOU 1056 C TYR A 143 8007 7573 7096 -2395 -425 -584 C -ATOM 1057 O TYR A 143 70.748 72.979 19.523 1.00 58.45 O -ANISOU 1057 O TYR A 143 7852 7393 6962 -2474 -393 -552 O -ATOM 1058 CB TYR A 143 69.245 74.466 22.152 1.00 58.29 C -ANISOU 1058 CB TYR A 143 8281 7053 6814 -2417 -432 -701 C -ATOM 1059 CG TYR A 143 69.870 75.641 21.428 1.00 59.72 C -ANISOU 1059 CG TYR A 143 8620 7132 6938 -2667 -423 -722 C -ATOM 1060 CD1 TYR A 143 69.140 76.388 20.503 1.00 61.17 C -ANISOU 1060 CD1 TYR A 143 9027 7072 7144 -2629 -372 -706 C -ATOM 1061 CD2 TYR A 143 71.208 75.980 21.629 1.00 61.38 C -ANISOU 1061 CD2 TYR A 143 8751 7503 7066 -2944 -465 -754 C -ATOM 1062 CE1 TYR A 143 69.720 77.461 19.817 1.00 62.02 C -ANISOU 1062 CE1 TYR A 143 9305 7070 7190 -2867 -359 -717 C -ATOM 1063 CE2 TYR A 143 71.803 77.037 20.933 1.00 63.10 C -ANISOU 1063 CE2 TYR A 143 9116 7632 7227 -3203 -449 -767 C -ATOM 1064 CZ TYR A 143 71.053 77.775 20.031 1.00 66.69 C -ANISOU 1064 CZ TYR A 143 9819 7816 7702 -3165 -393 -746 C -ATOM 1065 OH TYR A 143 71.637 78.795 19.328 1.00 68.19 O -ANISOU 1065 OH TYR A 143 10173 7906 7829 -3424 -372 -749 O -ATOM 1066 N ILE A 144 71.256 72.038 21.532 1.00 56.64 N -ANISOU 1066 N ILE A 144 7424 7426 6672 -2412 -478 -592 N -ATOM 1067 CA ILE A 144 72.562 71.479 21.169 1.00 56.38 C -ANISOU 1067 CA ILE A 144 7143 7663 6616 -2513 -504 -569 C -ATOM 1068 C ILE A 144 72.414 70.575 19.953 1.00 57.42 C -ANISOU 1068 C ILE A 144 7145 7828 6845 -2363 -461 -492 C -ATOM 1069 O ILE A 144 73.118 70.769 18.968 1.00 57.81 O -ANISOU 1069 O ILE A 144 7126 7950 6889 -2483 -440 -472 O -ATOM 1070 CB ILE A 144 73.246 70.753 22.375 1.00 60.14 C -ANISOU 1070 CB ILE A 144 7438 8384 7030 -2484 -574 -588 C -ATOM 1071 CG1 ILE A 144 73.695 71.783 23.451 1.00 62.23 C -ANISOU 1071 CG1 ILE A 144 7814 8655 7173 -2697 -627 -676 C -ATOM 1072 CG2 ILE A 144 74.444 69.899 21.893 1.00 61.55 C -ANISOU 1072 CG2 ILE A 144 7328 8862 7196 -2497 -597 -550 C -ATOM 1073 CD1 ILE A 144 74.301 71.201 24.762 1.00 66.94 C -ANISOU 1073 CD1 ILE A 144 8262 9484 7688 -2669 -704 -704 C -ATOM 1074 N ALA A 145 71.473 69.617 20.013 1.00 52.20 N -ANISOU 1074 N ALA A 145 6458 7108 6266 -2110 -444 -452 N -ATOM 1075 CA ALA A 145 71.204 68.661 18.947 1.00 50.25 C -ANISOU 1075 CA ALA A 145 6106 6876 6111 -1949 -409 -387 C -ATOM 1076 C ALA A 145 70.767 69.329 17.660 1.00 55.49 C -ANISOU 1076 C ALA A 145 6894 7372 6817 -1989 -355 -370 C -ATOM 1077 O ALA A 145 71.230 68.914 16.602 1.00 55.52 O -ANISOU 1077 O ALA A 145 6785 7462 6848 -1983 -335 -330 O -ATOM 1078 CB ALA A 145 70.181 67.650 19.394 1.00 49.30 C -ANISOU 1078 CB ALA A 145 5978 6697 6058 -1710 -402 -358 C -ATOM 1079 N ALA A 146 69.920 70.390 17.742 1.00 52.76 N -ANISOU 1079 N ALA A 146 6787 6794 6464 -2022 -334 -401 N -ATOM 1080 CA ALA A 146 69.446 71.143 16.574 1.00 52.11 C -ANISOU 1080 CA ALA A 146 6859 6533 6406 -2049 -287 -385 C -ATOM 1081 C ALA A 146 70.596 71.839 15.852 1.00 57.88 C -ANISOU 1081 C ALA A 146 7581 7336 7074 -2290 -278 -382 C -ATOM 1082 O ALA A 146 70.679 71.721 14.630 1.00 58.93 O -ANISOU 1082 O ALA A 146 7684 7468 7239 -2280 -241 -337 O -ATOM 1083 CB ALA A 146 68.379 72.137 16.969 1.00 52.99 C -ANISOU 1083 CB ALA A 146 7235 6397 6502 -2015 -274 -423 C -ATOM 1084 N VAL A 147 71.524 72.480 16.597 1.00 54.47 N -ANISOU 1084 N VAL A 147 7156 6993 6549 -2513 -311 -430 N -ATOM 1085 CA VAL A 147 72.712 73.136 16.022 1.00 55.17 C -ANISOU 1085 CA VAL A 147 7214 7186 6564 -2785 -302 -432 C -ATOM 1086 C VAL A 147 73.605 72.072 15.327 1.00 60.86 C -ANISOU 1086 C VAL A 147 7634 8183 7306 -2751 -297 -383 C -ATOM 1087 O VAL A 147 74.064 72.300 14.207 1.00 61.36 O -ANISOU 1087 O VAL A 147 7674 8282 7359 -2851 -254 -349 O -ATOM 1088 CB VAL A 147 73.496 73.979 17.075 1.00 59.07 C -ANISOU 1088 CB VAL A 147 7761 7736 6945 -3042 -348 -503 C -ATOM 1089 CG1 VAL A 147 74.752 74.587 16.473 1.00 60.20 C -ANISOU 1089 CG1 VAL A 147 7848 8017 7010 -3347 -335 -504 C -ATOM 1090 CG2 VAL A 147 72.621 75.071 17.689 1.00 58.75 C -ANISOU 1090 CG2 VAL A 147 8045 7406 6872 -3065 -350 -556 C -ATOM 1091 N MET A 148 73.800 70.904 15.970 1.00 58.21 N -ANISOU 1091 N MET A 148 7088 8034 6995 -2590 -336 -378 N -ATOM 1092 CA MET A 148 74.616 69.808 15.435 1.00 58.83 C -ANISOU 1092 CA MET A 148 6893 8375 7084 -2511 -338 -338 C -ATOM 1093 C MET A 148 74.050 69.272 14.155 1.00 59.08 C -ANISOU 1093 C MET A 148 6927 8323 7198 -2350 -285 -281 C -ATOM 1094 O MET A 148 74.772 69.224 13.162 1.00 59.24 O -ANISOU 1094 O MET A 148 6840 8472 7198 -2420 -253 -253 O -ATOM 1095 CB MET A 148 74.780 68.672 16.451 1.00 61.89 C -ANISOU 1095 CB MET A 148 7112 8930 7475 -2337 -393 -341 C -ATOM 1096 CG MET A 148 75.833 68.949 17.497 1.00 69.06 C -ANISOU 1096 CG MET A 148 7910 10053 8275 -2502 -455 -391 C -ATOM 1097 SD MET A 148 75.921 67.613 18.717 1.00 75.24 S -ANISOU 1097 SD MET A 148 8525 11013 9050 -2266 -522 -385 S -ATOM 1098 CE MET A 148 76.805 66.358 17.761 1.00 72.10 C -ANISOU 1098 CE MET A 148 7849 10888 8659 -2123 -512 -330 C -ATOM 1099 N ALA A 149 72.743 68.903 14.171 1.00 51.85 N -ANISOU 1099 N ALA A 149 6134 7200 6369 -2142 -275 -267 N -ATOM 1100 CA ALA A 149 71.986 68.370 13.043 1.00 49.08 C -ANISOU 1100 CA ALA A 149 5806 6743 6100 -1971 -235 -222 C -ATOM 1101 C ALA A 149 71.985 69.321 11.847 1.00 51.68 C -ANISOU 1101 C ALA A 149 6266 6958 6412 -2096 -184 -205 C -ATOM 1102 O ALA A 149 72.138 68.868 10.718 1.00 50.04 O -ANISOU 1102 O ALA A 149 5986 6799 6229 -2034 -152 -166 O -ATOM 1103 CB ALA A 149 70.566 68.053 13.477 1.00 48.51 C -ANISOU 1103 CB ALA A 149 5852 6477 6102 -1779 -238 -225 C -ATOM 1104 N THR A 150 71.840 70.635 12.089 1.00 49.90 N -ANISOU 1104 N THR A 150 6246 6578 6135 -2270 -176 -234 N -ATOM 1105 CA THR A 150 71.883 71.638 11.019 1.00 50.85 C -ANISOU 1105 CA THR A 150 6529 6571 6221 -2407 -127 -213 C -ATOM 1106 C THR A 150 73.259 71.621 10.332 1.00 56.97 C -ANISOU 1106 C THR A 150 7135 7579 6934 -2591 -103 -190 C -ATOM 1107 O THR A 150 73.313 71.511 9.104 1.00 57.44 O -ANISOU 1107 O THR A 150 7179 7643 7002 -2565 -57 -145 O -ATOM 1108 CB THR A 150 71.498 73.032 11.529 1.00 57.53 C -ANISOU 1108 CB THR A 150 7658 7190 7010 -2551 -128 -252 C -ATOM 1109 OG1 THR A 150 70.324 72.925 12.323 1.00 54.76 O -ANISOU 1109 OG1 THR A 150 7411 6687 6707 -2364 -153 -279 O -ATOM 1110 CG2 THR A 150 71.228 74.003 10.399 1.00 58.05 C -ANISOU 1110 CG2 THR A 150 7949 7062 7048 -2627 -77 -221 C -ATOM 1111 N ASN A 151 74.361 71.688 11.122 1.00 54.14 N -ANISOU 1111 N ASN A 151 6633 7433 6504 -2767 -134 -223 N -ATOM 1112 CA ASN A 151 75.734 71.665 10.590 1.00 55.07 C -ANISOU 1112 CA ASN A 151 6552 7823 6550 -2952 -112 -208 C -ATOM 1113 C ASN A 151 76.079 70.352 9.909 1.00 56.86 C -ANISOU 1113 C ASN A 151 6527 8262 6815 -2753 -101 -169 C -ATOM 1114 O ASN A 151 76.683 70.379 8.849 1.00 58.94 O -ANISOU 1114 O ASN A 151 6715 8632 7046 -2822 -49 -134 O -ATOM 1115 CB ASN A 151 76.783 71.983 11.668 1.00 57.47 C -ANISOU 1115 CB ASN A 151 6739 8333 6765 -3173 -159 -261 C -ATOM 1116 CG ASN A 151 76.678 73.338 12.324 1.00 74.05 C -ANISOU 1116 CG ASN A 151 9089 10244 8802 -3415 -172 -309 C -ATOM 1117 OD1 ASN A 151 77.036 73.497 13.489 1.00 73.28 O -ANISOU 1117 OD1 ASN A 151 8963 10219 8660 -3499 -230 -366 O -ATOM 1118 ND2 ASN A 151 76.204 74.344 11.607 1.00 64.86 N -ANISOU 1118 ND2 ASN A 151 8189 8832 7623 -3528 -120 -291 N -ATOM 1119 N LEU A 152 75.693 69.217 10.495 1.00 50.63 N -ANISOU 1119 N LEU A 152 5626 7523 6088 -2506 -144 -173 N -ATOM 1120 CA LEU A 152 75.978 67.889 9.950 1.00 49.27 C -ANISOU 1120 CA LEU A 152 5244 7529 5948 -2292 -141 -142 C -ATOM 1121 C LEU A 152 75.216 67.542 8.673 1.00 53.78 C -ANISOU 1121 C LEU A 152 5896 7952 6585 -2135 -93 -100 C -ATOM 1122 O LEU A 152 75.844 67.116 7.704 1.00 54.32 O -ANISOU 1122 O LEU A 152 5833 8178 6630 -2110 -58 -72 O -ATOM 1123 CB LEU A 152 75.696 66.780 10.993 1.00 47.66 C -ANISOU 1123 CB LEU A 152 4948 7377 5786 -2072 -201 -155 C -ATOM 1124 CG LEU A 152 76.604 66.668 12.211 1.00 51.35 C -ANISOU 1124 CG LEU A 152 5264 8068 6179 -2148 -260 -191 C -ATOM 1125 CD1 LEU A 152 75.963 65.781 13.264 1.00 49.04 C -ANISOU 1125 CD1 LEU A 152 4982 7716 5933 -1936 -311 -197 C -ATOM 1126 CD2 LEU A 152 77.956 66.138 11.833 1.00 52.07 C -ANISOU 1126 CD2 LEU A 152 5082 8504 6196 -2159 -260 -183 C -ATOM 1127 N TYR A 153 73.863 67.664 8.693 1.00 48.57 N -ANISOU 1127 N TYR A 153 5438 7013 6003 -2015 -96 -99 N -ATOM 1128 CA TYR A 153 72.964 67.185 7.637 1.00 46.20 C -ANISOU 1128 CA TYR A 153 5209 6573 5773 -1831 -69 -68 C -ATOM 1129 C TYR A 153 72.180 68.237 6.830 1.00 50.81 C -ANISOU 1129 C TYR A 153 6029 6916 6360 -1892 -30 -53 C -ATOM 1130 O TYR A 153 71.462 67.859 5.913 1.00 51.49 O -ANISOU 1130 O TYR A 153 6163 6907 6494 -1743 -13 -30 O -ATOM 1131 CB TYR A 153 71.967 66.182 8.264 1.00 44.59 C -ANISOU 1131 CB TYR A 153 5009 6279 5657 -1596 -109 -77 C -ATOM 1132 CG TYR A 153 72.616 65.218 9.240 1.00 46.39 C -ANISOU 1132 CG TYR A 153 5055 6700 5873 -1523 -153 -89 C -ATOM 1133 CD1 TYR A 153 73.620 64.346 8.826 1.00 48.61 C -ANISOU 1133 CD1 TYR A 153 5134 7215 6119 -1456 -151 -74 C -ATOM 1134 CD2 TYR A 153 72.257 65.210 10.589 1.00 47.18 C -ANISOU 1134 CD2 TYR A 153 5189 6755 5981 -1511 -195 -115 C -ATOM 1135 CE1 TYR A 153 74.248 63.487 9.726 1.00 49.99 C -ANISOU 1135 CE1 TYR A 153 5155 7572 6269 -1369 -196 -82 C -ATOM 1136 CE2 TYR A 153 72.864 64.340 11.496 1.00 47.99 C -ANISOU 1136 CE2 TYR A 153 5140 7034 6060 -1433 -238 -120 C -ATOM 1137 CZ TYR A 153 73.863 63.481 11.060 1.00 57.77 C -ANISOU 1137 CZ TYR A 153 6186 8500 7264 -1359 -240 -103 C -ATOM 1138 OH TYR A 153 74.489 62.630 11.943 1.00 60.04 O -ANISOU 1138 OH TYR A 153 6334 8966 7514 -1262 -287 -106 O -ATOM 1139 N GLY A 154 72.322 69.512 7.144 1.00 46.81 N -ANISOU 1139 N GLY A 154 5678 6312 5797 -2100 -20 -67 N -ATOM 1140 CA GLY A 154 71.568 70.569 6.486 1.00 46.61 C -ANISOU 1140 CA GLY A 154 5910 6040 5761 -2142 12 -52 C -ATOM 1141 C GLY A 154 71.777 70.745 4.998 1.00 53.19 C -ANISOU 1141 C GLY A 154 6771 6876 6563 -2168 68 -3 C -ATOM 1142 O GLY A 154 70.827 71.071 4.286 1.00 54.43 O -ANISOU 1142 O GLY A 154 7105 6836 6740 -2069 83 17 O -ATOM 1143 N ALA A 155 73.017 70.587 4.522 1.00 49.94 N -ANISOU 1143 N ALA A 155 6189 6695 6091 -2300 101 17 N -ATOM 1144 CA ALA A 155 73.387 70.780 3.117 1.00 49.29 C -ANISOU 1144 CA ALA A 155 6120 6649 5961 -2350 164 66 C -ATOM 1145 C ALA A 155 72.947 69.598 2.235 1.00 54.05 C -ANISOU 1145 C ALA A 155 6618 7295 6624 -2087 165 85 C -ATOM 1146 O ALA A 155 72.711 69.779 1.029 1.00 55.46 O -ANISOU 1146 O ALA A 155 6883 7407 6781 -2053 207 123 O -ATOM 1147 CB ALA A 155 74.889 70.982 2.999 1.00 50.49 C -ANISOU 1147 CB ALA A 155 6100 7066 6017 -2588 202 76 C -ATOM 1148 N THR A 156 72.869 68.398 2.835 1.00 48.25 N -ANISOU 1148 N THR A 156 5709 6669 5954 -1908 119 59 N -ATOM 1149 CA THR A 156 72.500 67.159 2.146 1.00 46.77 C -ANISOU 1149 CA THR A 156 5422 6525 5821 -1664 112 66 C -ATOM 1150 C THR A 156 71.024 66.819 2.333 1.00 48.61 C -ANISOU 1150 C THR A 156 5782 6538 6149 -1470 70 50 C -ATOM 1151 O THR A 156 70.457 66.168 1.475 1.00 49.49 O -ANISOU 1151 O THR A 156 5899 6611 6296 -1307 71 58 O -ATOM 1152 CB THR A 156 73.443 65.990 2.536 1.00 49.51 C -ANISOU 1152 CB THR A 156 5509 7139 6162 -1585 93 52 C -ATOM 1153 OG1 THR A 156 73.556 65.923 3.961 1.00 52.71 O -ANISOU 1153 OG1 THR A 156 5867 7577 6583 -1618 43 20 O -ATOM 1154 CG2 THR A 156 74.816 66.126 1.932 1.00 37.13 C -ANISOU 1154 CG2 THR A 156 3782 5828 4496 -1716 144 72 C -ATOM 1155 N PHE A 157 70.413 67.226 3.455 1.00 43.05 N -ANISOU 1155 N PHE A 157 5170 5708 5477 -1489 35 22 N -ATOM 1156 CA PHE A 157 69.001 66.993 3.772 1.00 40.68 C -ANISOU 1156 CA PHE A 157 4975 5224 5257 -1324 0 4 C -ATOM 1157 C PHE A 157 68.349 68.336 4.138 1.00 46.76 C -ANISOU 1157 C PHE A 157 5969 5793 6005 -1414 3 -5 C -ATOM 1158 O PHE A 157 67.884 68.487 5.256 1.00 47.07 O -ANISOU 1158 O PHE A 157 6050 5767 6069 -1404 -27 -36 O -ATOM 1159 CB PHE A 157 68.854 65.912 4.881 1.00 40.75 C -ANISOU 1159 CB PHE A 157 4856 5302 5325 -1214 -45 -23 C -ATOM 1160 CG PHE A 157 69.396 64.579 4.414 1.00 40.76 C -ANISOU 1160 CG PHE A 157 4682 5465 5341 -1090 -49 -13 C -ATOM 1161 CD1 PHE A 157 70.761 64.279 4.530 1.00 43.67 C -ANISOU 1161 CD1 PHE A 157 4884 6059 5651 -1156 -40 -7 C -ATOM 1162 CD2 PHE A 157 68.576 63.668 3.757 1.00 38.74 C -ANISOU 1162 CD2 PHE A 157 4432 5142 5144 -910 -59 -14 C -ATOM 1163 CE1 PHE A 157 71.294 63.106 3.974 1.00 42.53 C -ANISOU 1163 CE1 PHE A 157 4595 6059 5503 -1020 -38 1 C -ATOM 1164 CE2 PHE A 157 69.101 62.471 3.255 1.00 40.76 C -ANISOU 1164 CE2 PHE A 157 4559 5527 5402 -793 -62 -9 C -ATOM 1165 CZ PHE A 157 70.461 62.211 3.348 1.00 39.63 C -ANISOU 1165 CZ PHE A 157 4264 5596 5196 -837 -49 -1 C -ATOM 1166 N PRO A 158 68.289 69.338 3.211 1.00 45.38 N -ANISOU 1166 N PRO A 158 5959 5509 5774 -1493 40 22 N -ATOM 1167 CA PRO A 158 67.730 70.654 3.592 1.00 45.60 C -ANISOU 1167 CA PRO A 158 6229 5330 5765 -1570 41 12 C -ATOM 1168 C PRO A 158 66.265 70.701 4.069 1.00 49.79 C -ANISOU 1168 C PRO A 158 6872 5692 6352 -1385 6 -16 C -ATOM 1169 O PRO A 158 65.969 71.570 4.867 1.00 50.22 O -ANISOU 1169 O PRO A 158 7079 5623 6380 -1439 -2 -41 O -ATOM 1170 CB PRO A 158 67.937 71.498 2.329 1.00 47.69 C -ANISOU 1170 CB PRO A 158 6648 5518 5954 -1658 89 58 C -ATOM 1171 CG PRO A 158 68.099 70.529 1.224 1.00 49.84 C -ANISOU 1171 CG PRO A 158 6774 5914 6247 -1545 104 85 C -ATOM 1172 CD PRO A 158 68.821 69.380 1.823 1.00 45.00 C -ANISOU 1172 CD PRO A 158 5902 5520 5677 -1526 85 65 C -ATOM 1173 N GLU A 159 65.351 69.821 3.593 1.00 46.40 N -ANISOU 1173 N GLU A 159 6372 5264 5993 -1177 -14 -18 N -ATOM 1174 CA GLU A 159 63.929 69.831 4.005 1.00 45.75 C -ANISOU 1174 CA GLU A 159 6366 5059 5959 -1007 -44 -47 C -ATOM 1175 C GLU A 159 63.756 69.524 5.503 1.00 51.01 C -ANISOU 1175 C GLU A 159 6969 5751 6660 -1005 -69 -86 C -ATOM 1176 O GLU A 159 62.841 70.069 6.142 1.00 52.37 O -ANISOU 1176 O GLU A 159 7260 5807 6832 -940 -80 -114 O -ATOM 1177 CB GLU A 159 63.124 68.800 3.207 1.00 46.64 C -ANISOU 1177 CB GLU A 159 6380 5206 6135 -820 -63 -46 C -ATOM 1178 CG GLU A 159 61.608 68.942 3.365 1.00 67.51 C -ANISOU 1178 CG GLU A 159 9102 7740 8810 -652 -89 -73 C -ATOM 1179 CD GLU A 159 60.702 67.744 3.101 1.00 90.31 C -ANISOU 1179 CD GLU A 159 11855 10685 11774 -492 -119 -91 C -ATOM 1180 OE1 GLU A 159 61.135 66.785 2.414 1.00 92.12 O -ANISOU 1180 OE1 GLU A 159 11960 11010 12030 -480 -121 -80 O -ATOM 1181 OE2 GLU A 159 59.538 67.781 3.571 1.00 69.34 O -ANISOU 1181 OE2 GLU A 159 9224 7979 9143 -379 -139 -120 O -ATOM 1182 N TRP A 160 64.619 68.614 6.035 1.00 44.29 N -ANISOU 1182 N TRP A 160 5932 5063 5833 -1058 -76 -87 N -ATOM 1183 CA TRP A 160 64.618 68.149 7.409 1.00 41.79 C -ANISOU 1183 CA TRP A 160 5537 4799 5542 -1056 -100 -115 C -ATOM 1184 C TRP A 160 65.606 68.886 8.303 1.00 45.58 C -ANISOU 1184 C TRP A 160 6046 5315 5956 -1242 -100 -130 C -ATOM 1185 O TRP A 160 65.306 69.049 9.472 1.00 46.71 O -ANISOU 1185 O TRP A 160 6224 5428 6098 -1242 -118 -161 O -ATOM 1186 CB TRP A 160 64.890 66.633 7.472 1.00 39.03 C -ANISOU 1186 CB TRP A 160 4983 4597 5249 -971 -116 -106 C -ATOM 1187 CG TRP A 160 63.958 65.771 6.668 1.00 38.52 C -ANISOU 1187 CG TRP A 160 4884 4503 5247 -808 -122 -100 C -ATOM 1188 CD1 TRP A 160 62.639 66.009 6.386 1.00 40.66 C -ANISOU 1188 CD1 TRP A 160 5244 4657 5547 -699 -127 -114 C -ATOM 1189 CD2 TRP A 160 64.261 64.479 6.114 1.00 37.66 C -ANISOU 1189 CD2 TRP A 160 4637 4498 5175 -731 -129 -86 C -ATOM 1190 NE1 TRP A 160 62.113 64.959 5.655 1.00 38.88 N -ANISOU 1190 NE1 TRP A 160 4938 4460 5376 -582 -139 -110 N -ATOM 1191 CE2 TRP A 160 63.096 64.022 5.447 1.00 40.22 C -ANISOU 1191 CE2 TRP A 160 4984 4749 5550 -600 -139 -94 C -ATOM 1192 CE3 TRP A 160 65.417 63.673 6.085 1.00 38.59 C -ANISOU 1192 CE3 TRP A 160 4618 4768 5278 -753 -130 -72 C -ATOM 1193 CZ2 TRP A 160 63.072 62.819 4.723 1.00 38.07 C -ANISOU 1193 CZ2 TRP A 160 4622 4530 5314 -510 -150 -90 C -ATOM 1194 CZ3 TRP A 160 65.382 62.475 5.377 1.00 38.71 C -ANISOU 1194 CZ3 TRP A 160 4551 4831 5327 -637 -137 -65 C -ATOM 1195 CH2 TRP A 160 64.223 62.064 4.703 1.00 38.11 C -ANISOU 1195 CH2 TRP A 160 4520 4659 5301 -526 -147 -75 C -ATOM 1196 N PHE A 161 66.773 69.322 7.794 1.00 41.89 N -ANISOU 1196 N PHE A 161 5561 4926 5429 -1409 -80 -111 N -ATOM 1197 CA PHE A 161 67.779 69.978 8.639 1.00 42.86 C -ANISOU 1197 CA PHE A 161 5693 5111 5482 -1614 -85 -131 C -ATOM 1198 C PHE A 161 68.353 71.287 8.070 1.00 51.87 C -ANISOU 1198 C PHE A 161 6997 6174 6537 -1819 -52 -120 C -ATOM 1199 O PHE A 161 69.359 71.788 8.579 1.00 53.46 O -ANISOU 1199 O PHE A 161 7180 6460 6673 -2028 -53 -135 O -ATOM 1200 CB PHE A 161 68.910 68.982 8.968 1.00 44.10 C -ANISOU 1200 CB PHE A 161 5603 5517 5637 -1651 -102 -126 C -ATOM 1201 CG PHE A 161 68.425 67.680 9.580 1.00 44.24 C -ANISOU 1201 CG PHE A 161 5488 5596 5726 -1460 -132 -130 C -ATOM 1202 CD1 PHE A 161 68.032 67.621 10.925 1.00 46.05 C -ANISOU 1202 CD1 PHE A 161 5735 5801 5963 -1431 -162 -161 C -ATOM 1203 CD2 PHE A 161 68.348 66.514 8.813 1.00 43.91 C -ANISOU 1203 CD2 PHE A 161 5323 5626 5735 -1313 -128 -103 C -ATOM 1204 CE1 PHE A 161 67.576 66.420 11.490 1.00 45.28 C -ANISOU 1204 CE1 PHE A 161 5534 5750 5922 -1269 -184 -157 C -ATOM 1205 CE2 PHE A 161 67.897 65.310 9.382 1.00 45.65 C -ANISOU 1205 CE2 PHE A 161 5451 5880 6013 -1153 -154 -105 C -ATOM 1206 CZ PHE A 161 67.516 65.271 10.716 1.00 43.64 C -ANISOU 1206 CZ PHE A 161 5216 5602 5765 -1138 -179 -127 C -ATOM 1207 N GLY A 162 67.685 71.852 7.065 1.00 49.88 N -ANISOU 1207 N GLY A 162 6914 5759 6279 -1763 -26 -96 N -ATOM 1208 CA GLY A 162 68.115 73.053 6.351 1.00 51.23 C -ANISOU 1208 CA GLY A 162 7275 5825 6364 -1939 13 -72 C -ATOM 1209 C GLY A 162 68.484 74.241 7.195 1.00 56.45 C -ANISOU 1209 C GLY A 162 8117 6386 6946 -2146 11 -105 C -ATOM 1210 O GLY A 162 69.404 74.980 6.850 1.00 58.68 O -ANISOU 1210 O GLY A 162 8467 6682 7148 -2383 41 -89 O -ATOM 1211 N ASP A 163 67.764 74.428 8.295 1.00 52.38 N -ANISOU 1211 N ASP A 163 7686 5770 6447 -2067 -24 -153 N -ATOM 1212 CA ASP A 163 67.977 75.511 9.242 1.00 53.60 C -ANISOU 1212 CA ASP A 163 8030 5811 6524 -2236 -35 -199 C -ATOM 1213 C ASP A 163 67.613 75.017 10.638 1.00 58.27 C -ANISOU 1213 C ASP A 163 8535 6454 7152 -2142 -79 -253 C -ATOM 1214 O ASP A 163 67.114 73.898 10.763 1.00 57.43 O -ANISOU 1214 O ASP A 163 8247 6445 7129 -1947 -94 -245 O -ATOM 1215 CB ASP A 163 67.184 76.774 8.834 1.00 56.33 C -ANISOU 1215 CB ASP A 163 8729 5865 6811 -2213 -14 -197 C -ATOM 1216 CG ASP A 163 65.675 76.632 8.714 1.00 71.42 C -ANISOU 1216 CG ASP A 163 10724 7638 8773 -1909 -24 -201 C -ATOM 1217 OD1 ASP A 163 65.058 75.985 9.600 1.00 72.68 O -ANISOU 1217 OD1 ASP A 163 10777 7849 8991 -1756 -53 -237 O -ATOM 1218 OD2 ASP A 163 65.098 77.234 7.783 1.00 78.00 O -ANISOU 1218 OD2 ASP A 163 11743 8314 9578 -1829 -1 -168 O -ATOM 1219 N LEU A 164 67.834 75.842 11.675 1.00 56.31 N -ANISOU 1219 N LEU A 164 8430 6131 6834 -2281 -99 -306 N -ATOM 1220 CA LEU A 164 67.546 75.520 13.074 1.00 56.12 C -ANISOU 1220 CA LEU A 164 8352 6149 6822 -2212 -139 -360 C -ATOM 1221 C LEU A 164 66.097 75.111 13.318 1.00 57.78 C -ANISOU 1221 C LEU A 164 8589 6266 7099 -1921 -141 -367 C -ATOM 1222 O LEU A 164 65.836 74.121 14.005 1.00 56.99 O -ANISOU 1222 O LEU A 164 8307 6292 7055 -1799 -161 -374 O -ATOM 1223 CB LEU A 164 67.898 76.728 13.932 1.00 58.70 C -ANISOU 1223 CB LEU A 164 8903 6355 7045 -2408 -155 -421 C -ATOM 1224 CG LEU A 164 68.483 76.453 15.293 1.00 65.02 C -ANISOU 1224 CG LEU A 164 9582 7306 7816 -2499 -201 -475 C -ATOM 1225 CD1 LEU A 164 69.748 75.593 15.183 1.00 66.32 C -ANISOU 1225 CD1 LEU A 164 9439 7768 7993 -2626 -217 -450 C -ATOM 1226 CD2 LEU A 164 68.813 77.754 15.978 1.00 69.09 C -ANISOU 1226 CD2 LEU A 164 10356 7677 8218 -2713 -217 -540 C -ATOM 1227 N SER A 165 65.161 75.867 12.735 1.00 53.85 N -ANISOU 1227 N SER A 165 8318 5557 6586 -1810 -119 -362 N -ATOM 1228 CA SER A 165 63.719 75.641 12.813 1.00 52.30 C -ANISOU 1228 CA SER A 165 8159 5276 6438 -1534 -117 -370 C -ATOM 1229 C SER A 165 63.323 74.256 12.271 1.00 53.45 C -ANISOU 1229 C SER A 165 8046 5572 6689 -1373 -116 -329 C -ATOM 1230 O SER A 165 62.589 73.514 12.932 1.00 51.51 O -ANISOU 1230 O SER A 165 7688 5387 6496 -1219 -126 -344 O -ATOM 1231 CB SER A 165 62.990 76.745 12.057 1.00 54.85 C -ANISOU 1231 CB SER A 165 8769 5365 6707 -1458 -96 -366 C -ATOM 1232 OG SER A 165 63.332 77.967 12.687 1.00 66.41 O -ANISOU 1232 OG SER A 165 10493 6674 8067 -1609 -99 -410 O -ATOM 1233 N LYS A 166 63.833 73.914 11.075 1.00 49.10 N -ANISOU 1233 N LYS A 166 7411 5083 6162 -1419 -101 -278 N -ATOM 1234 CA LYS A 166 63.576 72.634 10.441 1.00 47.11 C -ANISOU 1234 CA LYS A 166 6938 4962 5999 -1285 -102 -242 C -ATOM 1235 C LYS A 166 64.132 71.499 11.278 1.00 48.32 C -ANISOU 1235 C LYS A 166 6857 5305 6196 -1304 -123 -247 C -ATOM 1236 O LYS A 166 63.458 70.475 11.425 1.00 47.70 O -ANISOU 1236 O LYS A 166 6648 5287 6188 -1148 -131 -242 O -ATOM 1237 CB LYS A 166 64.155 72.595 9.029 1.00 49.93 C -ANISOU 1237 CB LYS A 166 7271 5347 6351 -1348 -80 -192 C -ATOM 1238 CG LYS A 166 63.425 73.455 8.021 1.00 48.12 C -ANISOU 1238 CG LYS A 166 7255 4940 6089 -1268 -61 -173 C -ATOM 1239 CD LYS A 166 64.287 73.524 6.800 1.00 58.86 C -ANISOU 1239 CD LYS A 166 8607 6339 7418 -1390 -33 -123 C -ATOM 1240 CE LYS A 166 63.674 74.167 5.591 1.00 65.18 C -ANISOU 1240 CE LYS A 166 9583 6997 8187 -1294 -15 -90 C -ATOM 1241 NZ LYS A 166 64.551 73.957 4.407 1.00 76.12 N -ANISOU 1241 NZ LYS A 166 10905 8467 9549 -1398 16 -37 N -ATOM 1242 N SER A 167 65.330 71.700 11.861 1.00 44.55 N -ANISOU 1242 N SER A 167 6338 4922 5667 -1496 -134 -259 N -ATOM 1243 CA SER A 167 66.006 70.725 12.729 1.00 43.53 C -ANISOU 1243 CA SER A 167 6002 4983 5554 -1520 -161 -265 C -ATOM 1244 C SER A 167 65.254 70.506 14.022 1.00 47.78 C -ANISOU 1244 C SER A 167 6554 5498 6104 -1418 -179 -300 C -ATOM 1245 O SER A 167 65.065 69.353 14.402 1.00 48.00 O -ANISOU 1245 O SER A 167 6424 5630 6185 -1308 -190 -285 O -ATOM 1246 CB SER A 167 67.445 71.133 13.012 1.00 46.47 C -ANISOU 1246 CB SER A 167 6332 5473 5850 -1755 -173 -276 C -ATOM 1247 OG SER A 167 68.190 71.108 11.809 1.00 51.44 O -ANISOU 1247 OG SER A 167 6897 6176 6472 -1839 -149 -236 O -ATOM 1248 N LEU A 168 64.768 71.583 14.672 1.00 45.04 N -ANISOU 1248 N LEU A 168 6409 5003 5701 -1443 -179 -344 N -ATOM 1249 CA LEU A 168 63.988 71.454 15.913 1.00 44.38 C -ANISOU 1249 CA LEU A 168 6349 4898 5615 -1337 -188 -381 C -ATOM 1250 C LEU A 168 62.735 70.656 15.658 1.00 46.86 C -ANISOU 1250 C LEU A 168 6596 5200 6010 -1119 -170 -360 C -ATOM 1251 O LEU A 168 62.415 69.774 16.441 1.00 46.55 O -ANISOU 1251 O LEU A 168 6438 5248 6001 -1039 -175 -358 O -ATOM 1252 CB LEU A 168 63.661 72.818 16.540 1.00 45.87 C -ANISOU 1252 CB LEU A 168 6788 4920 5719 -1385 -187 -438 C -ATOM 1253 CG LEU A 168 64.812 73.517 17.287 1.00 52.54 C -ANISOU 1253 CG LEU A 168 7694 5795 6473 -1616 -215 -478 C -ATOM 1254 CD1 LEU A 168 64.537 75.031 17.467 1.00 54.06 C -ANISOU 1254 CD1 LEU A 168 8196 5770 6575 -1687 -209 -530 C -ATOM 1255 CD2 LEU A 168 65.095 72.851 18.629 1.00 52.82 C -ANISOU 1255 CD2 LEU A 168 7596 5980 6494 -1618 -247 -501 C -ATOM 1256 N TYR A 169 62.064 70.902 14.521 1.00 44.53 N -ANISOU 1256 N TYR A 169 6367 4809 5744 -1032 -150 -342 N -ATOM 1257 CA TYR A 169 60.873 70.140 14.133 1.00 43.33 C -ANISOU 1257 CA TYR A 169 6136 4665 5665 -841 -138 -326 C -ATOM 1258 C TYR A 169 61.170 68.636 13.906 1.00 47.11 C -ANISOU 1258 C TYR A 169 6390 5292 6218 -816 -146 -286 C -ATOM 1259 O TYR A 169 60.475 67.792 14.479 1.00 46.88 O -ANISOU 1259 O TYR A 169 6270 5313 6230 -719 -143 -285 O -ATOM 1260 CB TYR A 169 60.164 70.763 12.922 1.00 42.98 C -ANISOU 1260 CB TYR A 169 6209 4502 5622 -753 -125 -318 C -ATOM 1261 CG TYR A 169 58.910 70.005 12.536 1.00 41.02 C -ANISOU 1261 CG TYR A 169 5864 4283 5441 -567 -119 -311 C -ATOM 1262 CD1 TYR A 169 58.963 68.937 11.645 1.00 40.38 C -ANISOU 1262 CD1 TYR A 169 5628 4285 5428 -539 -125 -275 C -ATOM 1263 CD2 TYR A 169 57.670 70.350 13.070 1.00 42.07 C -ANISOU 1263 CD2 TYR A 169 6056 4370 5558 -424 -109 -345 C -ATOM 1264 CE1 TYR A 169 57.826 68.204 11.322 1.00 38.47 C -ANISOU 1264 CE1 TYR A 169 5295 4079 5243 -397 -124 -275 C -ATOM 1265 CE2 TYR A 169 56.518 69.637 12.736 1.00 42.58 C -ANISOU 1265 CE2 TYR A 169 6008 4492 5679 -275 -104 -343 C -ATOM 1266 CZ TYR A 169 56.606 68.560 11.863 1.00 46.88 C -ANISOU 1266 CZ TYR A 169 6402 5115 6295 -274 -114 -308 C -ATOM 1267 OH TYR A 169 55.485 67.857 11.495 1.00 49.51 O -ANISOU 1267 OH TYR A 169 6629 5506 6678 -152 -114 -311 O -ATOM 1268 N THR A 170 62.205 68.310 13.104 1.00 43.73 N -ANISOU 1268 N THR A 170 5885 4934 5798 -904 -153 -255 N -ATOM 1269 CA THR A 170 62.582 66.912 12.809 1.00 42.89 C -ANISOU 1269 CA THR A 170 5591 4957 5748 -865 -162 -220 C -ATOM 1270 C THR A 170 63.006 66.153 14.070 1.00 47.05 C -ANISOU 1270 C THR A 170 6016 5591 6268 -878 -179 -221 C -ATOM 1271 O THR A 170 62.678 64.980 14.217 1.00 46.95 O -ANISOU 1271 O THR A 170 5901 5632 6304 -787 -181 -200 O -ATOM 1272 CB THR A 170 63.623 66.847 11.687 1.00 45.12 C -ANISOU 1272 CB THR A 170 5821 5300 6022 -943 -160 -192 C -ATOM 1273 OG1 THR A 170 63.136 67.625 10.595 1.00 46.86 O -ANISOU 1273 OG1 THR A 170 6161 5405 6236 -924 -143 -188 O -ATOM 1274 CG2 THR A 170 63.869 65.432 11.209 1.00 38.70 C -ANISOU 1274 CG2 THR A 170 4845 4596 5263 -865 -167 -161 C -ATOM 1275 N LEU A 171 63.728 66.817 14.973 1.00 44.20 N -ANISOU 1275 N LEU A 171 5697 5258 5839 -993 -193 -246 N -ATOM 1276 CA LEU A 171 64.168 66.206 16.227 1.00 43.55 C -ANISOU 1276 CA LEU A 171 5533 5284 5732 -1003 -216 -248 C -ATOM 1277 C LEU A 171 63.008 65.953 17.159 1.00 46.68 C -ANISOU 1277 C LEU A 171 5966 5628 6144 -896 -202 -260 C -ATOM 1278 O LEU A 171 63.004 64.921 17.839 1.00 46.60 O -ANISOU 1278 O LEU A 171 5862 5696 6147 -838 -208 -238 O -ATOM 1279 CB LEU A 171 65.270 67.018 16.892 1.00 44.48 C -ANISOU 1279 CB LEU A 171 5682 5457 5761 -1168 -241 -279 C -ATOM 1280 CG LEU A 171 66.590 67.123 16.107 1.00 48.08 C -ANISOU 1280 CG LEU A 171 6055 6023 6189 -1297 -253 -264 C -ATOM 1281 CD1 LEU A 171 67.502 68.096 16.784 1.00 48.72 C -ANISOU 1281 CD1 LEU A 171 6181 6151 6178 -1484 -277 -304 C -ATOM 1282 CD2 LEU A 171 67.266 65.747 15.910 1.00 47.01 C -ANISOU 1282 CD2 LEU A 171 5722 6058 6081 -1224 -268 -223 C -ATOM 1283 N PHE A 172 61.972 66.835 17.130 1.00 42.84 N -ANISOU 1283 N PHE A 172 5615 5013 5651 -853 -179 -292 N -ATOM 1284 CA PHE A 172 60.747 66.605 17.910 1.00 41.73 C -ANISOU 1284 CA PHE A 172 5492 4842 5522 -738 -155 -304 C -ATOM 1285 C PHE A 172 60.056 65.308 17.377 1.00 44.23 C -ANISOU 1285 C PHE A 172 5686 5197 5923 -634 -141 -264 C -ATOM 1286 O PHE A 172 59.658 64.464 18.174 1.00 42.91 O -ANISOU 1286 O PHE A 172 5457 5082 5766 -589 -130 -248 O -ATOM 1287 CB PHE A 172 59.804 67.829 17.892 1.00 43.01 C -ANISOU 1287 CB PHE A 172 5817 4874 5651 -687 -134 -349 C -ATOM 1288 CG PHE A 172 58.547 67.605 18.698 1.00 43.29 C -ANISOU 1288 CG PHE A 172 5848 4913 5688 -564 -104 -365 C -ATOM 1289 CD1 PHE A 172 58.545 67.784 20.081 1.00 45.74 C -ANISOU 1289 CD1 PHE A 172 6195 5249 5934 -575 -100 -392 C -ATOM 1290 CD2 PHE A 172 57.370 67.172 18.083 1.00 43.58 C -ANISOU 1290 CD2 PHE A 172 5830 4946 5783 -441 -79 -354 C -ATOM 1291 CE1 PHE A 172 57.394 67.509 20.839 1.00 45.07 C -ANISOU 1291 CE1 PHE A 172 6091 5190 5843 -464 -62 -402 C -ATOM 1292 CE2 PHE A 172 56.224 66.888 18.842 1.00 45.33 C -ANISOU 1292 CE2 PHE A 172 6018 5204 6000 -342 -45 -367 C -ATOM 1293 CZ PHE A 172 56.249 67.051 20.215 1.00 43.18 C -ANISOU 1293 CZ PHE A 172 5783 4961 5664 -354 -32 -388 C -ATOM 1294 N GLN A 173 59.953 65.160 16.031 1.00 40.51 N -ANISOU 1294 N GLN A 173 5192 4697 5502 -609 -141 -247 N -ATOM 1295 CA GLN A 173 59.407 63.985 15.336 1.00 38.85 C -ANISOU 1295 CA GLN A 173 4880 4514 5365 -532 -135 -217 C -ATOM 1296 C GLN A 173 60.198 62.708 15.718 1.00 45.14 C -ANISOU 1296 C GLN A 173 5571 5404 6176 -548 -150 -179 C -ATOM 1297 O GLN A 173 59.593 61.673 16.008 1.00 44.75 O -ANISOU 1297 O GLN A 173 5470 5370 6162 -493 -138 -159 O -ATOM 1298 CB GLN A 173 59.481 64.190 13.823 1.00 38.49 C -ANISOU 1298 CB GLN A 173 4843 4430 5349 -522 -141 -210 C -ATOM 1299 CG GLN A 173 58.777 63.071 13.046 1.00 41.81 C -ANISOU 1299 CG GLN A 173 5180 4867 5840 -443 -140 -193 C -ATOM 1300 CD GLN A 173 59.125 63.087 11.594 1.00 50.59 C -ANISOU 1300 CD GLN A 173 6287 5964 6970 -438 -151 -183 C -ATOM 1301 OE1 GLN A 173 59.112 64.138 10.931 1.00 42.90 O -ANISOU 1301 OE1 GLN A 173 5399 4932 5968 -447 -150 -194 O -ATOM 1302 NE2 GLN A 173 59.547 61.931 11.101 1.00 44.36 N -ANISOU 1302 NE2 GLN A 173 5413 5224 6216 -424 -162 -159 N -ATOM 1303 N VAL A 174 61.551 62.806 15.721 1.00 43.21 N -ANISOU 1303 N VAL A 174 5300 5224 5893 -624 -175 -170 N -ATOM 1304 CA VAL A 174 62.483 61.732 16.094 1.00 42.92 C -ANISOU 1304 CA VAL A 174 5171 5292 5847 -620 -197 -137 C -ATOM 1305 C VAL A 174 62.230 61.289 17.550 1.00 46.86 C -ANISOU 1305 C VAL A 174 5672 5819 6315 -599 -195 -130 C -ATOM 1306 O VAL A 174 62.057 60.092 17.783 1.00 46.08 O -ANISOU 1306 O VAL A 174 5531 5740 6238 -536 -192 -95 O -ATOM 1307 CB VAL A 174 63.972 62.100 15.788 1.00 46.25 C -ANISOU 1307 CB VAL A 174 5546 5808 6218 -707 -224 -137 C -ATOM 1308 CG1 VAL A 174 64.945 61.153 16.495 1.00 46.06 C -ANISOU 1308 CG1 VAL A 174 5428 5917 6156 -686 -253 -111 C -ATOM 1309 CG2 VAL A 174 64.235 62.111 14.281 1.00 45.24 C -ANISOU 1309 CG2 VAL A 174 5395 5673 6122 -705 -218 -128 C -ATOM 1310 N MET A 175 62.121 62.261 18.495 1.00 45.00 N -ANISOU 1310 N MET A 175 5505 5571 6023 -650 -193 -164 N -ATOM 1311 CA MET A 175 61.823 62.019 19.912 1.00 45.74 C -ANISOU 1311 CA MET A 175 5616 5692 6073 -631 -187 -162 C -ATOM 1312 C MET A 175 60.476 61.299 20.085 1.00 47.15 C -ANISOU 1312 C MET A 175 5795 5822 6299 -549 -144 -143 C -ATOM 1313 O MET A 175 60.366 60.400 20.925 1.00 46.97 O -ANISOU 1313 O MET A 175 5752 5836 6259 -519 -135 -110 O -ATOM 1314 CB MET A 175 61.857 63.325 20.723 1.00 49.70 C -ANISOU 1314 CB MET A 175 6211 6172 6501 -696 -190 -214 C -ATOM 1315 CG MET A 175 61.377 63.147 22.168 1.00 55.25 C -ANISOU 1315 CG MET A 175 6943 6897 7151 -664 -175 -217 C -ATOM 1316 SD MET A 175 61.265 64.667 23.139 1.00 62.53 S -ANISOU 1316 SD MET A 175 8002 7778 7980 -720 -177 -290 S -ATOM 1317 CE MET A 175 59.791 65.413 22.417 1.00 58.66 C -ANISOU 1317 CE MET A 175 7600 7154 7536 -647 -128 -322 C -ATOM 1318 N THR A 176 59.466 61.656 19.276 1.00 42.48 N -ANISOU 1318 N THR A 176 5223 5158 5759 -516 -118 -161 N -ATOM 1319 CA THR A 176 58.163 60.981 19.356 1.00 42.30 C -ANISOU 1319 CA THR A 176 5176 5117 5778 -457 -78 -149 C -ATOM 1320 C THR A 176 58.200 59.599 18.675 1.00 46.21 C -ANISOU 1320 C THR A 176 5606 5617 6333 -437 -83 -104 C -ATOM 1321 O THR A 176 57.186 58.910 18.668 1.00 46.30 O -ANISOU 1321 O THR A 176 5594 5616 6379 -415 -53 -92 O -ATOM 1322 CB THR A 176 57.031 61.871 18.842 1.00 43.60 C -ANISOU 1322 CB THR A 176 5376 5230 5960 -415 -53 -191 C -ATOM 1323 OG1 THR A 176 57.134 61.944 17.419 1.00 43.63 O -ANISOU 1323 OG1 THR A 176 5366 5197 6014 -405 -72 -193 O -ATOM 1324 CG2 THR A 176 57.045 63.265 19.468 1.00 37.17 C -ANISOU 1324 CG2 THR A 176 4662 4386 5076 -421 -50 -238 C -ATOM 1325 N LEU A 177 59.363 59.208 18.089 1.00 41.96 N -ANISOU 1325 N LEU A 177 5041 5102 5798 -448 -121 -85 N -ATOM 1326 CA LEU A 177 59.615 57.919 17.411 1.00 40.64 C -ANISOU 1326 CA LEU A 177 4835 4933 5672 -414 -132 -48 C -ATOM 1327 C LEU A 177 58.793 57.739 16.132 1.00 45.69 C -ANISOU 1327 C LEU A 177 5462 5517 6382 -393 -124 -63 C -ATOM 1328 O LEU A 177 58.684 56.626 15.620 1.00 47.11 O -ANISOU 1328 O LEU A 177 5629 5674 6597 -369 -128 -41 O -ATOM 1329 CB LEU A 177 59.459 56.708 18.369 1.00 39.68 C -ANISOU 1329 CB LEU A 177 4725 4819 5534 -393 -119 -2 C -ATOM 1330 CG LEU A 177 60.236 56.814 19.702 1.00 42.00 C -ANISOU 1330 CG LEU A 177 5034 5179 5746 -399 -132 14 C -ATOM 1331 CD1 LEU A 177 59.812 55.730 20.670 1.00 39.79 C -ANISOU 1331 CD1 LEU A 177 4789 4887 5441 -377 -107 62 C -ATOM 1332 CD2 LEU A 177 61.789 56.926 19.467 1.00 39.66 C -ANISOU 1332 CD2 LEU A 177 4698 4963 5409 -392 -184 17 C -ATOM 1333 N GLU A 178 58.286 58.842 15.584 1.00 41.54 N -ANISOU 1333 N GLU A 178 4952 4966 5866 -398 -118 -101 N -ATOM 1334 CA GLU A 178 57.481 58.856 14.380 1.00 41.65 C -ANISOU 1334 CA GLU A 178 4953 4941 5930 -369 -117 -121 C -ATOM 1335 C GLU A 178 58.333 58.786 13.112 1.00 47.58 C -ANISOU 1335 C GLU A 178 5695 5689 6696 -363 -146 -118 C -ATOM 1336 O GLU A 178 58.995 59.765 12.759 1.00 48.11 O -ANISOU 1336 O GLU A 178 5789 5758 6733 -387 -155 -129 O -ATOM 1337 CB GLU A 178 56.547 60.073 14.383 1.00 43.12 C -ANISOU 1337 CB GLU A 178 5173 5107 6106 -349 -100 -161 C -ATOM 1338 CG GLU A 178 55.308 59.879 13.534 1.00 50.73 C -ANISOU 1338 CG GLU A 178 6101 6062 7113 -303 -95 -182 C -ATOM 1339 CD GLU A 178 55.477 60.163 12.058 1.00 56.72 C -ANISOU 1339 CD GLU A 178 6868 6791 7891 -276 -122 -193 C -ATOM 1340 OE1 GLU A 178 55.684 61.340 11.695 1.00 55.90 O -ANISOU 1340 OE1 GLU A 178 6828 6655 7755 -261 -128 -210 O -ATOM 1341 OE2 GLU A 178 55.351 59.215 11.258 1.00 55.93 O -ANISOU 1341 OE2 GLU A 178 6726 6693 7833 -271 -137 -187 O -ATOM 1342 N SER A 179 58.307 57.612 12.423 1.00 44.49 N -ANISOU 1342 N SER A 179 5275 5287 6341 -337 -157 -103 N -ATOM 1343 CA SER A 179 59.029 57.311 11.172 1.00 43.26 C -ANISOU 1343 CA SER A 179 5108 5135 6196 -313 -180 -101 C -ATOM 1344 C SER A 179 60.507 57.656 11.306 1.00 44.81 C -ANISOU 1344 C SER A 179 5290 5394 6342 -331 -192 -85 C -ATOM 1345 O SER A 179 61.172 57.935 10.305 1.00 45.56 O -ANISOU 1345 O SER A 179 5372 5512 6426 -328 -201 -88 O -ATOM 1346 CB SER A 179 58.424 58.105 10.007 1.00 46.86 C -ANISOU 1346 CB SER A 179 5576 5560 6668 -298 -183 -131 C -ATOM 1347 OG SER A 179 57.062 57.790 9.789 1.00 51.28 O -ANISOU 1347 OG SER A 179 6124 6094 7267 -277 -179 -152 O -ATOM 1348 N TRP A 180 61.025 57.641 12.534 1.00 39.89 N -ANISOU 1348 N TRP A 180 4662 4815 5680 -355 -192 -68 N -ATOM 1349 CA TRP A 180 62.389 58.069 12.794 1.00 40.36 C -ANISOU 1349 CA TRP A 180 4690 4962 5682 -388 -207 -60 C -ATOM 1350 C TRP A 180 63.410 57.324 11.934 1.00 44.84 C -ANISOU 1350 C TRP A 180 5204 5595 6238 -339 -224 -44 C -ATOM 1351 O TRP A 180 64.334 57.958 11.424 1.00 45.17 O -ANISOU 1351 O TRP A 180 5208 5711 6244 -379 -229 -49 O -ATOM 1352 CB TRP A 180 62.738 58.042 14.299 1.00 39.13 C -ANISOU 1352 CB TRP A 180 4534 4857 5479 -410 -213 -48 C -ATOM 1353 CG TRP A 180 63.015 56.679 14.884 1.00 40.32 C -ANISOU 1353 CG TRP A 180 4670 5032 5617 -340 -223 -11 C -ATOM 1354 CD1 TRP A 180 62.139 55.875 15.563 1.00 42.91 C -ANISOU 1354 CD1 TRP A 180 5041 5299 5965 -312 -207 9 C -ATOM 1355 CD2 TRP A 180 64.271 55.978 14.863 1.00 40.67 C -ANISOU 1355 CD2 TRP A 180 4663 5174 5616 -284 -252 13 C -ATOM 1356 NE1 TRP A 180 62.765 54.710 15.945 1.00 42.12 N -ANISOU 1356 NE1 TRP A 180 4945 5226 5833 -244 -223 48 N -ATOM 1357 CE2 TRP A 180 64.077 54.752 15.542 1.00 44.06 C -ANISOU 1357 CE2 TRP A 180 5131 5574 6038 -210 -254 49 C -ATOM 1358 CE3 TRP A 180 65.537 56.249 14.288 1.00 41.90 C -ANISOU 1358 CE3 TRP A 180 4742 5447 5730 -285 -273 8 C -ATOM 1359 CZ2 TRP A 180 65.104 53.808 15.689 1.00 43.99 C -ANISOU 1359 CZ2 TRP A 180 5100 5638 5977 -113 -283 80 C -ATOM 1360 CZ3 TRP A 180 66.558 55.322 14.450 1.00 43.62 C -ANISOU 1360 CZ3 TRP A 180 4909 5767 5898 -192 -299 34 C -ATOM 1361 CH2 TRP A 180 66.332 54.108 15.123 1.00 44.62 C -ANISOU 1361 CH2 TRP A 180 5089 5849 6014 -94 -307 69 C -ATOM 1362 N SER A 181 63.208 56.003 11.726 1.00 40.08 N -ANISOU 1362 N SER A 181 4607 4961 5660 -257 -230 -27 N -ATOM 1363 CA SER A 181 64.147 55.160 10.999 1.00 39.07 C -ANISOU 1363 CA SER A 181 4443 4890 5511 -179 -246 -14 C -ATOM 1364 C SER A 181 63.819 55.044 9.543 1.00 43.88 C -ANISOU 1364 C SER A 181 5064 5453 6154 -151 -242 -34 C -ATOM 1365 O SER A 181 64.655 55.407 8.719 1.00 45.65 O -ANISOU 1365 O SER A 181 5243 5753 6349 -148 -242 -38 O -ATOM 1366 CB SER A 181 64.278 53.787 11.664 1.00 40.67 C -ANISOU 1366 CB SER A 181 4676 5078 5698 -91 -259 16 C -ATOM 1367 OG SER A 181 65.386 53.067 11.151 1.00 44.82 O -ANISOU 1367 OG SER A 181 5167 5682 6180 9 -277 27 O -ATOM 1368 N MET A 182 62.624 54.534 9.196 1.00 40.40 N -ANISOU 1368 N MET A 182 4679 4902 5769 -138 -239 -46 N -ATOM 1369 CA MET A 182 62.273 54.344 7.778 1.00 39.50 C -ANISOU 1369 CA MET A 182 4579 4748 5681 -106 -244 -70 C -ATOM 1370 C MET A 182 62.158 55.658 7.046 1.00 42.73 C -ANISOU 1370 C MET A 182 4976 5173 6088 -156 -234 -88 C -ATOM 1371 O MET A 182 62.490 55.704 5.870 1.00 42.73 O -ANISOU 1371 O MET A 182 4969 5192 6075 -127 -236 -97 O -ATOM 1372 CB MET A 182 60.989 53.515 7.568 1.00 41.16 C -ANISOU 1372 CB MET A 182 4844 4851 5943 -100 -249 -87 C -ATOM 1373 CG MET A 182 60.996 52.150 8.228 1.00 45.50 C -ANISOU 1373 CG MET A 182 5446 5352 6490 -61 -255 -65 C -ATOM 1374 SD MET A 182 62.384 51.090 7.815 1.00 50.72 S -ANISOU 1374 SD MET A 182 6125 6051 7096 65 -273 -49 S -ATOM 1375 CE MET A 182 61.734 50.189 6.494 1.00 47.48 C -ANISOU 1375 CE MET A 182 5788 5540 6713 102 -289 -87 C -ATOM 1376 N GLY A 183 61.696 56.696 7.746 1.00 38.51 N -ANISOU 1376 N GLY A 183 4452 4624 5556 -224 -222 -92 N -ATOM 1377 CA GLY A 183 61.476 58.009 7.175 1.00 38.03 C -ANISOU 1377 CA GLY A 183 4417 4549 5485 -268 -212 -106 C -ATOM 1378 C GLY A 183 62.622 58.981 7.225 1.00 43.79 C -ANISOU 1378 C GLY A 183 5134 5345 6157 -336 -201 -94 C -ATOM 1379 O GLY A 183 62.757 59.753 6.284 1.00 46.40 O -ANISOU 1379 O GLY A 183 5495 5667 6468 -361 -192 -97 O -ATOM 1380 N ILE A 184 63.427 59.006 8.313 1.00 39.09 N -ANISOU 1380 N ILE A 184 4503 4820 5528 -379 -203 -81 N -ATOM 1381 CA ILE A 184 64.510 59.978 8.485 1.00 38.96 C -ANISOU 1381 CA ILE A 184 4469 4883 5451 -475 -196 -76 C -ATOM 1382 C ILE A 184 65.942 59.371 8.486 1.00 45.38 C -ANISOU 1382 C ILE A 184 5177 5851 6216 -467 -204 -59 C -ATOM 1383 O ILE A 184 66.762 59.782 7.666 1.00 47.63 O -ANISOU 1383 O ILE A 184 5424 6214 6460 -511 -190 -54 O -ATOM 1384 CB ILE A 184 64.291 60.875 9.774 1.00 41.77 C -ANISOU 1384 CB ILE A 184 4874 5212 5787 -556 -195 -89 C -ATOM 1385 CG1 ILE A 184 62.904 61.615 9.808 1.00 40.89 C -ANISOU 1385 CG1 ILE A 184 4865 4966 5707 -544 -184 -110 C -ATOM 1386 CG2 ILE A 184 65.463 61.873 10.031 1.00 41.10 C -ANISOU 1386 CG2 ILE A 184 4778 5209 5631 -687 -193 -91 C -ATOM 1387 CD1 ILE A 184 62.528 62.535 8.632 1.00 48.59 C -ANISOU 1387 CD1 ILE A 184 5918 5867 6677 -554 -171 -118 C -ATOM 1388 N VAL A 185 66.270 58.486 9.443 1.00 41.30 N -ANISOU 1388 N VAL A 185 4612 5389 5689 -412 -223 -48 N -ATOM 1389 CA VAL A 185 67.641 58.013 9.679 1.00 41.53 C -ANISOU 1389 CA VAL A 185 4535 5588 5656 -388 -238 -34 C -ATOM 1390 C VAL A 185 68.130 57.002 8.600 1.00 46.31 C -ANISOU 1390 C VAL A 185 5093 6248 6255 -267 -237 -25 C -ATOM 1391 O VAL A 185 69.282 57.134 8.183 1.00 47.61 O -ANISOU 1391 O VAL A 185 5160 6571 6359 -277 -232 -22 O -ATOM 1392 CB VAL A 185 67.837 57.515 11.149 1.00 44.80 C -ANISOU 1392 CB VAL A 185 4930 6047 6044 -361 -264 -23 C -ATOM 1393 CG1 VAL A 185 69.264 57.023 11.418 1.00 44.65 C -ANISOU 1393 CG1 VAL A 185 4788 6229 5947 -316 -288 -11 C -ATOM 1394 CG2 VAL A 185 67.457 58.617 12.147 1.00 43.91 C -ANISOU 1394 CG2 VAL A 185 4868 5893 5924 -483 -264 -40 C -ATOM 1395 N ARG A 186 67.304 56.042 8.130 1.00 40.40 N -ANISOU 1395 N ARG A 186 4409 5383 5559 -162 -240 -26 N -ATOM 1396 CA ARG A 186 67.784 55.156 7.064 1.00 40.14 C -ANISOU 1396 CA ARG A 186 4349 5396 5507 -47 -239 -27 C -ATOM 1397 C ARG A 186 68.137 56.005 5.829 1.00 45.32 C -ANISOU 1397 C ARG A 186 4973 6104 6141 -108 -212 -36 C -ATOM 1398 O ARG A 186 69.285 55.910 5.422 1.00 46.14 O -ANISOU 1398 O ARG A 186 4983 6367 6181 -79 -202 -30 O -ATOM 1399 CB ARG A 186 66.838 53.989 6.763 1.00 38.64 C -ANISOU 1399 CB ARG A 186 4250 5064 5367 58 -251 -33 C -ATOM 1400 CG ARG A 186 66.906 52.859 7.771 1.00 36.33 C -ANISOU 1400 CG ARG A 186 3992 4745 5066 142 -272 -14 C -ATOM 1401 CD ARG A 186 66.037 51.686 7.332 1.00 39.60 C -ANISOU 1401 CD ARG A 186 4515 5009 5521 221 -281 -22 C -ATOM 1402 NE ARG A 186 65.886 50.686 8.390 1.00 41.41 N -ANISOU 1402 NE ARG A 186 4814 5177 5743 277 -295 4 N -ATOM 1403 CZ ARG A 186 66.802 49.766 8.669 1.00 57.05 C -ANISOU 1403 CZ ARG A 186 6804 7214 7660 412 -312 25 C -ATOM 1404 NH1 ARG A 186 67.924 49.697 7.954 1.00 40.30 N -ANISOU 1404 NH1 ARG A 186 4605 5229 5478 509 -316 17 N -ATOM 1405 NH2 ARG A 186 66.610 48.910 9.670 1.00 37.48 N -ANISOU 1405 NH2 ARG A 186 4412 4662 5167 459 -323 56 N -ATOM 1406 N PRO A 187 67.277 56.963 5.337 1.00 41.85 N -ANISOU 1406 N PRO A 187 4605 5558 5739 -198 -196 -46 N -ATOM 1407 CA PRO A 187 67.710 57.868 4.249 1.00 39.61 C -ANISOU 1407 CA PRO A 187 4310 5323 5418 -266 -166 -45 C -ATOM 1408 C PRO A 187 68.990 58.682 4.530 1.00 43.93 C -ANISOU 1408 C PRO A 187 4767 6035 5891 -383 -147 -31 C -ATOM 1409 O PRO A 187 69.796 58.813 3.631 1.00 47.41 O -ANISOU 1409 O PRO A 187 5146 6591 6277 -395 -120 -24 O -ATOM 1410 CB PRO A 187 66.493 58.790 4.079 1.00 39.51 C -ANISOU 1410 CB PRO A 187 4410 5153 5450 -330 -162 -55 C -ATOM 1411 CG PRO A 187 65.335 57.940 4.440 1.00 43.16 C -ANISOU 1411 CG PRO A 187 4921 5498 5979 -249 -188 -69 C -ATOM 1412 CD PRO A 187 65.843 57.215 5.658 1.00 41.42 C -ANISOU 1412 CD PRO A 187 4648 5338 5752 -223 -203 -59 C -ATOM 1413 N VAL A 188 69.196 59.209 5.752 1.00 38.40 N -ANISOU 1413 N VAL A 188 4053 5358 5179 -476 -160 -31 N -ATOM 1414 CA VAL A 188 70.382 60.010 6.143 1.00 37.78 C -ANISOU 1414 CA VAL A 188 3886 5442 5025 -617 -149 -27 C -ATOM 1415 C VAL A 188 71.655 59.141 6.122 1.00 47.02 C -ANISOU 1415 C VAL A 188 4892 6841 6133 -535 -156 -20 C -ATOM 1416 O VAL A 188 72.705 59.593 5.675 1.00 49.21 O -ANISOU 1416 O VAL A 188 5066 7293 6338 -619 -131 -15 O -ATOM 1417 CB VAL A 188 70.178 60.764 7.505 1.00 39.42 C -ANISOU 1417 CB VAL A 188 4139 5607 5234 -731 -170 -38 C -ATOM 1418 CG1 VAL A 188 71.473 61.378 8.021 1.00 40.04 C -ANISOU 1418 CG1 VAL A 188 4108 5877 5227 -873 -172 -42 C -ATOM 1419 CG2 VAL A 188 69.094 61.836 7.403 1.00 38.02 C -ANISOU 1419 CG2 VAL A 188 4122 5232 5093 -812 -155 -48 C -ATOM 1420 N MET A 189 71.551 57.892 6.588 1.00 44.99 N -ANISOU 1420 N MET A 189 4616 6586 5893 -367 -187 -18 N -ATOM 1421 CA MET A 189 72.647 56.933 6.592 1.00 46.24 C -ANISOU 1421 CA MET A 189 4641 6942 5986 -234 -200 -13 C -ATOM 1422 C MET A 189 73.110 56.534 5.199 1.00 52.77 C -ANISOU 1422 C MET A 189 5421 7849 6781 -146 -168 -13 C -ATOM 1423 O MET A 189 74.258 56.099 5.074 1.00 54.70 O -ANISOU 1423 O MET A 189 5524 8314 6945 -67 -166 -11 O -ATOM 1424 CB MET A 189 72.284 55.704 7.404 1.00 48.50 C -ANISOU 1424 CB MET A 189 4972 7160 6297 -68 -240 -7 C -ATOM 1425 CG MET A 189 72.350 55.934 8.916 1.00 52.42 C -ANISOU 1425 CG MET A 189 5456 7680 6778 -125 -273 -2 C -ATOM 1426 SD MET A 189 71.796 54.428 9.727 1.00 57.14 S -ANISOU 1426 SD MET A 189 6144 8169 7399 73 -309 17 S -ATOM 1427 CE MET A 189 73.181 53.669 9.829 1.00 55.84 C -ANISOU 1427 CE MET A 189 5844 8241 7133 228 -331 25 C -ATOM 1428 N ASN A 190 72.244 56.686 4.145 1.00 48.57 N -ANISOU 1428 N ASN A 190 4997 7157 6298 -149 -144 -17 N -ATOM 1429 CA ASN A 190 72.649 56.394 2.758 1.00 49.33 C -ANISOU 1429 CA ASN A 190 5059 7329 6354 -74 -110 -20 C -ATOM 1430 C ASN A 190 73.773 57.348 2.308 1.00 55.54 C -ANISOU 1430 C ASN A 190 5721 8327 7056 -217 -65 -8 C -ATOM 1431 O ASN A 190 74.636 56.953 1.523 1.00 58.38 O -ANISOU 1431 O ASN A 190 5973 8864 7344 -139 -37 -7 O -ATOM 1432 CB ASN A 190 71.476 56.408 1.767 1.00 47.49 C -ANISOU 1432 CB ASN A 190 4971 6891 6182 -51 -102 -29 C -ATOM 1433 CG ASN A 190 70.479 55.285 1.954 1.00 83.72 C -ANISOU 1433 CG ASN A 190 9665 11305 10840 87 -141 -45 C -ATOM 1434 OD1 ASN A 190 70.827 54.160 2.343 1.00 82.70 O -ANISOU 1434 OD1 ASN A 190 9516 11210 10695 230 -165 -49 O -ATOM 1435 ND2 ASN A 190 69.213 55.547 1.617 1.00 77.79 N -ANISOU 1435 ND2 ASN A 190 9035 10365 10158 50 -148 -56 N -ATOM 1436 N VAL A 191 73.797 58.566 2.873 1.00 50.50 N -ANISOU 1436 N VAL A 191 5094 7676 6417 -427 -57 -1 N -ATOM 1437 CA VAL A 191 74.796 59.609 2.617 1.00 49.78 C -ANISOU 1437 CA VAL A 191 4906 7763 6244 -619 -15 11 C -ATOM 1438 C VAL A 191 75.821 59.687 3.781 1.00 56.44 C -ANISOU 1438 C VAL A 191 5592 8823 7029 -690 -41 3 C -ATOM 1439 O VAL A 191 77.007 59.794 3.508 1.00 60.09 O -ANISOU 1439 O VAL A 191 5885 9548 7401 -741 -15 6 O -ATOM 1440 CB VAL A 191 74.078 60.956 2.316 1.00 49.87 C -ANISOU 1440 CB VAL A 191 5077 7588 6282 -811 11 21 C -ATOM 1441 CG1 VAL A 191 75.059 62.097 2.067 1.00 49.72 C -ANISOU 1441 CG1 VAL A 191 4995 7719 6175 -1047 60 36 C -ATOM 1442 CG2 VAL A 191 73.122 60.800 1.144 1.00 47.46 C -ANISOU 1442 CG2 VAL A 191 4905 7104 6021 -715 28 26 C -ATOM 1443 N HIS A 192 75.377 59.571 5.057 1.00 50.09 N -ANISOU 1443 N HIS A 192 4834 7930 6268 -681 -94 -7 N -ATOM 1444 CA HIS A 192 76.217 59.667 6.259 1.00 49.11 C -ANISOU 1444 CA HIS A 192 4582 7991 6088 -744 -131 -18 C -ATOM 1445 C HIS A 192 76.142 58.353 7.036 1.00 54.37 C -ANISOU 1445 C HIS A 192 5221 8672 6767 -511 -183 -19 C -ATOM 1446 O HIS A 192 75.372 58.267 7.991 1.00 53.96 O -ANISOU 1446 O HIS A 192 5274 8460 6768 -498 -219 -22 O -ATOM 1447 CB HIS A 192 75.746 60.841 7.137 1.00 48.92 C -ANISOU 1447 CB HIS A 192 4667 7833 6087 -954 -145 -30 C -ATOM 1448 CG HIS A 192 75.615 62.133 6.393 1.00 52.67 C -ANISOU 1448 CG HIS A 192 5234 8225 6552 -1169 -94 -25 C -ATOM 1449 ND1 HIS A 192 76.726 62.887 6.052 1.00 56.10 N -ANISOU 1449 ND1 HIS A 192 5554 8865 6895 -1366 -61 -23 N -ATOM 1450 CD2 HIS A 192 74.513 62.728 5.885 1.00 53.33 C -ANISOU 1450 CD2 HIS A 192 5515 8050 6697 -1203 -72 -17 C -ATOM 1451 CE1 HIS A 192 76.265 63.920 5.370 1.00 55.23 C -ANISOU 1451 CE1 HIS A 192 5598 8592 6793 -1519 -17 -11 C -ATOM 1452 NE2 HIS A 192 74.942 63.874 5.253 1.00 54.30 N -ANISOU 1452 NE2 HIS A 192 5671 8196 6764 -1415 -25 -7 N -ATOM 1453 N PRO A 193 76.974 57.336 6.682 1.00 52.20 N -ANISOU 1453 N PRO A 193 4810 8594 6430 -324 -187 -17 N -ATOM 1454 CA PRO A 193 76.847 56.003 7.320 1.00 51.22 C -ANISOU 1454 CA PRO A 193 4706 8444 6311 -78 -235 -12 C -ATOM 1455 C PRO A 193 76.906 55.916 8.853 1.00 55.77 C -ANISOU 1455 C PRO A 193 5273 9044 6873 -80 -292 -11 C -ATOM 1456 O PRO A 193 76.414 54.929 9.419 1.00 55.68 O -ANISOU 1456 O PRO A 193 5354 8913 6888 93 -326 1 O -ATOM 1457 CB PRO A 193 77.985 55.178 6.688 1.00 53.84 C -ANISOU 1457 CB PRO A 193 4875 9035 6548 107 -226 -13 C -ATOM 1458 CG PRO A 193 78.742 56.101 5.814 1.00 58.61 C -ANISOU 1458 CG PRO A 193 5346 9830 7094 -62 -171 -18 C -ATOM 1459 CD PRO A 193 77.915 57.295 5.537 1.00 53.90 C -ANISOU 1459 CD PRO A 193 4884 9027 6569 -303 -140 -15 C -ATOM 1460 N ASN A 194 77.486 56.907 9.525 1.00 52.90 N -ANISOU 1460 N ASN A 194 4813 8824 6461 -277 -304 -25 N -ATOM 1461 CA ASN A 194 77.582 56.872 10.987 1.00 53.04 C -ANISOU 1461 CA ASN A 194 4821 8880 6453 -282 -363 -29 C -ATOM 1462 C ASN A 194 76.549 57.734 11.675 1.00 56.43 C -ANISOU 1462 C ASN A 194 5413 9075 6954 -452 -365 -37 C -ATOM 1463 O ASN A 194 76.705 58.016 12.862 1.00 57.86 O -ANISOU 1463 O ASN A 194 5580 9306 7100 -517 -407 -48 O -ATOM 1464 CB ASN A 194 79.002 57.235 11.446 1.00 55.51 C -ANISOU 1464 CB ASN A 194 4901 9547 6643 -358 -391 -47 C -ATOM 1465 CG ASN A 194 80.028 56.227 11.001 1.00 82.38 C -ANISOU 1465 CG ASN A 194 8131 13211 9959 -135 -398 -41 C -ATOM 1466 OD1 ASN A 194 79.860 55.003 11.172 1.00 81.65 O -ANISOU 1466 OD1 ASN A 194 8091 13068 9865 133 -424 -22 O -ATOM 1467 ND2 ASN A 194 81.086 56.718 10.367 1.00 70.54 N -ANISOU 1467 ND2 ASN A 194 6433 11990 8380 -238 -369 -55 N -ATOM 1468 N ALA A 195 75.482 58.142 10.954 1.00 50.37 N -ANISOU 1468 N ALA A 195 4802 8060 6277 -512 -323 -34 N -ATOM 1469 CA ALA A 195 74.442 59.014 11.501 1.00 48.71 C -ANISOU 1469 CA ALA A 195 4750 7628 6128 -652 -319 -45 C -ATOM 1470 C ALA A 195 73.743 58.454 12.727 1.00 54.33 C -ANISOU 1470 C ALA A 195 5548 8227 6866 -561 -356 -39 C -ATOM 1471 O ALA A 195 73.236 59.235 13.527 1.00 56.90 O -ANISOU 1471 O ALA A 195 5957 8458 7203 -683 -364 -56 O -ATOM 1472 CB ALA A 195 73.440 59.389 10.427 1.00 48.06 C -ANISOU 1472 CB ALA A 195 4807 7328 6127 -680 -272 -41 C -ATOM 1473 N TRP A 196 73.758 57.122 12.912 1.00 50.17 N -ANISOU 1473 N TRP A 196 5011 7713 6337 -348 -378 -15 N -ATOM 1474 CA TRP A 196 73.121 56.438 14.051 1.00 49.62 C -ANISOU 1474 CA TRP A 196 5031 7539 6282 -249 -407 2 C -ATOM 1475 C TRP A 196 73.796 56.796 15.385 1.00 54.82 C -ANISOU 1475 C TRP A 196 5619 8354 6858 -308 -454 -8 C -ATOM 1476 O TRP A 196 73.154 56.719 16.430 1.00 55.46 O -ANISOU 1476 O TRP A 196 5792 8331 6947 -300 -469 -1 O -ATOM 1477 CB TRP A 196 73.100 54.908 13.827 1.00 48.17 C -ANISOU 1477 CB TRP A 196 4874 7330 6100 -11 -417 34 C -ATOM 1478 CG TRP A 196 74.465 54.307 13.645 1.00 49.64 C -ANISOU 1478 CG TRP A 196 4904 7770 6188 121 -443 39 C -ATOM 1479 CD1 TRP A 196 75.150 54.167 12.474 1.00 52.56 C -ANISOU 1479 CD1 TRP A 196 5176 8262 6534 173 -422 31 C -ATOM 1480 CD2 TRP A 196 75.354 53.884 14.685 1.00 50.59 C -ANISOU 1480 CD2 TRP A 196 4930 8084 6208 215 -496 49 C -ATOM 1481 NE1 TRP A 196 76.390 53.632 12.713 1.00 53.25 N -ANISOU 1481 NE1 TRP A 196 5108 8613 6512 304 -455 34 N -ATOM 1482 CE2 TRP A 196 76.555 53.474 14.067 1.00 54.94 C -ANISOU 1482 CE2 TRP A 196 5319 8880 6677 332 -506 44 C -ATOM 1483 CE3 TRP A 196 75.246 53.790 16.085 1.00 52.18 C -ANISOU 1483 CE3 TRP A 196 5170 8285 6371 224 -538 61 C -ATOM 1484 CZ2 TRP A 196 77.639 52.977 14.796 1.00 55.51 C -ANISOU 1484 CZ2 TRP A 196 5257 9203 6629 467 -560 50 C -ATOM 1485 CZ3 TRP A 196 76.326 53.294 16.806 1.00 54.71 C -ANISOU 1485 CZ3 TRP A 196 5370 8843 6574 351 -594 69 C -ATOM 1486 CH2 TRP A 196 77.503 52.894 16.162 1.00 56.20 C -ANISOU 1486 CH2 TRP A 196 5391 9281 6683 476 -607 63 C -ATOM 1487 N VAL A 197 75.088 57.203 15.334 1.00 51.55 N -ANISOU 1487 N VAL A 197 5031 8201 6354 -375 -475 -27 N -ATOM 1488 CA VAL A 197 75.922 57.631 16.478 1.00 51.89 C -ANISOU 1488 CA VAL A 197 4970 8445 6300 -454 -529 -48 C -ATOM 1489 C VAL A 197 75.336 58.936 17.039 1.00 55.90 C -ANISOU 1489 C VAL A 197 5582 8826 6831 -683 -521 -82 C -ATOM 1490 O VAL A 197 75.472 59.216 18.222 1.00 56.83 O -ANISOU 1490 O VAL A 197 5702 8997 6893 -735 -564 -100 O -ATOM 1491 CB VAL A 197 77.418 57.774 16.060 1.00 56.66 C -ANISOU 1491 CB VAL A 197 5344 9381 6804 -487 -546 -66 C -ATOM 1492 CG1 VAL A 197 78.283 58.361 17.164 1.00 57.96 C -ANISOU 1492 CG1 VAL A 197 5387 9771 6863 -614 -605 -99 C -ATOM 1493 CG2 VAL A 197 77.988 56.443 15.607 1.00 57.02 C -ANISOU 1493 CG2 VAL A 197 5298 9556 6810 -220 -557 -36 C -ATOM 1494 N PHE A 198 74.671 59.715 16.188 1.00 51.77 N -ANISOU 1494 N PHE A 198 5158 8131 6381 -803 -469 -92 N -ATOM 1495 CA PHE A 198 74.027 60.943 16.591 1.00 50.80 C -ANISOU 1495 CA PHE A 198 5168 7857 6279 -989 -457 -125 C -ATOM 1496 C PHE A 198 72.588 60.649 17.049 1.00 54.50 C -ANISOU 1496 C PHE A 198 5810 8071 6827 -895 -440 -111 C -ATOM 1497 O PHE A 198 72.227 61.004 18.176 1.00 55.55 O -ANISOU 1497 O PHE A 198 6015 8156 6937 -937 -460 -129 O -ATOM 1498 CB PHE A 198 74.061 61.978 15.441 1.00 52.12 C -ANISOU 1498 CB PHE A 198 5366 7971 6467 -1158 -410 -139 C -ATOM 1499 CG PHE A 198 73.263 63.227 15.736 1.00 53.38 C -ANISOU 1499 CG PHE A 198 5705 7930 6648 -1319 -392 -170 C -ATOM 1500 CD1 PHE A 198 73.781 64.226 16.548 1.00 56.65 C -ANISOU 1500 CD1 PHE A 198 6131 8408 6986 -1512 -421 -213 C -ATOM 1501 CD2 PHE A 198 71.966 63.379 15.242 1.00 54.24 C -ANISOU 1501 CD2 PHE A 198 5977 7788 6845 -1265 -352 -160 C -ATOM 1502 CE1 PHE A 198 73.021 65.351 16.864 1.00 57.46 C -ANISOU 1502 CE1 PHE A 198 6427 8307 7099 -1636 -406 -246 C -ATOM 1503 CE2 PHE A 198 71.208 64.502 15.560 1.00 56.03 C -ANISOU 1503 CE2 PHE A 198 6376 7833 7079 -1377 -338 -190 C -ATOM 1504 CZ PHE A 198 71.734 65.473 16.378 1.00 55.35 C -ANISOU 1504 CZ PHE A 198 6321 7793 6915 -1554 -364 -233 C -ATOM 1505 N PHE A 199 71.778 59.991 16.186 1.00 48.25 N -ANISOU 1505 N PHE A 199 5080 7134 6120 -773 -404 -82 N -ATOM 1506 CA PHE A 199 70.344 59.776 16.413 1.00 45.76 C -ANISOU 1506 CA PHE A 199 4912 6591 5883 -709 -379 -72 C -ATOM 1507 C PHE A 199 69.952 58.786 17.498 1.00 52.18 C -ANISOU 1507 C PHE A 199 5756 7383 6688 -579 -399 -46 C -ATOM 1508 O PHE A 199 68.999 59.089 18.228 1.00 52.29 O -ANISOU 1508 O PHE A 199 5874 7270 6724 -603 -386 -53 O -ATOM 1509 CB PHE A 199 69.627 59.420 15.120 1.00 45.11 C -ANISOU 1509 CB PHE A 199 4878 6378 5885 -642 -340 -57 C -ATOM 1510 CG PHE A 199 69.575 60.596 14.169 1.00 44.86 C -ANISOU 1510 CG PHE A 199 4881 6297 5866 -776 -310 -79 C -ATOM 1511 CD1 PHE A 199 68.675 61.638 14.374 1.00 45.79 C -ANISOU 1511 CD1 PHE A 199 5131 6259 6008 -864 -291 -104 C -ATOM 1512 CD2 PHE A 199 70.431 60.666 13.075 1.00 45.08 C -ANISOU 1512 CD2 PHE A 199 4821 6436 5871 -804 -299 -74 C -ATOM 1513 CE1 PHE A 199 68.654 62.738 13.519 1.00 45.93 C -ANISOU 1513 CE1 PHE A 199 5210 6216 6025 -979 -266 -119 C -ATOM 1514 CE2 PHE A 199 70.379 61.745 12.197 1.00 47.14 C -ANISOU 1514 CE2 PHE A 199 5135 6641 6135 -933 -267 -87 C -ATOM 1515 CZ PHE A 199 69.485 62.770 12.420 1.00 45.09 C -ANISOU 1515 CZ PHE A 199 5026 6209 5898 -1018 -252 -107 C -ATOM 1516 N ILE A 200 70.627 57.622 17.611 1.00 49.31 N -ANISOU 1516 N ILE A 200 5314 7135 6287 -436 -426 -13 N -ATOM 1517 CA ILE A 200 70.276 56.629 18.649 1.00 48.31 C -ANISOU 1517 CA ILE A 200 5241 6973 6140 -310 -443 22 C -ATOM 1518 C ILE A 200 70.529 57.239 20.060 1.00 52.32 C -ANISOU 1518 C ILE A 200 5748 7560 6570 -387 -476 3 C -ATOM 1519 O ILE A 200 69.571 57.276 20.841 1.00 51.39 O -ANISOU 1519 O ILE A 200 5740 7315 6471 -394 -458 8 O -ATOM 1520 CB ILE A 200 70.901 55.209 18.418 1.00 50.28 C -ANISOU 1520 CB ILE A 200 5447 7300 6357 -114 -465 64 C -ATOM 1521 CG1 ILE A 200 70.297 54.574 17.137 1.00 48.55 C -ANISOU 1521 CG1 ILE A 200 5283 6940 6223 -43 -427 77 C -ATOM 1522 CG2 ILE A 200 70.746 54.295 19.654 1.00 47.83 C -ANISOU 1522 CG2 ILE A 200 5204 6973 5995 4 -489 106 C -ATOM 1523 CD1 ILE A 200 70.793 53.190 16.769 1.00 53.94 C -ANISOU 1523 CD1 ILE A 200 5965 7653 6878 157 -443 112 C -ATOM 1524 N PRO A 201 71.707 57.834 20.383 1.00 50.07 N -ANISOU 1524 N PRO A 201 5346 7481 6198 -468 -521 -27 N -ATOM 1525 CA PRO A 201 71.862 58.471 21.718 1.00 50.32 C -ANISOU 1525 CA PRO A 201 5394 7574 6153 -555 -556 -55 C -ATOM 1526 C PRO A 201 70.882 59.631 21.942 1.00 54.02 C -ANISOU 1526 C PRO A 201 5992 7869 6663 -700 -521 -94 C -ATOM 1527 O PRO A 201 70.481 59.844 23.083 1.00 54.52 O -ANISOU 1527 O PRO A 201 6129 7898 6686 -712 -531 -105 O -ATOM 1528 CB PRO A 201 73.321 58.969 21.725 1.00 52.56 C -ANISOU 1528 CB PRO A 201 5511 8118 6343 -647 -608 -89 C -ATOM 1529 CG PRO A 201 74.003 58.141 20.726 1.00 57.42 C -ANISOU 1529 CG PRO A 201 6010 8846 6963 -524 -608 -60 C -ATOM 1530 CD PRO A 201 72.969 57.917 19.626 1.00 52.20 C -ANISOU 1530 CD PRO A 201 5455 7959 6422 -485 -543 -38 C -ATOM 1531 N PHE A 202 70.501 60.383 20.863 1.00 48.57 N -ANISOU 1531 N PHE A 202 5340 7073 6042 -796 -480 -116 N -ATOM 1532 CA PHE A 202 69.556 61.491 20.974 1.00 46.63 C -ANISOU 1532 CA PHE A 202 5232 6657 5829 -904 -447 -154 C -ATOM 1533 C PHE A 202 68.184 60.965 21.406 1.00 50.62 C -ANISOU 1533 C PHE A 202 5846 6998 6390 -795 -410 -130 C -ATOM 1534 O PHE A 202 67.559 61.582 22.260 1.00 50.80 O -ANISOU 1534 O PHE A 202 5964 6951 6389 -835 -401 -158 O -ATOM 1535 CB PHE A 202 69.467 62.324 19.678 1.00 47.54 C -ANISOU 1535 CB PHE A 202 5375 6694 5994 -1002 -413 -173 C -ATOM 1536 CG PHE A 202 68.327 63.329 19.695 1.00 48.39 C -ANISOU 1536 CG PHE A 202 5648 6601 6138 -1058 -376 -204 C -ATOM 1537 CD1 PHE A 202 68.492 64.587 20.279 1.00 51.18 C -ANISOU 1537 CD1 PHE A 202 6089 6929 6428 -1206 -388 -258 C -ATOM 1538 CD2 PHE A 202 67.072 63.000 19.166 1.00 48.55 C -ANISOU 1538 CD2 PHE A 202 5739 6464 6245 -955 -332 -184 C -ATOM 1539 CE1 PHE A 202 67.427 65.497 20.329 1.00 51.52 C -ANISOU 1539 CE1 PHE A 202 6300 6784 6491 -1224 -355 -289 C -ATOM 1540 CE2 PHE A 202 66.000 63.897 19.249 1.00 50.54 C -ANISOU 1540 CE2 PHE A 202 6131 6557 6517 -975 -301 -215 C -ATOM 1541 CZ PHE A 202 66.185 65.136 19.834 1.00 49.78 C -ANISOU 1541 CZ PHE A 202 6132 6429 6354 -1097 -312 -266 C -ATOM 1542 N ILE A 203 67.714 59.851 20.794 1.00 46.85 N -ANISOU 1542 N ILE A 203 5358 6464 5980 -666 -385 -83 N -ATOM 1543 CA ILE A 203 66.449 59.168 21.086 1.00 45.50 C -ANISOU 1543 CA ILE A 203 5269 6158 5862 -576 -346 -54 C -ATOM 1544 C ILE A 203 66.517 58.650 22.512 1.00 53.98 C -ANISOU 1544 C ILE A 203 6362 7284 6864 -527 -365 -32 C -ATOM 1545 O ILE A 203 65.559 58.812 23.252 1.00 54.75 O -ANISOU 1545 O ILE A 203 6542 7297 6962 -529 -333 -35 O -ATOM 1546 CB ILE A 203 66.229 57.997 20.084 1.00 47.54 C -ANISOU 1546 CB ILE A 203 5504 6372 6189 -468 -331 -11 C -ATOM 1547 CG1 ILE A 203 65.721 58.495 18.745 1.00 45.97 C -ANISOU 1547 CG1 ILE A 203 5316 6083 6067 -504 -302 -31 C -ATOM 1548 CG2 ILE A 203 65.303 56.882 20.659 1.00 50.40 C -ANISOU 1548 CG2 ILE A 203 5932 6646 6573 -375 -305 34 C -ATOM 1549 CD1 ILE A 203 65.932 57.535 17.595 1.00 46.90 C -ANISOU 1549 CD1 ILE A 203 5394 6196 6230 -416 -300 -4 C -ATOM 1550 N MET A 204 67.636 58.015 22.897 1.00 54.43 N -ANISOU 1550 N MET A 204 6342 7490 6850 -470 -414 -8 N -ATOM 1551 CA MET A 204 67.810 57.480 24.247 1.00 56.71 C -ANISOU 1551 CA MET A 204 6651 7844 7053 -406 -440 20 C -ATOM 1552 C MET A 204 67.695 58.568 25.309 1.00 60.52 C -ANISOU 1552 C MET A 204 7178 8346 7470 -510 -450 -29 C -ATOM 1553 O MET A 204 66.916 58.419 26.238 1.00 60.95 O -ANISOU 1553 O MET A 204 7319 8336 7505 -482 -423 -15 O -ATOM 1554 CB MET A 204 69.117 56.691 24.366 1.00 61.10 C -ANISOU 1554 CB MET A 204 7105 8580 7532 -312 -501 47 C -ATOM 1555 CG MET A 204 69.054 55.338 23.689 1.00 67.12 C -ANISOU 1555 CG MET A 204 7873 9295 8335 -162 -489 105 C -ATOM 1556 SD MET A 204 70.711 54.619 23.696 1.00 76.84 S -ANISOU 1556 SD MET A 204 8973 10764 9458 -25 -564 126 S -ATOM 1557 CE MET A 204 70.350 52.915 23.113 1.00 73.93 C -ANISOU 1557 CE MET A 204 8699 10262 9128 178 -540 200 C -ATOM 1558 N LEU A 205 68.386 59.690 25.114 1.00 57.31 N -ANISOU 1558 N LEU A 205 6728 8014 7032 -639 -480 -89 N -ATOM 1559 CA LEU A 205 68.375 60.833 26.010 1.00 58.44 C -ANISOU 1559 CA LEU A 205 6929 8167 7107 -757 -497 -150 C -ATOM 1560 C LEU A 205 67.018 61.534 26.152 1.00 59.91 C -ANISOU 1560 C LEU A 205 7255 8170 7339 -786 -436 -178 C -ATOM 1561 O LEU A 205 66.580 61.789 27.274 1.00 60.16 O -ANISOU 1561 O LEU A 205 7363 8185 7311 -784 -431 -195 O -ATOM 1562 CB LEU A 205 69.406 61.862 25.528 1.00 60.00 C -ANISOU 1562 CB LEU A 205 7062 8464 7272 -913 -536 -207 C -ATOM 1563 CG LEU A 205 70.815 61.708 26.044 1.00 67.94 C -ANISOU 1563 CG LEU A 205 7934 9709 8170 -944 -613 -218 C -ATOM 1564 CD1 LEU A 205 71.787 62.523 25.180 1.00 69.01 C -ANISOU 1564 CD1 LEU A 205 7979 9946 8295 -1105 -634 -260 C -ATOM 1565 CD2 LEU A 205 70.901 62.111 27.530 1.00 72.85 C -ANISOU 1565 CD2 LEU A 205 8610 10388 8681 -985 -655 -257 C -ATOM 1566 N THR A 206 66.398 61.909 25.022 1.00 53.56 N -ANISOU 1566 N THR A 206 6480 7242 6628 -807 -393 -186 N -ATOM 1567 CA THR A 206 65.165 62.689 24.985 1.00 52.23 C -ANISOU 1567 CA THR A 206 6431 6916 6496 -820 -340 -218 C -ATOM 1568 C THR A 206 63.936 61.909 25.394 1.00 56.36 C -ANISOU 1568 C THR A 206 6990 7368 7055 -708 -287 -179 C -ATOM 1569 O THR A 206 63.080 62.482 26.062 1.00 57.02 O -ANISOU 1569 O THR A 206 7162 7390 7113 -705 -254 -210 O -ATOM 1570 CB THR A 206 64.977 63.359 23.626 1.00 55.43 C -ANISOU 1570 CB THR A 206 6857 7229 6973 -870 -320 -238 C -ATOM 1571 OG1 THR A 206 64.936 62.354 22.615 1.00 56.82 O -ANISOU 1571 OG1 THR A 206 6953 7407 7230 -794 -307 -186 O -ATOM 1572 CG2 THR A 206 66.068 64.385 23.322 1.00 48.72 C -ANISOU 1572 CG2 THR A 206 6005 6432 6072 -1020 -359 -283 C -ATOM 1573 N THR A 207 63.820 60.625 25.009 1.00 53.02 N -ANISOU 1573 N THR A 207 6508 6953 6683 -621 -275 -115 N -ATOM 1574 CA THR A 207 62.644 59.836 25.398 1.00 53.09 C -ANISOU 1574 CA THR A 207 6554 6896 6722 -544 -220 -74 C -ATOM 1575 C THR A 207 62.671 59.626 26.901 1.00 59.53 C -ANISOU 1575 C THR A 207 7409 7770 7440 -523 -222 -61 C -ATOM 1576 O THR A 207 61.633 59.747 27.545 1.00 59.53 O -ANISOU 1576 O THR A 207 7467 7724 7427 -507 -169 -65 O -ATOM 1577 CB THR A 207 62.508 58.531 24.603 1.00 55.41 C -ANISOU 1577 CB THR A 207 6805 7163 7088 -475 -207 -13 C -ATOM 1578 OG1 THR A 207 63.660 57.714 24.839 1.00 55.12 O -ANISOU 1578 OG1 THR A 207 6721 7221 7000 -430 -257 26 O -ATOM 1579 CG2 THR A 207 62.272 58.768 23.115 1.00 49.64 C -ANISOU 1579 CG2 THR A 207 6046 6366 6450 -489 -198 -30 C -ATOM 1580 N PHE A 208 63.874 59.385 27.463 1.00 57.82 N -ANISOU 1580 N PHE A 208 7154 7671 7143 -521 -283 -50 N -ATOM 1581 CA PHE A 208 64.075 59.235 28.898 1.00 58.43 C -ANISOU 1581 CA PHE A 208 7269 7823 7109 -499 -300 -40 C -ATOM 1582 C PHE A 208 63.689 60.528 29.631 1.00 61.72 C -ANISOU 1582 C PHE A 208 7761 8222 7469 -569 -290 -114 C -ATOM 1583 O PHE A 208 62.905 60.468 30.579 1.00 62.26 O -ANISOU 1583 O PHE A 208 7896 8269 7491 -536 -247 -108 O -ATOM 1584 CB PHE A 208 65.522 58.823 29.215 1.00 61.22 C -ANISOU 1584 CB PHE A 208 7550 8331 7382 -478 -382 -24 C -ATOM 1585 CG PHE A 208 65.888 58.977 30.673 1.00 65.24 C -ANISOU 1585 CG PHE A 208 8094 8938 7757 -473 -417 -35 C -ATOM 1586 CD1 PHE A 208 65.355 58.127 31.636 1.00 69.20 C -ANISOU 1586 CD1 PHE A 208 8662 9425 8205 -387 -385 26 C -ATOM 1587 CD2 PHE A 208 66.731 60.001 31.091 1.00 69.93 C -ANISOU 1587 CD2 PHE A 208 8665 9636 8269 -569 -480 -107 C -ATOM 1588 CE1 PHE A 208 65.650 58.303 32.986 1.00 71.81 C -ANISOU 1588 CE1 PHE A 208 9034 9846 8403 -378 -416 15 C -ATOM 1589 CE2 PHE A 208 67.057 60.153 32.441 1.00 74.32 C -ANISOU 1589 CE2 PHE A 208 9257 10288 8694 -566 -518 -124 C -ATOM 1590 CZ PHE A 208 66.503 59.311 33.380 1.00 72.67 C -ANISOU 1590 CZ PHE A 208 9113 10065 8432 -462 -486 -63 C -ATOM 1591 N THR A 209 64.216 61.686 29.181 1.00 57.12 N -ANISOU 1591 N THR A 209 7178 7642 6882 -668 -326 -185 N -ATOM 1592 CA THR A 209 63.963 62.993 29.800 1.00 57.20 C -ANISOU 1592 CA THR A 209 7289 7616 6829 -739 -325 -265 C -ATOM 1593 C THR A 209 62.478 63.384 29.745 1.00 62.26 C -ANISOU 1593 C THR A 209 8016 8126 7514 -691 -244 -281 C -ATOM 1594 O THR A 209 61.945 63.835 30.765 1.00 62.47 O -ANISOU 1594 O THR A 209 8127 8144 7464 -673 -220 -314 O -ATOM 1595 CB THR A 209 64.890 64.068 29.226 1.00 55.85 C -ANISOU 1595 CB THR A 209 7117 7458 6644 -872 -377 -329 C -ATOM 1596 OG1 THR A 209 66.226 63.596 29.302 1.00 52.43 O -ANISOU 1596 OG1 THR A 209 6572 7187 6163 -907 -449 -313 O -ATOM 1597 CG2 THR A 209 64.803 65.377 29.979 1.00 54.02 C -ANISOU 1597 CG2 THR A 209 7017 7182 6325 -956 -388 -417 C -ATOM 1598 N VAL A 210 61.812 63.192 28.585 1.00 58.42 N -ANISOU 1598 N VAL A 210 7502 7556 7140 -660 -203 -259 N -ATOM 1599 CA VAL A 210 60.390 63.518 28.422 1.00 58.38 C -ANISOU 1599 CA VAL A 210 7550 7456 7176 -601 -131 -274 C -ATOM 1600 C VAL A 210 59.519 62.631 29.345 1.00 62.81 C -ANISOU 1600 C VAL A 210 8102 8052 7711 -526 -74 -226 C -ATOM 1601 O VAL A 210 58.557 63.139 29.922 1.00 61.80 O -ANISOU 1601 O VAL A 210 8033 7902 7545 -486 -22 -259 O -ATOM 1602 CB VAL A 210 59.943 63.529 26.930 1.00 61.28 C -ANISOU 1602 CB VAL A 210 7880 7745 7658 -589 -112 -265 C -ATOM 1603 CG1 VAL A 210 58.919 62.447 26.613 1.00 60.02 C -ANISOU 1603 CG1 VAL A 210 7655 7578 7572 -516 -59 -207 C -ATOM 1604 CG2 VAL A 210 59.403 64.901 26.544 1.00 61.54 C -ANISOU 1604 CG2 VAL A 210 8015 7681 7688 -591 -95 -335 C -ATOM 1605 N LEU A 211 59.904 61.341 29.524 1.00 61.38 N -ANISOU 1605 N LEU A 211 7858 7927 7536 -504 -83 -150 N -ATOM 1606 CA LEU A 211 59.248 60.386 30.423 1.00 63.71 C -ANISOU 1606 CA LEU A 211 8161 8253 7795 -454 -30 -91 C -ATOM 1607 C LEU A 211 59.353 60.941 31.873 1.00 67.77 C -ANISOU 1607 C LEU A 211 8749 8827 8176 -451 -33 -123 C -ATOM 1608 O LEU A 211 58.329 61.142 32.527 1.00 68.78 O -ANISOU 1608 O LEU A 211 8917 8952 8265 -418 35 -133 O -ATOM 1609 CB LEU A 211 59.913 58.981 30.306 1.00 65.02 C -ANISOU 1609 CB LEU A 211 8281 8447 7975 -429 -56 -5 C -ATOM 1610 CG LEU A 211 59.554 57.909 31.386 1.00 72.08 C -ANISOU 1610 CG LEU A 211 9216 9371 8802 -387 -14 71 C -ATOM 1611 CD1 LEU A 211 58.470 56.969 30.879 1.00 73.25 C -ANISOU 1611 CD1 LEU A 211 9352 9452 9030 -383 60 126 C -ATOM 1612 CD2 LEU A 211 60.791 57.107 31.858 1.00 71.85 C -ANISOU 1612 CD2 LEU A 211 9189 9409 8703 -348 -81 125 C -ATOM 1613 N ASN A 212 60.587 61.226 32.326 1.00 62.40 N -ANISOU 1613 N ASN A 212 8077 8212 7420 -487 -113 -146 N -ATOM 1614 CA ASN A 212 60.915 61.809 33.624 1.00 63.00 C -ANISOU 1614 CA ASN A 212 8224 8354 7361 -498 -138 -189 C -ATOM 1615 C ASN A 212 60.115 63.113 33.866 1.00 65.37 C -ANISOU 1615 C ASN A 212 8618 8591 7630 -507 -99 -278 C -ATOM 1616 O ASN A 212 59.462 63.253 34.900 1.00 66.25 O -ANISOU 1616 O ASN A 212 8792 8725 7655 -463 -53 -290 O -ATOM 1617 CB ASN A 212 62.417 62.083 33.663 1.00 65.49 C -ANISOU 1617 CB ASN A 212 8508 8754 7622 -562 -241 -218 C -ATOM 1618 CG ASN A 212 63.006 62.170 35.031 1.00 98.10 C -ANISOU 1618 CG ASN A 212 12680 12991 11603 -562 -286 -235 C -ATOM 1619 OD1 ASN A 212 63.085 61.181 35.758 1.00 98.03 O -ANISOU 1619 OD1 ASN A 212 12665 13046 11536 -491 -281 -165 O -ATOM 1620 ND2 ASN A 212 63.530 63.335 35.370 1.00 95.68 N -ANISOU 1620 ND2 ASN A 212 12426 12705 11225 -648 -339 -328 N -ATOM 1621 N LEU A 213 60.126 64.035 32.890 1.00 59.88 N -ANISOU 1621 N LEU A 213 7940 7812 6998 -550 -112 -336 N -ATOM 1622 CA LEU A 213 59.398 65.302 32.963 1.00 59.31 C -ANISOU 1622 CA LEU A 213 7981 7658 6897 -538 -80 -420 C -ATOM 1623 C LEU A 213 57.906 65.084 33.217 1.00 66.14 C -ANISOU 1623 C LEU A 213 8848 8510 7771 -431 19 -404 C -ATOM 1624 O LEU A 213 57.381 65.643 34.179 1.00 67.61 O -ANISOU 1624 O LEU A 213 9119 8712 7859 -385 53 -449 O -ATOM 1625 CB LEU A 213 59.648 66.176 31.719 1.00 57.92 C -ANISOU 1625 CB LEU A 213 7832 7381 6793 -594 -108 -466 C -ATOM 1626 CG LEU A 213 58.912 67.514 31.641 1.00 62.21 C -ANISOU 1626 CG LEU A 213 8520 7812 7304 -563 -79 -551 C -ATOM 1627 CD1 LEU A 213 59.476 68.515 32.614 1.00 63.84 C -ANISOU 1627 CD1 LEU A 213 8868 8010 7379 -626 -124 -634 C -ATOM 1628 CD2 LEU A 213 58.983 68.090 30.252 1.00 63.10 C -ANISOU 1628 CD2 LEU A 213 8652 7820 7503 -596 -92 -566 C -ATOM 1629 N PHE A 214 57.255 64.223 32.410 1.00 63.28 N -ANISOU 1629 N PHE A 214 8386 8138 7517 -397 65 -340 N -ATOM 1630 CA PHE A 214 55.828 63.912 32.512 1.00 63.96 C -ANISOU 1630 CA PHE A 214 8440 8241 7622 -317 160 -320 C -ATOM 1631 C PHE A 214 55.484 63.123 33.808 1.00 67.95 C -ANISOU 1631 C PHE A 214 8940 8839 8040 -293 211 -270 C -ATOM 1632 O PHE A 214 54.514 63.481 34.467 1.00 68.66 O -ANISOU 1632 O PHE A 214 9057 8964 8067 -230 283 -297 O -ATOM 1633 CB PHE A 214 55.308 63.227 31.217 1.00 65.66 C -ANISOU 1633 CB PHE A 214 8549 8425 7973 -314 183 -273 C -ATOM 1634 CG PHE A 214 55.085 64.096 29.963 1.00 67.13 C -ANISOU 1634 CG PHE A 214 8746 8527 8235 -298 165 -325 C -ATOM 1635 CD1 PHE A 214 55.437 65.449 29.949 1.00 70.64 C -ANISOU 1635 CD1 PHE A 214 9308 8903 8629 -298 129 -406 C -ATOM 1636 CD2 PHE A 214 54.531 63.551 28.803 1.00 68.12 C -ANISOU 1636 CD2 PHE A 214 8779 8633 8471 -287 182 -292 C -ATOM 1637 CE1 PHE A 214 55.232 66.237 28.802 1.00 71.05 C -ANISOU 1637 CE1 PHE A 214 9394 8865 8739 -279 115 -444 C -ATOM 1638 CE2 PHE A 214 54.309 64.346 27.668 1.00 70.24 C -ANISOU 1638 CE2 PHE A 214 9065 8828 8796 -261 164 -335 C -ATOM 1639 CZ PHE A 214 54.669 65.680 27.671 1.00 68.50 C -ANISOU 1639 CZ PHE A 214 8971 8535 8523 -254 132 -406 C -ATOM 1640 N ILE A 215 56.303 62.132 34.217 1.00 63.94 N -ANISOU 1640 N ILE A 215 8409 8374 7510 -332 176 -200 N -ATOM 1641 CA ILE A 215 56.111 61.381 35.467 1.00 64.88 C -ANISOU 1641 CA ILE A 215 8549 8573 7531 -311 219 -143 C -ATOM 1642 C ILE A 215 56.188 62.334 36.669 1.00 71.56 C -ANISOU 1642 C ILE A 215 9495 9461 8232 -284 215 -214 C -ATOM 1643 O ILE A 215 55.345 62.249 37.566 1.00 73.30 O -ANISOU 1643 O ILE A 215 9741 9737 8374 -237 295 -205 O -ATOM 1644 CB ILE A 215 57.092 60.174 35.576 1.00 68.40 C -ANISOU 1644 CB ILE A 215 8973 9044 7974 -336 167 -54 C -ATOM 1645 CG1 ILE A 215 56.635 59.024 34.645 1.00 69.41 C -ANISOU 1645 CG1 ILE A 215 9029 9125 8218 -348 205 25 C -ATOM 1646 CG2 ILE A 215 57.286 59.680 37.036 1.00 69.73 C -ANISOU 1646 CG2 ILE A 215 9203 9292 7998 -310 178 -10 C -ATOM 1647 CD1 ILE A 215 57.617 57.832 34.516 1.00 84.19 C -ANISOU 1647 CD1 ILE A 215 10895 10995 10099 -349 149 107 C -ATOM 1648 N GLY A 216 57.173 63.241 36.653 1.00 66.47 N -ANISOU 1648 N GLY A 216 8909 8793 7552 -323 126 -287 N -ATOM 1649 CA GLY A 216 57.357 64.263 37.674 1.00 66.34 C -ANISOU 1649 CA GLY A 216 9008 8798 7399 -314 106 -372 C -ATOM 1650 C GLY A 216 56.123 65.123 37.873 1.00 70.03 C -ANISOU 1650 C GLY A 216 9539 9235 7835 -235 189 -437 C -ATOM 1651 O GLY A 216 55.701 65.328 39.011 1.00 70.95 O -ANISOU 1651 O GLY A 216 9721 9410 7828 -181 233 -460 O -ATOM 1652 N ILE A 217 55.514 65.607 36.767 1.00 66.23 N -ANISOU 1652 N ILE A 217 9037 8673 7457 -211 211 -467 N -ATOM 1653 CA ILE A 217 54.293 66.428 36.795 1.00 67.07 C -ANISOU 1653 CA ILE A 217 9190 8757 7537 -106 287 -530 C -ATOM 1654 C ILE A 217 53.124 65.581 37.277 1.00 74.00 C -ANISOU 1654 C ILE A 217 9974 9741 8399 -40 397 -467 C -ATOM 1655 O ILE A 217 52.403 65.990 38.177 1.00 75.25 O -ANISOU 1655 O ILE A 217 10184 9959 8447 43 461 -506 O -ATOM 1656 CB ILE A 217 53.954 67.122 35.437 1.00 68.68 C -ANISOU 1656 CB ILE A 217 9392 8855 7847 -83 277 -569 C -ATOM 1657 CG1 ILE A 217 55.147 67.927 34.881 1.00 67.61 C -ANISOU 1657 CG1 ILE A 217 9352 8611 7727 -177 175 -621 C -ATOM 1658 CG2 ILE A 217 52.697 68.014 35.586 1.00 69.82 C -ANISOU 1658 CG2 ILE A 217 9596 8993 7938 62 351 -639 C -ATOM 1659 CD1 ILE A 217 55.016 68.392 33.444 1.00 64.09 C -ANISOU 1659 CD1 ILE A 217 8904 8059 7390 -175 160 -636 C -ATOM 1660 N CYS A 218 52.962 64.405 36.680 1.00 71.56 N -ANISOU 1660 N CYS A 218 9537 9459 8195 -84 419 -373 N -ATOM 1661 CA CYS A 218 51.916 63.437 36.952 1.00 73.00 C -ANISOU 1661 CA CYS A 218 9620 9736 8382 -68 522 -300 C -ATOM 1662 C CYS A 218 51.819 63.079 38.448 1.00 75.55 C -ANISOU 1662 C CYS A 218 9990 10156 8559 -54 573 -270 C -ATOM 1663 O CYS A 218 50.743 63.189 39.025 1.00 76.92 O -ANISOU 1663 O CYS A 218 10143 10419 8663 11 671 -282 O -ATOM 1664 CB CYS A 218 52.125 62.210 36.071 1.00 74.24 C -ANISOU 1664 CB CYS A 218 9674 9868 8665 -150 508 -206 C -ATOM 1665 SG CYS A 218 50.868 60.928 36.263 1.00 80.13 S -ANISOU 1665 SG CYS A 218 10307 10711 9429 -177 631 -113 S -ATOM 1666 N VAL A 219 52.950 62.750 39.084 1.00 69.38 N -ANISOU 1666 N VAL A 219 9273 9371 7718 -104 504 -240 N -ATOM 1667 CA VAL A 219 53.052 62.388 40.503 1.00 68.33 C -ANISOU 1667 CA VAL A 219 9202 9324 7435 -90 534 -206 C -ATOM 1668 C VAL A 219 52.766 63.601 41.444 1.00 72.14 C -ANISOU 1668 C VAL A 219 9793 9842 7776 -9 553 -312 C -ATOM 1669 O VAL A 219 51.981 63.464 42.387 1.00 71.20 O -ANISOU 1669 O VAL A 219 9683 9820 7550 44 648 -298 O -ATOM 1670 CB VAL A 219 54.420 61.695 40.760 1.00 70.65 C -ANISOU 1670 CB VAL A 219 9528 9609 7708 -149 437 -149 C -ATOM 1671 CG1 VAL A 219 54.790 61.660 42.232 1.00 71.46 C -ANISOU 1671 CG1 VAL A 219 9724 9794 7632 -123 432 -143 C -ATOM 1672 CG2 VAL A 219 54.426 60.287 40.182 1.00 69.61 C -ANISOU 1672 CG2 VAL A 219 9318 9458 7671 -198 454 -30 C -ATOM 1673 N ASP A 220 53.389 64.768 41.177 1.00 69.81 N -ANISOU 1673 N ASP A 220 9585 9466 7473 -4 468 -416 N -ATOM 1674 CA ASP A 220 53.221 65.996 41.964 1.00 71.34 C -ANISOU 1674 CA ASP A 220 9916 9658 7532 69 471 -530 C -ATOM 1675 C ASP A 220 51.799 66.547 41.877 1.00 76.50 C -ANISOU 1675 C ASP A 220 10556 10338 8172 193 579 -578 C -ATOM 1676 O ASP A 220 51.217 66.879 42.917 1.00 77.79 O -ANISOU 1676 O ASP A 220 10781 10581 8194 281 646 -616 O -ATOM 1677 CB ASP A 220 54.216 67.082 41.521 1.00 73.57 C -ANISOU 1677 CB ASP A 220 10308 9823 7823 18 353 -627 C -ATOM 1678 CG ASP A 220 55.662 66.940 41.979 1.00 90.59 C -ANISOU 1678 CG ASP A 220 12507 11992 9922 -87 239 -625 C -ATOM 1679 OD1 ASP A 220 55.969 65.958 42.700 1.00 92.00 O -ANISOU 1679 OD1 ASP A 220 12638 12267 10050 -101 242 -543 O -ATOM 1680 OD2 ASP A 220 56.491 67.826 41.623 1.00 98.95 O -ANISOU 1680 OD2 ASP A 220 13648 12969 10978 -156 146 -707 O -ATOM 1681 N ALA A 221 51.240 66.631 40.644 1.00 72.05 N -ANISOU 1681 N ALA A 221 9908 9724 7745 212 596 -577 N -ATOM 1682 CA ALA A 221 49.891 67.140 40.366 1.00 72.56 C -ANISOU 1682 CA ALA A 221 9932 9831 7807 344 689 -622 C -ATOM 1683 C ALA A 221 48.798 66.347 41.078 1.00 78.66 C -ANISOU 1683 C ALA A 221 10589 10778 8522 385 819 -560 C -ATOM 1684 O ALA A 221 47.856 66.948 41.598 1.00 79.43 O -ANISOU 1684 O ALA A 221 10703 10960 8517 517 900 -619 O -ATOM 1685 CB ALA A 221 49.626 67.181 38.867 1.00 71.90 C -ANISOU 1685 CB ALA A 221 9760 9675 7883 341 669 -617 C -ATOM 1686 N MET A 222 48.939 65.013 41.127 1.00 76.30 N -ANISOU 1686 N MET A 222 10185 10531 8275 272 841 -441 N -ATOM 1687 CA MET A 222 47.994 64.129 41.795 1.00 78.47 C -ANISOU 1687 CA MET A 222 10358 10961 8494 267 966 -365 C -ATOM 1688 C MET A 222 47.975 64.388 43.291 1.00 82.07 C -ANISOU 1688 C MET A 222 10918 11506 8760 325 1012 -386 C -ATOM 1689 O MET A 222 46.893 64.504 43.869 1.00 83.98 O -ANISOU 1689 O MET A 222 11109 11888 8911 407 1130 -398 O -ATOM 1690 CB MET A 222 48.302 62.658 41.492 1.00 81.60 C -ANISOU 1690 CB MET A 222 10671 11352 8982 121 965 -233 C -ATOM 1691 CG MET A 222 47.979 62.270 40.053 1.00 86.97 C -ANISOU 1691 CG MET A 222 11224 11984 9836 71 953 -208 C -ATOM 1692 SD MET A 222 47.933 60.486 39.761 1.00 93.83 S -ANISOU 1692 SD MET A 222 12000 12861 10789 -89 989 -59 S -ATOM 1693 CE MET A 222 49.701 60.067 39.815 1.00 90.04 C -ANISOU 1693 CE MET A 222 11645 12240 10326 -148 851 -16 C -ATOM 1694 N ALA A 223 49.170 64.536 43.906 1.00 75.40 N -ANISOU 1694 N ALA A 223 10211 10592 7845 289 919 -399 N -ATOM 1695 CA ALA A 223 49.348 64.801 45.334 1.00 74.67 C -ANISOU 1695 CA ALA A 223 10237 10571 7561 337 939 -424 C -ATOM 1696 C ALA A 223 48.747 66.164 45.729 1.00 78.37 C -ANISOU 1696 C ALA A 223 10799 11058 7919 490 972 -560 C -ATOM 1697 O ALA A 223 48.066 66.241 46.744 1.00 80.17 O -ANISOU 1697 O ALA A 223 11048 11415 8001 572 1069 -570 O -ATOM 1698 CB ALA A 223 50.825 64.742 45.694 1.00 74.40 C -ANISOU 1698 CB ALA A 223 10315 10462 7493 262 808 -421 C -ATOM 1699 N ILE A 224 48.974 67.217 44.912 1.00 72.47 N -ANISOU 1699 N ILE A 224 10119 10181 7234 533 897 -660 N -ATOM 1700 CA ILE A 224 48.462 68.572 45.127 1.00 72.34 C -ANISOU 1700 CA ILE A 224 10228 10139 7120 691 914 -795 C -ATOM 1701 C ILE A 224 46.927 68.590 45.047 1.00 78.56 C -ANISOU 1701 C ILE A 224 10890 11071 7889 833 1055 -798 C -ATOM 1702 O ILE A 224 46.287 69.123 45.959 1.00 79.63 O -ANISOU 1702 O ILE A 224 11085 11304 7866 970 1133 -860 O -ATOM 1703 CB ILE A 224 49.129 69.591 44.152 1.00 73.56 C -ANISOU 1703 CB ILE A 224 10496 10096 7358 679 798 -883 C -ATOM 1704 CG1 ILE A 224 50.618 69.794 44.489 1.00 72.55 C -ANISOU 1704 CG1 ILE A 224 10505 9862 7197 547 664 -908 C -ATOM 1705 CG2 ILE A 224 48.380 70.932 44.121 1.00 74.78 C -ANISOU 1705 CG2 ILE A 224 10778 10203 7432 866 828 -1011 C -ATOM 1706 CD1 ILE A 224 51.471 70.258 43.350 1.00 72.49 C -ANISOU 1706 CD1 ILE A 224 10541 9688 7316 453 552 -937 C -ATOM 1707 N THR A 225 46.345 68.010 43.964 1.00 75.19 N -ANISOU 1707 N THR A 225 10282 10671 7617 800 1087 -737 N -ATOM 1708 CA THR A 225 44.887 67.955 43.744 1.00 75.95 C -ANISOU 1708 CA THR A 225 10213 10930 7712 914 1212 -735 C -ATOM 1709 C THR A 225 44.175 67.201 44.876 1.00 80.94 C -ANISOU 1709 C THR A 225 10754 11777 8222 910 1346 -671 C -ATOM 1710 O THR A 225 43.126 67.649 45.340 1.00 81.96 O -ANISOU 1710 O THR A 225 10838 12063 8240 1064 1452 -722 O -ATOM 1711 CB THR A 225 44.555 67.413 42.348 1.00 81.43 C -ANISOU 1711 CB THR A 225 10735 11606 8596 843 1198 -679 C -ATOM 1712 OG1 THR A 225 45.244 68.198 41.378 1.00 82.29 O -ANISOU 1712 OG1 THR A 225 10952 11521 8793 863 1082 -744 O -ATOM 1713 CG2 THR A 225 43.059 67.441 42.043 1.00 81.15 C -ANISOU 1713 CG2 THR A 225 10510 11764 8560 954 1316 -685 C -ATOM 1714 N LYS A 226 44.775 66.087 45.334 1.00 76.57 N -ANISOU 1714 N LYS A 226 10185 11231 7677 743 1342 -559 N -ATOM 1715 CA LYS A 226 44.267 65.252 46.416 1.00 77.54 C -ANISOU 1715 CA LYS A 226 10249 11530 7682 703 1463 -476 C -ATOM 1716 C LYS A 226 44.154 66.075 47.718 1.00 84.52 C -ANISOU 1716 C LYS A 226 11274 12489 8350 847 1505 -559 C -ATOM 1717 O LYS A 226 43.164 65.918 48.432 1.00 86.39 O -ANISOU 1717 O LYS A 226 11430 12924 8469 910 1645 -544 O -ATOM 1718 CB LYS A 226 45.160 64.014 46.582 1.00 78.70 C -ANISOU 1718 CB LYS A 226 10410 11615 7876 513 1418 -346 C -ATOM 1719 CG LYS A 226 44.566 62.886 47.406 1.00 96.92 C -ANISOU 1719 CG LYS A 226 12645 14082 10097 430 1549 -227 C -ATOM 1720 CD LYS A 226 45.634 62.256 48.301 1.00107.25 C -ANISOU 1720 CD LYS A 226 14097 15332 11323 349 1496 -151 C -ATOM 1721 CE LYS A 226 45.095 61.172 49.203 1.00120.85 C -ANISOU 1721 CE LYS A 226 15787 17193 12936 270 1628 -27 C -ATOM 1722 NZ LYS A 226 44.810 59.915 48.460 1.00131.19 N -ANISOU 1722 NZ LYS A 226 16974 18493 14378 107 1672 97 N -ATOM 1723 N GLU A 227 45.127 66.983 47.988 1.00 81.41 N -ANISOU 1723 N GLU A 227 11088 11944 7900 895 1388 -653 N -ATOM 1724 CA GLU A 227 45.117 67.877 49.150 1.00 83.92 C -ANISOU 1724 CA GLU A 227 11574 12298 8012 1034 1406 -754 C -ATOM 1725 C GLU A 227 44.037 68.955 49.014 1.00 90.05 C -ANISOU 1725 C GLU A 227 12351 13140 8726 1254 1478 -872 C -ATOM 1726 O GLU A 227 43.310 69.208 49.970 1.00 91.59 O -ANISOU 1726 O GLU A 227 12559 13492 8748 1386 1586 -909 O -ATOM 1727 CB GLU A 227 46.482 68.539 49.355 1.00 85.19 C -ANISOU 1727 CB GLU A 227 11955 12271 8141 993 1249 -827 C -ATOM 1728 CG GLU A 227 47.430 67.707 50.187 1.00101.60 C -ANISOU 1728 CG GLU A 227 14081 14364 10159 859 1203 -742 C -ATOM 1729 CD GLU A 227 48.812 68.314 50.311 1.00135.02 C -ANISOU 1729 CD GLU A 227 18495 18441 14367 799 1039 -814 C -ATOM 1730 OE1 GLU A 227 48.994 69.187 51.190 1.00138.01 O -ANISOU 1730 OE1 GLU A 227 19047 18814 14577 882 1016 -922 O -ATOM 1731 OE2 GLU A 227 49.708 67.927 49.524 1.00131.48 O -ANISOU 1731 OE2 GLU A 227 18011 17885 14060 666 933 -768 O -ATOM 1732 N GLN A 228 43.942 69.583 47.822 1.00 86.53 N -ANISOU 1732 N GLN A 228 11894 12574 8409 1305 1418 -929 N -ATOM 1733 CA GLN A 228 42.973 70.629 47.475 1.00 87.22 C -ANISOU 1733 CA GLN A 228 11987 12698 8453 1534 1467 -1039 C -ATOM 1734 C GLN A 228 41.541 70.120 47.515 1.00 93.66 C -ANISOU 1734 C GLN A 228 12557 13786 9244 1617 1628 -994 C -ATOM 1735 O GLN A 228 40.649 70.871 47.896 1.00 95.15 O -ANISOU 1735 O GLN A 228 12756 14098 9300 1840 1710 -1082 O -ATOM 1736 CB GLN A 228 43.277 71.199 46.089 1.00 86.60 C -ANISOU 1736 CB GLN A 228 11942 12428 8536 1539 1361 -1080 C -ATOM 1737 CG GLN A 228 44.556 72.023 46.046 1.00 89.33 C -ANISOU 1737 CG GLN A 228 12551 12515 8876 1487 1213 -1157 C -ATOM 1738 CD GLN A 228 44.726 72.732 44.734 1.00101.53 C -ANISOU 1738 CD GLN A 228 14152 13876 10549 1515 1127 -1205 C -ATOM 1739 OE1 GLN A 228 45.007 73.928 44.692 1.00 93.57 O -ANISOU 1739 OE1 GLN A 228 13376 12702 9476 1613 1065 -1318 O -ATOM 1740 NE2 GLN A 228 44.578 72.012 43.630 1.00 99.07 N -ANISOU 1740 NE2 GLN A 228 13645 13580 10415 1423 1122 -1118 N -ATOM 1741 N GLU A 229 41.327 68.851 47.109 1.00 90.90 N -ANISOU 1741 N GLU A 229 11989 13533 9014 1438 1673 -861 N -ATOM 1742 CA GLU A 229 40.034 68.165 47.114 1.00 92.51 C -ANISOU 1742 CA GLU A 229 11935 14009 9206 1447 1825 -800 C -ATOM 1743 C GLU A 229 39.608 67.860 48.557 1.00100.64 C -ANISOU 1743 C GLU A 229 12964 15239 10037 1471 1955 -773 C -ATOM 1744 O GLU A 229 38.410 67.883 48.850 1.00102.89 O -ANISOU 1744 O GLU A 229 13089 15777 10229 1584 2095 -787 O -ATOM 1745 CB GLU A 229 40.108 66.875 46.281 1.00 92.34 C -ANISOU 1745 CB GLU A 229 11731 13987 9368 1211 1818 -667 C -ATOM 1746 CG GLU A 229 38.814 66.512 45.567 1.00104.44 C -ANISOU 1746 CG GLU A 229 12988 15734 10960 1228 1918 -645 C -ATOM 1747 CD GLU A 229 38.343 67.424 44.444 1.00121.48 C -ANISOU 1747 CD GLU A 229 15096 17866 13194 1401 1869 -742 C -ATOM 1748 OE1 GLU A 229 39.193 67.938 43.679 1.00107.45 O -ANISOU 1748 OE1 GLU A 229 13467 15842 11516 1409 1732 -783 O -ATOM 1749 OE2 GLU A 229 37.110 67.608 44.321 1.00113.89 O -ANISOU 1749 OE2 GLU A 229 13944 17144 12184 1532 1970 -774 O -ATOM 1750 N GLU A 230 40.594 67.607 49.460 1.00 97.24 N -ANISOU 1750 N GLU A 230 12708 14710 9529 1375 1908 -740 N -ATOM 1751 CA GLU A 230 40.375 67.351 50.888 1.00 98.87 C -ANISOU 1751 CA GLU A 230 12957 15077 9531 1396 2015 -714 C -ATOM 1752 C GLU A 230 39.955 68.620 51.615 1.00102.56 C -ANISOU 1752 C GLU A 230 13556 15605 9808 1661 2052 -863 C -ATOM 1753 O GLU A 230 38.994 68.580 52.380 1.00103.76 O -ANISOU 1753 O GLU A 230 13617 16001 9806 1765 2202 -866 O -ATOM 1754 CB GLU A 230 41.627 66.759 51.550 1.00100.01 C -ANISOU 1754 CB GLU A 230 13263 15089 9649 1235 1932 -642 C -ATOM 1755 CG GLU A 230 41.768 65.260 51.366 1.00116.26 C -ANISOU 1755 CG GLU A 230 15196 17169 11809 998 1960 -471 C -ATOM 1756 CD GLU A 230 42.955 64.667 52.095 1.00149.43 C -ANISOU 1756 CD GLU A 230 19557 21260 15957 876 1882 -397 C -ATOM 1757 OE1 GLU A 230 44.022 64.500 51.459 1.00146.98 O -ANISOU 1757 OE1 GLU A 230 19313 20755 15779 779 1736 -380 O -ATOM 1758 OE2 GLU A 230 42.824 64.383 53.308 1.00151.27 O -ANISOU 1758 OE2 GLU A 230 19849 21617 16010 887 1965 -358 O -ATOM 1759 N GLU A 231 40.676 69.743 51.381 1.00 98.05 N -ANISOU 1759 N GLU A 231 13207 14811 9237 1765 1918 -986 N -ATOM 1760 CA GLU A 231 40.397 71.062 51.971 1.00 99.74 C -ANISOU 1760 CA GLU A 231 13602 15021 9273 2024 1929 -1143 C -ATOM 1761 C GLU A 231 39.049 71.609 51.479 1.00105.42 C -ANISOU 1761 C GLU A 231 14171 15910 9973 2253 2033 -1208 C -ATOM 1762 O GLU A 231 38.394 72.365 52.200 1.00106.98 O -ANISOU 1762 O GLU A 231 14433 16234 9981 2487 2116 -1305 O -ATOM 1763 CB GLU A 231 41.505 72.067 51.625 1.00100.21 C -ANISOU 1763 CB GLU A 231 13936 14773 9365 2039 1754 -1251 C -ATOM 1764 CG GLU A 231 42.850 71.775 52.264 1.00112.49 C -ANISOU 1764 CG GLU A 231 15660 16188 10895 1855 1643 -1223 C -ATOM 1765 CD GLU A 231 44.025 72.532 51.668 1.00144.41 C -ANISOU 1765 CD GLU A 231 19910 19940 15019 1790 1463 -1301 C -ATOM 1766 OE1 GLU A 231 44.894 72.974 52.455 1.00149.68 O -ANISOU 1766 OE1 GLU A 231 20790 20509 15571 1752 1380 -1361 O -ATOM 1767 OE2 GLU A 231 44.090 72.674 50.424 1.00138.83 O -ANISOU 1767 OE2 GLU A 231 19151 19112 14484 1765 1405 -1301 O -ATOM 1768 N ALA A 232 38.648 71.242 50.243 1.00101.14 N -ANISOU 1768 N ALA A 232 13430 15380 9618 2198 2023 -1158 N -ATOM 1769 CA ALA A 232 37.378 71.657 49.644 1.00102.08 C -ANISOU 1769 CA ALA A 232 13369 15683 9735 2405 2109 -1209 C -ATOM 1770 C ALA A 232 36.186 71.009 50.360 1.00108.19 C -ANISOU 1770 C ALA A 232 13894 16827 10387 2437 2301 -1155 C -ATOM 1771 O ALA A 232 35.119 71.619 50.441 1.00110.22 O -ANISOU 1771 O ALA A 232 14059 17290 10530 2689 2396 -1235 O -ATOM 1772 CB ALA A 232 37.353 71.302 48.164 1.00100.73 C -ANISOU 1772 CB ALA A 232 13042 15437 9793 2301 2041 -1158 C -ATOM 1773 N LYS A 233 36.380 69.785 50.888 1.00104.16 N -ANISOU 1773 N LYS A 233 13283 16404 9890 2187 2359 -1018 N -ATOM 1774 CA LYS A 233 35.351 69.002 51.563 1.00105.77 C -ANISOU 1774 CA LYS A 233 13254 16948 9988 2146 2545 -941 C -ATOM 1775 C LYS A 233 35.381 69.094 53.090 1.00111.68 C -ANISOU 1775 C LYS A 233 14131 17803 10498 2211 2635 -953 C -ATOM 1776 O LYS A 233 34.322 69.262 53.698 1.00114.08 O -ANISOU 1776 O LYS A 233 14307 18400 10638 2367 2790 -985 O -ATOM 1777 CB LYS A 233 35.417 67.535 51.105 1.00106.97 C -ANISOU 1777 CB LYS A 233 13218 17130 10297 1820 2566 -773 C -ATOM 1778 N THR A 234 36.578 68.975 53.708 1.00106.82 N -ANISOU 1778 N THR A 234 13760 16972 9856 2097 2540 -930 N -ATOM 1779 CA THR A 234 36.746 68.965 55.170 1.00107.78 C -ANISOU 1779 CA THR A 234 14024 17176 9752 2132 2608 -930 C -ATOM 1780 C THR A 234 37.387 70.246 55.760 1.00111.50 C -ANISOU 1780 C THR A 234 14811 17472 10084 2336 2510 -1087 C -ATOM 1781 O THR A 234 37.486 70.359 56.983 1.00113.87 O -ANISOU 1781 O THR A 234 15243 17844 10180 2391 2561 -1107 O -ATOM 1782 CB THR A 234 37.517 67.700 55.623 1.00114.31 C -ANISOU 1782 CB THR A 234 14874 17947 10613 1841 2594 -769 C -ATOM 1783 OG1 THR A 234 38.894 67.816 55.266 1.00113.60 O -ANISOU 1783 OG1 THR A 234 14983 17541 10639 1740 2401 -777 O -ATOM 1784 CG2 THR A 234 36.932 66.399 55.055 1.00111.40 C -ANISOU 1784 CG2 THR A 234 14234 17719 10375 1617 2688 -613 C -ATOM 1785 N GLY A 235 37.810 71.181 54.911 1.00129.51 N -ANISOU 1785 N GLY A 235 17452 20493 11262 3440 2836 -501 N -ATOM 1786 CA GLY A 235 38.433 72.428 55.352 1.00128.18 C -ANISOU 1786 CA GLY A 235 17634 20046 11022 3531 3103 -274 C -ATOM 1787 C GLY A 235 39.903 72.306 55.700 1.00131.44 C -ANISOU 1787 C GLY A 235 18178 19884 11882 3278 2952 -230 C -ATOM 1788 O GLY A 235 40.541 73.300 56.052 1.00130.20 O -ANISOU 1788 O GLY A 235 18283 19444 11741 3311 3146 -78 O -ATOM 1789 N HIS A 236 40.449 71.081 55.601 1.00129.02 N -ANISOU 1789 N HIS A 236 17682 19402 11937 3025 2609 -371 N -ATOM 1790 CA HIS A 236 41.845 70.742 55.888 1.00128.55 C -ANISOU 1790 CA HIS A 236 17698 18854 12290 2780 2423 -344 C -ATOM 1791 C HIS A 236 42.278 69.492 55.093 1.00132.98 C -ANISOU 1791 C HIS A 236 17994 19406 13125 2754 2155 -539 C -ATOM 1792 O HIS A 236 41.437 68.814 54.498 1.00133.13 O -ANISOU 1792 O HIS A 236 17773 19758 13053 2849 2067 -721 O -ATOM 1793 CB HIS A 236 42.043 70.527 57.407 1.00129.03 C -ANISOU 1793 CB HIS A 236 17943 18604 12478 2333 2228 -226 C -ATOM 1794 CG HIS A 236 41.288 69.354 57.958 1.00133.00 C -ANISOU 1794 CG HIS A 236 18290 19209 13035 2050 1961 -284 C -ATOM 1795 ND1 HIS A 236 39.980 69.477 58.391 1.00135.48 N -ANISOU 1795 ND1 HIS A 236 18583 19838 13053 2057 2024 -227 N -ATOM 1796 CD2 HIS A 236 41.680 68.067 58.113 1.00134.92 C -ANISOU 1796 CD2 HIS A 236 18391 19268 13604 1771 1663 -372 C -ATOM 1797 CE1 HIS A 236 39.621 68.270 58.797 1.00135.53 C -ANISOU 1797 CE1 HIS A 236 18416 19826 13253 1769 1767 -279 C -ATOM 1798 NE2 HIS A 236 40.610 67.388 58.643 1.00135.60 N -ANISOU 1798 NE2 HIS A 236 18356 19527 13640 1591 1554 -372 N -ATOM 1799 N HIS A 237 43.583 69.184 55.102 1.00129.80 N -ANISOU 1799 N HIS A 237 17636 18629 13053 2627 2018 -510 N -ATOM 1800 CA HIS A 237 44.133 68.010 54.424 1.00130.31 C -ANISOU 1800 CA HIS A 237 17503 18635 13373 2609 1756 -666 C -ATOM 1801 C HIS A 237 44.880 67.084 55.403 1.00134.95 C -ANISOU 1801 C HIS A 237 18164 18838 14271 2149 1457 -625 C -ATOM 1802 O HIS A 237 45.189 67.497 56.528 1.00134.06 O -ANISOU 1802 O HIS A 237 18252 18495 14189 1900 1470 -472 O -ATOM 1803 CB HIS A 237 45.027 68.424 53.238 1.00130.90 C -ANISOU 1803 CB HIS A 237 17524 18705 13509 3018 1896 -651 C -ATOM 1804 CG HIS A 237 46.206 69.267 53.621 1.00133.50 C -ANISOU 1804 CG HIS A 237 18056 18673 13994 2965 2032 -437 C -ATOM 1805 ND1 HIS A 237 46.148 70.648 53.582 1.00135.28 N -ANISOU 1805 ND1 HIS A 237 18423 18911 14066 3189 2400 -291 N -ATOM 1806 CD2 HIS A 237 47.443 68.894 54.027 1.00134.56 C -ANISOU 1806 CD2 HIS A 237 18258 18440 14428 2715 1851 -360 C -ATOM 1807 CE1 HIS A 237 47.342 71.069 53.966 1.00134.30 C -ANISOU 1807 CE1 HIS A 237 18431 18404 14192 3039 2417 -150 C -ATOM 1808 NE2 HIS A 237 48.154 70.049 54.246 1.00134.16 N -ANISOU 1808 NE2 HIS A 237 18365 18173 14435 2758 2087 -186 N -ATOM 1809 N GLN A 238 45.154 65.833 54.971 1.00132.68 N -ANISOU 1809 N GLN A 238 17717 18500 14194 2070 1195 -773 N -ATOM 1810 CA GLN A 238 45.879 64.816 55.740 1.00132.76 C -ANISOU 1810 CA GLN A 238 17780 18177 14487 1698 935 -739 C -ATOM 1811 C GLN A 238 47.341 65.241 55.933 1.00136.16 C -ANISOU 1811 C GLN A 238 18368 18308 15059 1682 952 -581 C -ATOM 1812 O GLN A 238 48.021 65.582 54.960 1.00134.96 O -ANISOU 1812 O GLN A 238 18173 18175 14929 1982 1032 -572 O -ATOM 1813 CB GLN A 238 45.775 63.431 55.047 1.00135.36 C -ANISOU 1813 CB GLN A 238 17908 18535 14986 1687 688 -954 C -ATOM 1814 CG GLN A 238 46.699 62.314 55.588 1.00152.98 C -ANISOU 1814 CG GLN A 238 20202 20418 17504 1392 451 -915 C -ATOM 1815 CD GLN A 238 46.409 61.852 57.005 1.00173.57 C -ANISOU 1815 CD GLN A 238 22898 22847 20203 987 390 -802 C -ATOM 1816 OE1 GLN A 238 45.254 61.692 57.426 1.00169.81 O -ANISOU 1816 OE1 GLN A 238 22342 22506 19671 860 412 -834 O -ATOM 1817 NE2 GLN A 238 47.466 61.569 57.756 1.00164.72 N -ANISOU 1817 NE2 GLN A 238 21922 21442 19221 804 314 -657 N -ATOM 1818 N GLU A 239 47.803 65.234 57.198 1.00133.54 N -ANISOU 1818 N GLU A 239 18195 17728 14815 1357 885 -452 N -ATOM 1819 CA GLU A 239 49.175 65.590 57.573 1.00133.16 C -ANISOU 1819 CA GLU A 239 18276 17411 14908 1279 872 -325 C -ATOM 1820 C GLU A 239 50.180 64.550 57.039 1.00138.63 C -ANISOU 1820 C GLU A 239 18893 17975 15804 1282 673 -349 C -ATOM 1821 O GLU A 239 49.839 63.359 56.996 1.00138.54 O -ANISOU 1821 O GLU A 239 18800 17975 15866 1178 493 -447 O -ATOM 1822 CB GLU A 239 49.316 65.785 59.101 1.00134.27 C -ANISOU 1822 CB GLU A 239 18579 17385 15052 969 830 -225 C -ATOM 1823 CG GLU A 239 48.928 64.584 59.958 1.00143.78 C -ANISOU 1823 CG GLU A 239 19758 18548 16325 707 640 -232 C -ATOM 1824 CD GLU A 239 49.251 64.681 61.438 1.00156.68 C -ANISOU 1824 CD GLU A 239 21533 20042 17957 482 591 -122 C -ATOM 1825 OE1 GLU A 239 48.435 64.190 62.251 1.00147.06 O -ANISOU 1825 OE1 GLU A 239 20309 18877 16691 356 556 -81 O -ATOM 1826 OE2 GLU A 239 50.326 65.221 61.786 1.00145.60 O -ANISOU 1826 OE2 GLU A 239 20225 18489 16606 448 586 -77 O -ATOM 1827 N PRO A 240 51.402 64.962 56.601 1.00135.90 N -ANISOU 1827 N PRO A 240 18573 17506 15557 1409 708 -251 N -ATOM 1828 CA PRO A 240 52.365 63.964 56.095 1.00135.83 C -ANISOU 1828 CA PRO A 240 18508 17404 15697 1446 515 -243 C -ATOM 1829 C PRO A 240 52.762 62.946 57.164 1.00139.54 C -ANISOU 1829 C PRO A 240 19055 17702 16263 1102 312 -219 C -ATOM 1830 O PRO A 240 52.785 63.281 58.352 1.00138.86 O -ANISOU 1830 O PRO A 240 19074 17526 16159 862 334 -156 O -ATOM 1831 CB PRO A 240 53.558 64.810 55.633 1.00137.33 C -ANISOU 1831 CB PRO A 240 18713 17503 15965 1622 632 -90 C -ATOM 1832 CG PRO A 240 53.434 66.092 56.373 1.00141.74 C -ANISOU 1832 CG PRO A 240 19378 17993 16484 1512 835 -26 C -ATOM 1833 CD PRO A 240 51.968 66.328 56.561 1.00137.39 C -ANISOU 1833 CD PRO A 240 18836 17621 15743 1522 931 -131 C -ATOM 1834 N ILE A 241 53.052 61.701 56.738 1.00136.23 N -ANISOU 1834 N ILE A 241 18585 17246 15929 1118 127 -271 N -ATOM 1835 CA ILE A 241 53.439 60.585 57.612 1.00136.15 C -ANISOU 1835 CA ILE A 241 18647 17076 16007 851 -32 -235 C -ATOM 1836 C ILE A 241 54.638 60.972 58.506 1.00139.23 C -ANISOU 1836 C ILE A 241 19148 17340 16411 712 -27 -69 C -ATOM 1837 O ILE A 241 54.676 60.557 59.665 1.00139.02 O -ANISOU 1837 O ILE A 241 19196 17238 16388 480 -67 -26 O -ATOM 1838 CB ILE A 241 53.653 59.252 56.827 1.00139.90 C -ANISOU 1838 CB ILE A 241 19073 17515 16570 947 -210 -318 C -ATOM 1839 CG1 ILE A 241 52.546 59.022 55.764 1.00141.45 C -ANISOU 1839 CG1 ILE A 241 19117 17877 16751 1141 -231 -539 C -ATOM 1840 CG2 ILE A 241 53.738 58.045 57.772 1.00141.01 C -ANISOU 1840 CG2 ILE A 241 19290 17486 16802 673 -314 -287 C -ATOM 1841 CD1 ILE A 241 52.968 59.281 54.296 1.00149.12 C -ANISOU 1841 CD1 ILE A 241 19997 18988 17673 1571 -247 -585 C -ATOM 1842 N SER A 242 55.564 61.823 57.990 1.00135.07 N -ANISOU 1842 N SER A 242 18612 16810 15897 871 39 19 N -ATOM 1843 CA SER A 242 56.728 62.333 58.728 1.00134.51 C -ANISOU 1843 CA SER A 242 18604 16643 15860 742 43 142 C -ATOM 1844 C SER A 242 56.300 63.201 59.917 1.00136.72 C -ANISOU 1844 C SER A 242 18958 16898 16091 538 133 116 C -ATOM 1845 O SER A 242 56.910 63.099 60.982 1.00136.52 O -ANISOU 1845 O SER A 242 18991 16820 16062 353 65 149 O -ATOM 1846 CB SER A 242 57.656 63.125 57.811 1.00138.63 C -ANISOU 1846 CB SER A 242 19062 17160 16452 962 127 247 C -ATOM 1847 OG SER A 242 58.836 63.522 58.492 1.00149.15 O -ANISOU 1847 OG SER A 242 20418 18404 17847 812 106 346 O -ATOM 1848 N GLN A 243 55.249 64.034 59.739 1.00131.77 N -ANISOU 1848 N GLN A 243 18331 16339 15397 608 284 52 N -ATOM 1849 CA GLN A 243 54.708 64.894 60.794 1.00131.23 C -ANISOU 1849 CA GLN A 243 18356 16261 15245 466 371 28 C -ATOM 1850 C GLN A 243 54.041 64.079 61.905 1.00133.46 C -ANISOU 1850 C GLN A 243 18682 16571 15455 285 271 13 C -ATOM 1851 O GLN A 243 54.314 64.335 63.077 1.00133.02 O -ANISOU 1851 O GLN A 243 18704 16478 15359 148 241 31 O -ATOM 1852 CB GLN A 243 53.749 65.948 60.220 1.00132.64 C -ANISOU 1852 CB GLN A 243 18538 16531 15330 637 582 -7 C -ATOM 1853 CG GLN A 243 54.442 67.236 59.792 1.00151.11 C -ANISOU 1853 CG GLN A 243 20894 18775 17745 748 760 42 C -ATOM 1854 CD GLN A 243 54.982 68.020 60.964 1.00175.97 C -ANISOU 1854 CD GLN A 243 24154 21780 20928 535 756 32 C -ATOM 1855 OE1 GLN A 243 56.193 68.051 61.213 1.00172.79 O -ANISOU 1855 OE1 GLN A 243 23725 21255 20671 428 673 57 O -ATOM 1856 NE2 GLN A 243 54.094 68.658 61.718 1.00169.75 N -ANISOU 1856 NE2 GLN A 243 23483 21023 19991 485 833 -16 N -ATOM 1857 N THR A 244 53.206 63.074 61.532 1.00129.21 N -ANISOU 1857 N THR A 244 18077 16098 14918 302 222 -22 N -ATOM 1858 CA THR A 244 52.511 62.156 62.448 1.00129.22 C -ANISOU 1858 CA THR A 244 18086 16103 14908 147 159 -2 C -ATOM 1859 C THR A 244 53.534 61.379 63.293 1.00134.24 C -ANISOU 1859 C THR A 244 18770 16636 15599 32 51 80 C -ATOM 1860 O THR A 244 53.324 61.206 64.496 1.00134.48 O -ANISOU 1860 O THR A 244 18848 16672 15576 -63 51 141 O -ATOM 1861 CB THR A 244 51.583 61.198 61.675 1.00132.55 C -ANISOU 1861 CB THR A 244 18394 16577 15393 178 125 -81 C -ATOM 1862 OG1 THR A 244 50.946 61.894 60.606 1.00131.44 O -ANISOU 1862 OG1 THR A 244 18180 16580 15182 364 217 -178 O -ATOM 1863 CG2 THR A 244 50.533 60.548 62.569 1.00129.93 C -ANISOU 1863 CG2 THR A 244 18040 16259 15070 25 129 -43 C -ATOM 1864 N LEU A 245 54.643 60.931 62.658 1.00130.87 N -ANISOU 1864 N LEU A 245 18327 16148 15249 86 -27 96 N -ATOM 1865 CA LEU A 245 55.741 60.214 63.310 1.00131.01 C -ANISOU 1865 CA LEU A 245 18389 16113 15278 22 -114 181 C -ATOM 1866 C LEU A 245 56.534 61.146 64.240 1.00135.87 C -ANISOU 1866 C LEU A 245 19049 16754 15820 -34 -107 198 C -ATOM 1867 O LEU A 245 57.001 60.696 65.288 1.00135.82 O -ANISOU 1867 O LEU A 245 19076 16774 15755 -92 -148 247 O -ATOM 1868 CB LEU A 245 56.667 59.547 62.274 1.00130.58 C -ANISOU 1868 CB LEU A 245 18310 16017 15286 132 -198 210 C -ATOM 1869 CG LEU A 245 56.129 58.291 61.574 1.00135.28 C -ANISOU 1869 CG LEU A 245 18880 16559 15960 174 -255 170 C -ATOM 1870 CD1 LEU A 245 56.901 58.003 60.299 1.00134.79 C -ANISOU 1870 CD1 LEU A 245 18795 16493 15927 370 -338 174 C -ATOM 1871 CD2 LEU A 245 56.161 57.080 62.490 1.00138.56 C -ANISOU 1871 CD2 LEU A 245 19355 16895 16396 57 -271 246 C -ATOM 1872 N LEU A 246 56.656 62.445 63.867 1.00133.12 N -ANISOU 1872 N LEU A 246 18695 16403 15480 2 -43 145 N -ATOM 1873 CA LEU A 246 57.335 63.473 64.670 1.00133.91 C -ANISOU 1873 CA LEU A 246 18827 16498 15556 -69 -40 108 C -ATOM 1874 C LEU A 246 56.511 63.840 65.906 1.00137.67 C -ANISOU 1874 C LEU A 246 19376 17026 15908 -125 -19 66 C -ATOM 1875 O LEU A 246 57.083 64.063 66.976 1.00137.81 O -ANISOU 1875 O LEU A 246 19417 17081 15864 -175 -83 31 O -ATOM 1876 CB LEU A 246 57.642 64.731 63.838 1.00134.21 C -ANISOU 1876 CB LEU A 246 18839 16467 15688 -11 62 75 C -ATOM 1877 CG LEU A 246 58.985 64.742 63.096 1.00139.47 C -ANISOU 1877 CG LEU A 246 19422 17089 16484 35 28 142 C -ATOM 1878 CD1 LEU A 246 58.940 65.673 61.894 1.00139.53 C -ANISOU 1878 CD1 LEU A 246 19379 17032 16604 186 187 170 C -ATOM 1879 CD2 LEU A 246 60.137 65.128 64.028 1.00143.54 C -ANISOU 1879 CD2 LEU A 246 19915 17597 17024 -107 -55 107 C -ATOM 1880 N HIS A 247 55.168 63.891 65.752 1.00133.77 N -ANISOU 1880 N HIS A 247 18905 16565 15358 -86 65 71 N -ATOM 1881 CA HIS A 247 54.222 64.185 66.828 1.00134.14 C -ANISOU 1881 CA HIS A 247 19020 16685 15264 -92 96 78 C -ATOM 1882 C HIS A 247 54.189 63.060 67.850 1.00138.13 C -ANISOU 1882 C HIS A 247 19513 17242 15729 -112 31 169 C -ATOM 1883 O HIS A 247 54.036 63.335 69.039 1.00138.39 O -ANISOU 1883 O HIS A 247 19596 17350 15637 -79 16 182 O -ATOM 1884 CB HIS A 247 52.811 64.455 66.280 1.00134.70 C -ANISOU 1884 CB HIS A 247 19093 16814 15272 -31 212 88 C -ATOM 1885 CG HIS A 247 52.679 65.748 65.531 1.00137.99 C -ANISOU 1885 CG HIS A 247 19551 17214 15665 48 337 21 C -ATOM 1886 ND1 HIS A 247 53.246 66.924 66.001 1.00140.44 N -ANISOU 1886 ND1 HIS A 247 19953 17453 15955 35 366 -41 N -ATOM 1887 CD2 HIS A 247 52.003 66.019 64.391 1.00139.31 C -ANISOU 1887 CD2 HIS A 247 19675 17434 15821 162 458 5 C -ATOM 1888 CE1 HIS A 247 52.928 67.854 65.118 1.00139.64 C -ANISOU 1888 CE1 HIS A 247 19875 17330 15852 136 531 -63 C -ATOM 1889 NE2 HIS A 247 52.181 67.358 64.131 1.00139.25 N -ANISOU 1889 NE2 HIS A 247 19743 17379 15785 239 596 -31 N -ATOM 1890 N LEU A 248 54.342 61.797 67.390 1.00134.29 N -ANISOU 1890 N LEU A 248 18965 16715 15345 -132 5 236 N -ATOM 1891 CA LEU A 248 54.378 60.616 68.256 1.00134.73 C -ANISOU 1891 CA LEU A 248 19010 16788 15395 -129 -6 352 C -ATOM 1892 C LEU A 248 55.647 60.635 69.106 1.00139.98 C -ANISOU 1892 C LEU A 248 19695 17516 15975 -95 -72 349 C -ATOM 1893 O LEU A 248 55.579 60.339 70.299 1.00140.42 O -ANISOU 1893 O LEU A 248 19762 17668 15926 -19 -56 419 O -ATOM 1894 CB LEU A 248 54.293 59.315 67.439 1.00134.47 C -ANISOU 1894 CB LEU A 248 18926 16654 15514 -161 -5 400 C -ATOM 1895 CG LEU A 248 52.898 58.881 66.987 1.00139.12 C -ANISOU 1895 CG LEU A 248 19452 17210 16197 -202 56 407 C -ATOM 1896 CD1 LEU A 248 52.981 58.029 65.751 1.00139.09 C -ANISOU 1896 CD1 LEU A 248 19394 17102 16351 -221 10 341 C -ATOM 1897 CD2 LEU A 248 52.163 58.124 68.083 1.00142.37 C -ANISOU 1897 CD2 LEU A 248 19842 17623 16627 -213 137 560 C -ATOM 1898 N GLY A 249 56.767 61.030 68.489 1.00136.91 N -ANISOU 1898 N GLY A 249 19293 17103 15625 -123 -140 272 N -ATOM 1899 CA GLY A 249 58.071 61.159 69.134 1.00137.83 C -ANISOU 1899 CA GLY A 249 19395 17310 15665 -107 -218 235 C -ATOM 1900 C GLY A 249 58.092 62.217 70.221 1.00143.45 C -ANISOU 1900 C GLY A 249 20125 18117 16261 -87 -253 117 C -ATOM 1901 O GLY A 249 58.734 62.029 71.259 1.00144.18 O -ANISOU 1901 O GLY A 249 20196 18359 16228 -14 -307 94 O -ATOM 1902 N ASP A 250 57.365 63.333 69.992 1.00140.13 N -ANISOU 1902 N ASP A 250 19750 17629 15865 -121 -217 32 N -ATOM 1903 CA ASP A 250 57.213 64.444 70.935 1.00141.05 C -ANISOU 1903 CA ASP A 250 19919 17799 15874 -92 -249 -99 C -ATOM 1904 C ASP A 250 56.362 64.006 72.133 1.00145.87 C -ANISOU 1904 C ASP A 250 20567 18550 16309 54 -235 -10 C -ATOM 1905 O ASP A 250 56.615 64.452 73.251 1.00147.07 O -ANISOU 1905 O ASP A 250 20733 18828 16318 156 -310 -104 O -ATOM 1906 CB ASP A 250 56.582 65.658 70.238 1.00142.41 C -ANISOU 1906 CB ASP A 250 20159 17844 16106 -137 -168 -171 C -ATOM 1907 N ARG A 251 55.362 63.125 71.895 1.00141.81 N -ANISOU 1907 N ARG A 251 20048 18019 15814 82 -139 169 N -ATOM 1908 CA ARG A 251 54.481 62.564 72.925 1.00142.43 C -ANISOU 1908 CA ARG A 251 20133 18212 15773 231 -84 324 C -ATOM 1909 C ARG A 251 55.264 61.598 73.817 1.00148.43 C -ANISOU 1909 C ARG A 251 20837 19093 16468 358 -97 401 C -ATOM 1910 O ARG A 251 55.020 61.547 75.024 1.00149.23 O -ANISOU 1910 O ARG A 251 20937 19356 16407 564 -86 465 O -ATOM 1911 CB ARG A 251 53.275 61.854 72.293 1.00140.86 C -ANISOU 1911 CB ARG A 251 19906 17935 15679 182 31 485 C -ATOM 1912 CG ARG A 251 52.213 62.809 71.765 1.00148.53 C -ANISOU 1912 CG ARG A 251 20928 18891 16614 151 77 446 C -ATOM 1913 CD ARG A 251 51.061 62.081 71.097 1.00157.48 C -ANISOU 1913 CD ARG A 251 21991 19989 17854 93 172 566 C -ATOM 1914 NE ARG A 251 50.181 61.437 72.074 1.00169.23 N -ANISOU 1914 NE ARG A 251 23440 21561 19300 192 243 773 N -ATOM 1915 CZ ARG A 251 49.128 62.019 72.640 1.00186.95 C -ANISOU 1915 CZ ARG A 251 25718 23928 21386 300 292 870 C -ATOM 1916 NH1 ARG A 251 48.802 63.268 72.328 1.00174.48 N -ANISOU 1916 NH1 ARG A 251 24238 22398 19659 319 284 761 N -ATOM 1917 NH2 ARG A 251 48.394 61.358 73.525 1.00176.79 N -ANISOU 1917 NH2 ARG A 251 24370 22717 20084 414 369 1101 N -ATOM 1918 N LEU A 252 56.226 60.859 73.220 1.00145.37 N -ANISOU 1918 N LEU A 252 20404 18651 16177 279 -111 405 N -ATOM 1919 CA LEU A 252 57.104 59.911 73.914 1.00146.44 C -ANISOU 1919 CA LEU A 252 20497 18919 16227 412 -96 483 C -ATOM 1920 C LEU A 252 58.115 60.636 74.816 1.00152.52 C -ANISOU 1920 C LEU A 252 21235 19901 16814 522 -219 304 C -ATOM 1921 O LEU A 252 58.605 60.038 75.775 1.00153.30 O -ANISOU 1921 O LEU A 252 21290 20206 16753 732 -192 361 O -ATOM 1922 CB LEU A 252 57.823 58.985 72.914 1.00145.65 C -ANISOU 1922 CB LEU A 252 20384 18705 16252 306 -82 538 C -ATOM 1923 CG LEU A 252 56.952 57.948 72.187 1.00149.82 C -ANISOU 1923 CG LEU A 252 20924 19044 16958 238 32 695 C -ATOM 1924 CD1 LEU A 252 57.539 57.590 70.841 1.00148.89 C -ANISOU 1924 CD1 LEU A 252 20814 18786 16970 115 -20 658 C -ATOM 1925 CD2 LEU A 252 56.753 56.693 73.022 1.00153.63 C -ANISOU 1925 CD2 LEU A 252 21397 19559 17415 392 185 908 C -ATOM 1926 N ASP A 253 58.413 61.924 74.514 1.00149.85 N -ANISOU 1926 N ASP A 253 20910 19519 16508 395 -339 80 N -ATOM 1927 CA ASP A 253 59.307 62.785 75.300 1.00151.64 C -ANISOU 1927 CA ASP A 253 21091 19911 16615 450 -483 -158 C -ATOM 1928 C ASP A 253 58.628 63.143 76.624 1.00157.41 C -ANISOU 1928 C ASP A 253 21852 20815 17141 697 -502 -187 C -ATOM 1929 O ASP A 253 59.265 63.065 77.676 1.00158.64 O -ANISOU 1929 O ASP A 253 21938 21229 17110 908 -575 -281 O -ATOM 1930 CB ASP A 253 59.654 64.078 74.527 1.00153.39 C -ANISOU 1930 CB ASP A 253 21323 19960 16997 223 -566 -371 C -ATOM 1931 CG ASP A 253 60.794 63.986 73.526 1.00163.85 C -ANISOU 1931 CG ASP A 253 22568 21206 18482 48 -598 -398 C -ATOM 1932 OD1 ASP A 253 61.104 62.860 73.073 1.00164.36 O -ANISOU 1932 OD1 ASP A 253 22607 21291 18551 69 -546 -222 O -ATOM 1933 OD2 ASP A 253 61.352 65.045 73.166 1.00169.03 O -ANISOU 1933 OD2 ASP A 253 23189 21764 19271 -100 -664 -579 O -ATOM 1934 N ARG A 254 57.331 63.524 76.561 1.00153.74 N -ANISOU 1934 N ARG A 254 21484 20243 16687 709 -436 -97 N -ATOM 1935 CA ARG A 254 56.503 63.884 77.713 1.00155.02 C -ANISOU 1935 CA ARG A 254 21696 20559 16645 973 -443 -67 C -ATOM 1936 C ARG A 254 56.251 62.676 78.620 1.00160.32 C -ANISOU 1936 C ARG A 254 22303 21428 17185 1270 -331 185 C -ATOM 1937 O ARG A 254 56.189 62.842 79.839 1.00161.61 O -ANISOU 1937 O ARG A 254 22448 21832 17124 1592 -373 166 O -ATOM 1938 CB ARG A 254 55.175 64.503 77.254 1.00154.28 C -ANISOU 1938 CB ARG A 254 21720 20314 16588 904 -373 17 C -ATOM 1939 N ILE A 255 56.118 61.467 78.027 1.00156.31 N -ANISOU 1939 N ILE A 255 21757 20812 16822 1189 -177 419 N -ATOM 1940 CA ILE A 255 55.903 60.207 78.752 1.00157.26 C -ANISOU 1940 CA ILE A 255 21815 21053 16883 1446 -7 697 C -ATOM 1941 C ILE A 255 57.196 59.780 79.475 1.00162.92 C -ANISOU 1941 C ILE A 255 22452 22027 17424 1659 -36 618 C -ATOM 1942 O ILE A 255 57.127 59.349 80.628 1.00164.34 O -ANISOU 1942 O ILE A 255 22577 22454 17409 2038 49 744 O -ATOM 1943 CB ILE A 255 55.284 59.103 77.834 1.00159.20 C -ANISOU 1943 CB ILE A 255 22058 21052 17381 1260 168 939 C -ATOM 1944 CG1 ILE A 255 53.829 59.471 77.450 1.00158.88 C -ANISOU 1944 CG1 ILE A 255 22053 20867 17445 1153 215 1039 C -ATOM 1945 CG2 ILE A 255 55.335 57.703 78.484 1.00161.21 C -ANISOU 1945 CG2 ILE A 255 22249 21375 17629 1494 378 1218 C -ATOM 1946 CD1 ILE A 255 53.308 58.861 76.148 1.00164.43 C -ANISOU 1946 CD1 ILE A 255 22746 21305 18424 860 288 1105 C -ATOM 1947 N GLU A 256 58.365 59.939 78.812 1.00159.06 N -ANISOU 1947 N GLU A 256 21940 21513 16983 1452 -149 420 N -ATOM 1948 CA GLU A 256 59.683 59.625 79.380 1.00160.34 C -ANISOU 1948 CA GLU A 256 22009 21955 16958 1621 -195 313 C -ATOM 1949 C GLU A 256 60.008 60.570 80.547 1.00166.77 C -ANISOU 1949 C GLU A 256 22762 23071 17531 1868 -364 50 C -ATOM 1950 O GLU A 256 60.613 60.141 81.533 1.00167.82 O -ANISOU 1950 O GLU A 256 22798 23547 17418 2212 -342 37 O -ATOM 1951 CB GLU A 256 60.776 59.701 78.304 1.00160.58 C -ANISOU 1951 CB GLU A 256 22021 21880 17113 1318 -291 177 C -ATOM 1952 N LYS A 257 59.580 61.850 80.430 1.00163.90 N -ANISOU 1952 N LYS A 257 22459 22588 17229 1721 -522 -166 N -ATOM 1953 CA LYS A 257 59.754 62.896 81.442 1.00166.05 C -ANISOU 1953 CA LYS A 257 22702 23080 17309 1922 -713 -463 C -ATOM 1954 C LYS A 257 58.853 62.635 82.653 1.00171.90 C -ANISOU 1954 C LYS A 257 23456 24043 17815 2385 -633 -283 C -ATOM 1955 O LYS A 257 59.306 62.782 83.790 1.00173.86 O -ANISOU 1955 O LYS A 257 23614 24643 17800 2757 -727 -438 O -ATOM 1956 CB LYS A 257 59.469 64.284 80.846 1.00167.97 C -ANISOU 1956 CB LYS A 257 23044 23061 17717 1618 -857 -704 C -ATOM 1957 N GLN A 258 57.584 62.234 82.404 1.00167.62 N -ANISOU 1957 N GLN A 258 23003 23317 17366 2386 -457 48 N -ATOM 1958 CA GLN A 258 56.597 61.917 83.441 1.00168.82 C -ANISOU 1958 CA GLN A 258 23158 23646 17339 2818 -340 310 C -ATOM 1959 C GLN A 258 56.951 60.627 84.201 1.00174.59 C -ANISOU 1959 C GLN A 258 23765 24632 17938 3203 -138 561 C -ATOM 1960 O GLN A 258 56.559 60.483 85.362 1.00176.11 O -ANISOU 1960 O GLN A 258 23910 25103 17902 3699 -74 701 O -ATOM 1961 CB GLN A 258 55.185 61.823 82.843 1.00168.51 C -ANISOU 1961 CB GLN A 258 23217 23334 17474 2657 -199 599 C -ATOM 1962 N LEU A 259 57.694 59.701 83.545 1.00170.46 N -ANISOU 1962 N LEU A 259 23200 24024 17544 3015 -22 633 N -ATOM 1963 CA LEU A 259 58.144 58.421 84.108 1.00171.46 C -ANISOU 1963 CA LEU A 259 23234 24358 17556 3348 213 877 C -ATOM 1964 C LEU A 259 59.173 58.612 85.231 1.00177.94 C -ANISOU 1964 C LEU A 259 23929 25662 18016 3781 113 652 C -ATOM 1965 O LEU A 259 59.209 57.808 86.165 1.00179.46 O -ANISOU 1965 O LEU A 259 24037 26144 18005 4279 321 876 O -ATOM 1966 CB LEU A 259 58.719 57.519 83.009 1.00169.94 C -ANISOU 1966 CB LEU A 259 23064 23932 17572 3010 328 969 C -ATOM 1967 N ALA A 260 60.001 59.674 85.138 1.00174.66 N -ANISOU 1967 N ALA A 260 23486 25342 17535 3606 -192 207 N -ATOM 1968 CA ALA A 260 61.016 60.012 86.138 1.00176.92 C -ANISOU 1968 CA ALA A 260 23624 26103 17495 3963 -351 -107 C -ATOM 1969 C ALA A 260 60.393 60.754 87.338 1.00182.38 C -ANISOU 1969 C ALA A 260 24298 27050 17948 4419 -472 -217 C -ATOM 1970 O ALA A 260 60.697 60.418 88.486 1.00184.23 O -ANISOU 1970 O ALA A 260 24403 27741 17856 4997 -424 -215 O -ATOM 1971 CB ALA A 260 62.118 60.850 85.504 1.00177.50 C -ANISOU 1971 CB ALA A 260 23653 26133 17657 3549 -627 -542 C -ATOM 1972 N GLN A 261 59.510 61.743 87.065 1.00177.84 N -ANISOU 1972 N GLN A 261 23859 26204 17509 4204 -615 -296 N -ATOM 1973 CA GLN A 261 58.814 62.544 88.074 1.00201.79 C -ANISOU 1973 CA GLN A 261 26924 29424 20323 4605 -751 -387 C -ATOM 1974 C GLN A 261 57.363 62.091 88.226 1.00217.51 C -ANISOU 1974 C GLN A 261 29009 31284 22352 4800 -516 104 C -ATOM 1975 O GLN A 261 57.103 60.911 88.456 1.00176.05 O -ANISOU 1975 O GLN A 261 23691 26101 17098 5046 -218 511 O -ATOM 1976 CB GLN A 261 58.867 64.035 87.710 1.00203.07 C -ANISOU 1976 CB GLN A 261 27190 29386 20583 4256 -1066 -823 C -TER 1977 GLN A 261 -HETATM 1978 NA NA A 301 54.790 54.790 20.226 0.25 85.12 NA1+ -HETATM 1979 NA NA A 302 54.790 54.790 15.299 0.25 75.33 NA1+ -HETATM 1980 NA NA A 303 54.790 54.790 12.630 0.25 64.91 NA1+ -HETATM 1981 C9 2CV A 304 71.609 49.090 20.120 1.00 65.03 C -HETATM 1982 C12 2CV A 304 72.493 49.977 19.249 1.00 60.89 C -HETATM 1983 C15 2CV A 304 72.548 49.557 17.793 1.00 58.02 C -HETATM 1984 C18 2CV A 304 73.516 50.350 16.937 1.00 56.02 C -HETATM 1985 C21 2CV A 304 73.936 49.610 15.694 1.00 56.99 C -HETATM 1986 C24 2CV A 304 74.971 50.306 14.865 1.00 59.12 C -HETATM 1987 C27 2CV A 304 74.603 50.357 13.385 1.00 65.14 C -HETATM 1988 C30 2CV A 304 75.797 50.189 12.472 1.00 73.04 C -HETATM 1989 N33 2CV A 304 75.611 50.342 11.136 1.00 77.54 N -HETATM 1990 O34 2CV A 304 76.893 49.919 12.943 1.00 75.78 O -HETATM 1991 C35 2CV A 304 74.312 50.697 10.540 1.00 74.04 C -HETATM 1992 C36 2CV A 304 76.688 50.129 10.156 1.00 85.64 C -HETATM 1993 C37 2CV A 304 77.836 51.137 10.136 1.00 92.53 C -HETATM 1994 C40 2CV A 304 78.469 51.240 8.748 1.00 95.64 C -HETATM 1995 O47 2CV A 304 78.858 50.743 11.055 1.00 94.28 O -HETATM 1996 O49 2CV A 304 79.435 52.286 8.766 1.00 97.90 O -HETATM 1997 C60 2CV A 304 73.596 49.540 9.880 1.00 74.31 C -HETATM 1998 O63 2CV A 304 72.427 49.976 9.189 1.00 74.43 O -HETATM 1999 C1 2CV A 304 71.393 49.642 21.527 1.00 71.12 C -HETATM 2000 C0 2CV A 304 70.639 48.719 22.489 1.00 73.92 C -HETATM 2001 O37 12P A 305 69.880 57.566 29.826 1.00 94.32 O -HETATM 2002 C36 12P A 305 69.957 58.545 30.860 1.00 97.70 C -HETATM 2003 C35 12P A 305 71.380 58.832 31.259 1.00100.38 C -HETATM 2004 O34 12P A 305 71.449 59.945 32.155 1.00101.47 O -HETATM 2005 C33 12P A 305 72.579 60.786 31.920 1.00102.45 C -HETATM 2006 C32 12P A 305 72.158 62.204 31.652 1.00103.92 C -HETATM 2007 O31 12P A 305 73.283 62.995 31.280 1.00105.14 O -HETATM 2008 C30 12P A 305 72.984 64.018 30.334 1.00106.12 C -HETATM 2009 C29 12P A 305 74.092 64.118 29.324 1.00107.37 C -HETATM 2010 O28 12P A 305 73.889 65.227 28.449 1.00108.16 O -HETATM 2011 C27 12P A 305 74.278 64.973 27.095 1.00106.54 C -HETATM 2012 C26 12P A 305 73.912 66.142 26.216 1.00104.19 C -HETATM 2013 O25 12P A 305 74.231 65.895 24.847 1.00101.34 O -HETATM 2014 C24 12P A 305 73.577 66.793 23.957 1.00100.30 C -HETATM 2015 C23 12P A 305 73.700 66.338 22.532 1.00101.22 C -HETATM 2016 O22 12P A 305 72.831 65.241 22.264 1.00101.91 O -HETATM 2017 C21 12P A 305 72.720 64.928 20.880 1.00100.08 C -HETATM 2018 C20 12P A 305 73.171 63.526 20.629 1.00 98.77 C -HETATM 2019 O19 12P A 305 74.572 63.437 20.841 1.00 99.46 O -HETATM 2020 C18 12P A 305 75.104 62.137 20.601 1.00 98.38 C -HETATM 2021 C17 12P A 305 76.604 62.173 20.495 1.00 95.04 C -HETATM 2022 O16 12P A 305 77.009 62.926 19.358 1.00 91.78 O -HETATM 2023 C15 12P A 305 77.890 62.216 18.501 1.00 89.75 C -HETATM 2024 C14 12P A 305 78.097 62.985 17.246 1.00 89.43 C -HETATM 2025 O13 12P A 305 78.673 62.149 16.257 1.00 91.01 O -HETATM 2026 C12 12P A 305 78.426 62.603 14.932 1.00 92.08 C -HETATM 2027 C11 12P A 305 78.338 61.446 13.986 1.00 94.06 C -HETATM 2028 O10 12P A 305 78.357 61.927 12.644 1.00 96.10 O -HETATM 2029 C9 12P A 305 77.470 61.233 11.767 1.00 93.76 C -HETATM 2030 C8 12P A 305 77.395 61.911 10.436 1.00 91.34 C -HETATM 2031 O7 12P A 305 78.694 62.004 9.862 1.00 91.82 O -HETATM 2032 C6 12P A 305 78.742 61.707 8.462 1.00 89.27 C -HETATM 2033 C5 12P A 305 79.458 60.392 8.181 1.00 82.99 C -HETATM 2034 O4 12P A 305 78.772 59.268 8.705 1.00 76.40 O -HETATM 2035 O1 MES A 306 75.196 59.801 25.492 1.00176.78 O -HETATM 2036 C2 MES A 306 73.809 59.463 25.485 1.00176.73 C -HETATM 2037 C3 MES A 306 73.559 58.145 26.179 1.00176.80 C -HETATM 2038 N4 MES A 306 74.360 57.061 25.525 1.00177.35 N -HETATM 2039 C5 MES A 306 75.806 57.452 25.464 1.00177.06 C -HETATM 2040 C6 MES A 306 75.951 58.803 24.805 1.00176.92 C -HETATM 2041 C7 MES A 306 74.177 55.754 26.243 1.00178.69 C -HETATM 2042 C8 MES A 306 74.109 54.572 25.291 1.00180.31 C -HETATM 2043 S MES A 306 74.715 53.080 26.046 1.00181.81 S -HETATM 2044 O1S MES A 306 73.704 52.065 25.803 1.00182.05 O -HETATM 2045 O2S MES A 306 75.977 52.779 25.390 1.00181.87 O -HETATM 2046 O3S MES A 306 74.879 53.374 27.462 1.00182.10 O -HETATM 2047 O HOH A 401 57.248 68.231 2.706 1.00 65.23 O -HETATM 2048 O HOH A 402 41.012 73.376 47.384 1.00 84.96 O -HETATM 2049 O HOH A 403 61.596 59.715 3.865 1.00 57.98 O -HETATM 2050 O HOH A 404 75.208 67.703 5.110 1.00 60.19 O -HETATM 2051 O HOH A 405 33.197 77.494 14.710 1.00 74.97 O -HETATM 2052 O HOH A 406 58.510 69.155 5.673 1.00 51.07 O -HETATM 2053 O HOH A 407 46.168 67.411 38.950 1.00 73.59 O -HETATM 2054 O HOH A 408 71.945 64.801 -0.346 1.00 65.04 O -HETATM 2055 O HOH A 409 59.798 64.846 4.223 1.00 52.22 O -HETATM 2056 O HOH A 410 68.080 65.303 0.349 1.00 59.85 O -HETATM 2057 O HOH A 411 52.028 68.033 48.016 1.00101.74 O -HETATM 2058 O HOH A 412 31.753 70.093 10.642 1.00 53.49 O -HETATM 2059 O HOH A 413 75.534 52.650 8.057 1.00 59.43 O -HETATM 2060 O HOH A 414 27.638 85.939 16.911 1.00110.89 O -HETATM 2061 O HOH A 415 63.924 53.718 4.473 1.00 48.13 O -HETATM 2062 O HOH A 416 65.916 67.585 1.966 1.00 56.26 O -HETATM 2063 O HOH A 417 14.537 85.592 49.287 1.00113.80 O -HETATM 2064 O HOH A 418 20.634 74.094 7.170 1.00101.11 O -HETATM 2065 O HOH A 419 81.390 62.251 10.690 1.00 69.51 O -HETATM 2066 O HOH A 420 70.673 77.346 7.774 1.00 66.63 O -HETATM 2067 O HOH A 421 70.522 53.350 5.298 1.00 49.79 O -HETATM 2068 O HOH A 422 65.835 79.051 11.808 1.00 71.42 O -HETATM 2069 O HOH A 423 70.124 48.131 9.016 1.00 42.39 O -HETATM 2070 O HOH A 424 55.666 56.486 17.976 1.00127.77 O -HETATM 2071 O HOH A 425 80.080 49.638 13.504 1.00 86.14 O -HETATM 2072 O HOH A 426 24.133 87.346 13.682 1.00119.05 O -HETATM 2073 O HOH A 427 57.370 54.177 16.640 1.00 61.61 O -HETATM 2074 O HOH A 428 68.607 75.814 4.085 1.00 80.25 O -HETATM 2075 O HOH A 429 72.006 50.010 27.229 1.00 96.73 O -HETATM 2076 O HOH A 430 75.418 71.315 6.251 1.00 60.20 O -HETATM 2077 O HOH A 431 66.187 76.520 5.033 1.00 68.45 O -HETATM 2078 O HOH A 432 70.939 73.981 3.375 1.00 77.84 O -HETATM 2079 O HOH A 433 64.724 63.538 38.270 1.00 75.57 O -HETATM 2080 O HOH A 434 72.642 49.392 27.111 1.00124.00 O -HETATM 2081 O HOH A 435 56.220 62.495 54.956 1.00 83.21 O -HETATM 2082 O HOH A 436 28.501 84.935 50.693 1.00111.36 O -HETATM 2083 O HOH A 437 76.410 58.098 -0.890 1.00 84.55 O -HETATM 2084 O HOH A 438 44.576 82.849 42.251 1.00 87.11 O -HETATM 2085 O HOH A 439 77.896 56.553 1.769 1.00 74.46 O -HETATM 2086 O HOH A 440 36.082 85.626 20.852 1.00 78.93 O -HETATM 2087 O HOH A 441 78.348 64.955 8.386 1.00 75.61 O -HETATM 2088 O HOH A 442 39.714 74.996 45.366 1.00 73.01 O -HETATM 2089 O HOH A 443 45.681 71.981 56.604 1.00 93.00 O -HETATM 2090 O HOH A 444 34.231 98.006 43.689 1.00 89.17 O -HETATM 2091 O HOH A 445 66.300 54.217 3.025 1.00 59.61 O -HETATM 2092 O HOH A 446 66.664 79.526 5.584 1.00114.04 O -HETATM 2093 O HOH A 447 30.160 69.241 6.495 1.00 88.54 O -HETATM 2094 O HOH A 448 34.921 78.967 16.757 1.00 68.56 O -HETATM 2095 O HOH A 449 59.586 66.386 40.429 1.00 81.73 O -HETATM 2096 O HOH A 450 64.423 80.153 9.723 1.00 92.88 O -HETATM 2097 O HOH A 451 57.881 57.891 6.269 1.00 67.58 O -HETATM 2098 O HOH A 452 36.774 83.752 23.053 1.00 98.04 O -HETATM 2099 O HOH A 453 45.435 84.436 34.476 1.00 96.38 O -HETATM 2100 O HOH A 454 31.149 97.224 44.993 1.00106.75 O -HETATM 2101 O HOH A 455 28.791 67.820 8.426 1.00 98.02 O -HETATM 2102 O HOH A 456 64.852 74.390 22.032 1.00 72.32 O -HETATM 2103 O HOH A 457 57.853 58.965 23.429 1.00 73.79 O -HETATM 2104 O HOH A 458 44.768 80.055 41.531 1.00 96.27 O -HETATM 2105 O HOH A 459 73.250 52.418 5.745 1.00 76.50 O -HETATM 2106 O HOH A 460 69.432 81.603 17.809 1.00 75.69 O -HETATM 2107 O HOH A 461 62.563 77.035 33.382 1.00 98.26 O -HETATM 2108 O HOH A 462 31.852 94.624 47.616 1.00 87.19 O -HETATM 2109 O HOH A 463 23.877 70.849 34.089 1.00 92.60 O -HETATM 2110 O HOH A 464 63.985 53.981 23.653 1.00 53.56 O -HETATM 2111 O HOH A 465 58.208 75.855 34.360 1.00 77.28 O -HETATM 2112 O HOH A 466 64.948 76.460 36.402 1.00 88.17 O -HETATM 2113 O HOH A 467 73.485 69.243 28.405 1.00 80.36 O -HETATM 2114 O HOH A 468 81.775 54.853 14.806 1.00 95.73 O -HETATM 2115 O HOH A 469 79.127 48.705 16.202 1.00 95.36 O -HETATM 2116 O HOH A 470 29.416 68.786 11.020 1.00 99.22 O -HETATM 2117 O HOH A 471 20.282 72.964 34.038 1.00 97.73 O -HETATM 2118 O HOH A 472 28.479 68.755 13.574 1.00 78.03 O -HETATM 2119 O HOH A 473 29.390 70.082 23.197 1.00 82.59 O -HETATM 2120 O HOH A 474 44.558 79.985 35.985 1.00 92.63 O -HETATM 2121 O HOH A 475 62.047 76.044 30.887 1.00 76.20 O -HETATM 2122 O HOH A 476 75.348 53.589 21.126 1.00 87.16 O -HETATM 2123 O HOH A 477 31.219 71.508 24.646 1.00 83.24 O -HETATM 2124 O HOH A 478 75.292 58.796 30.007 1.00 97.31 O -HETATM 2125 O HOH A 479 78.119 58.568 22.219 1.00 84.36 O -HETATM 2126 O HOH A 480 63.624 65.836 39.212 1.00 91.18 O -HETATM 2127 O HOH A 481 57.478 73.507 32.428 1.00 74.31 O -HETATM 2128 O HOH A 482 56.555 61.513 23.418 1.00 65.57 O -HETATM 2129 O HOH A 483 65.126 79.490 16.878 1.00 82.04 O -HETATM 2130 O HOH A 484 80.589 56.611 2.535 1.00 84.53 O -HETATM 2131 O HOH A 485 68.644 77.284 25.226 1.00 94.20 O -HETATM 2132 O HOH A 486 22.415 84.458 34.685 1.00 80.79 O -HETATM 2133 O HOH A 487 76.127 50.058 5.453 1.00 87.36 O -HETATM 2134 O HOH A 488 77.619 55.115 20.621 1.00 81.55 O -HETATM 2135 O HOH A 489 51.471 57.677 43.355 1.00 96.63 O -HETATM 2136 O HOH A 490 80.728 58.064 -1.129 1.00100.42 O -HETATM 2137 O HOH A 491 29.087 90.688 12.855 1.00 95.82 O -HETATM 2138 O HOH A 492 77.487 48.956 19.579 1.00 74.35 O -HETATM 2139 O HOH A 493 81.012 54.336 18.211 1.00 84.76 O -HETATM 2140 O HOH A 494 30.821 102.566 41.137 1.00 99.69 O -HETATM 2141 O HOH A 495 38.160 103.630 21.288 1.00109.22 O -HETATM 2142 O HOH A 496 61.148 73.297 79.547 1.00108.66 O -HETATM 2143 O HOH A 497 28.284 103.834 30.124 1.00107.90 O -HETATM 2144 O HOH A 498 88.358 54.904 19.393 1.00100.96 O -HETATM 2145 O HOH A 499 37.479 107.237 21.517 1.00111.51 O -HETATM 2146 O HOH A 500 27.064 104.573 26.672 1.00122.60 O -HETATM 2147 O HOH A 501 40.103 108.080 12.306 1.00113.43 O -HETATM 2148 O HOH A 502 50.737 95.225 27.113 1.00 98.83 O -HETATM 2149 O HOH A 503 57.423 86.252 28.876 1.00100.85 O -HETATM 2150 O HOH A 504 38.154 111.366 53.453 1.00110.67 O -HETATM 2151 O HOH A 505 54.261 90.562 24.030 1.00129.20 O -HETATM 2152 O HOH A 506 56.180 88.572 24.875 1.00112.33 O -HETATM 2153 O HOH A 507 20.658 106.257 26.890 1.00129.67 O -HETATM 2154 O HOH A 508 17.806 106.804 27.964 1.00116.73 O -HETATM 2155 O HOH A 509 54.298 105.870 34.959 1.00109.34 O -HETATM 2156 O HOH A 510 39.896 116.954 50.843 1.00108.78 O -HETATM 2157 O HOH A 511 37.342 117.123 53.426 1.00117.83 O -CONECT 1978 2070 -CONECT 1979 2073 -CONECT 1981 1982 1999 -CONECT 1982 1981 1983 -CONECT 1983 1982 1984 -CONECT 1984 1983 1985 -CONECT 1985 1984 1986 -CONECT 1986 1985 1987 -CONECT 1987 1986 1988 -CONECT 1988 1987 1989 1990 -CONECT 1989 1988 1991 1992 -CONECT 1990 1988 -CONECT 1991 1989 1997 -CONECT 1992 1989 1993 -CONECT 1993 1992 1994 1995 -CONECT 1994 1993 1996 -CONECT 1995 1993 -CONECT 1996 1994 -CONECT 1997 1991 1998 -CONECT 1998 1997 -CONECT 1999 1981 2000 -CONECT 2000 1999 -CONECT 2001 2002 -CONECT 2002 2001 2003 -CONECT 2003 2002 2004 -CONECT 2004 2003 2005 -CONECT 2005 2004 2006 -CONECT 2006 2005 2007 -CONECT 2007 2006 2008 -CONECT 2008 2007 2009 -CONECT 2009 2008 2010 -CONECT 2010 2009 2011 -CONECT 2011 2010 2012 -CONECT 2012 2011 2013 -CONECT 2013 2012 2014 -CONECT 2014 2013 2015 -CONECT 2015 2014 2016 -CONECT 2016 2015 2017 -CONECT 2017 2016 2018 -CONECT 2018 2017 2019 -CONECT 2019 2018 2020 -CONECT 2020 2019 2021 -CONECT 2021 2020 2022 -CONECT 2022 2021 2023 -CONECT 2023 2022 2024 -CONECT 2024 2023 2025 -CONECT 2025 2024 2026 -CONECT 2026 2025 2027 -CONECT 2027 2026 2028 -CONECT 2028 2027 2029 -CONECT 2029 2028 2030 -CONECT 2030 2029 2031 -CONECT 2031 2030 2032 -CONECT 2032 2031 2033 -CONECT 2033 2032 2034 -CONECT 2034 2033 -CONECT 2035 2036 2040 -CONECT 2036 2035 2037 -CONECT 2037 2036 2038 -CONECT 2038 2037 2039 2041 -CONECT 2039 2038 2040 -CONECT 2040 2035 2039 -CONECT 2041 2038 2042 -CONECT 2042 2041 2043 -CONECT 2043 2042 2044 2045 2046 -CONECT 2044 2043 -CONECT 2045 2043 -CONECT 2046 2043 -CONECT 2070 1978 -CONECT 2073 1979 -MASTER 521 0 6 15 0 0 9 6 2156 1 70 22 -END diff --git a/pdb2sql/StructureSimilarity.py b/pdb2sql/StructureSimilarity.py index aa5a230..b878b6b 100644 --- a/pdb2sql/StructureSimilarity.py +++ b/pdb2sql/StructureSimilarity.py @@ -51,6 +51,7 @@ def __init__(self,decoy,ref,verbose=False): self.decoy = decoy self.ref = ref self.verbose = verbose + self.origin = [0., 0., 0.] ################################################################################################ @@ -155,7 +156,7 @@ def compute_lrmsd_fast(self,lzone=None,method='svd',check=True): U = self.get_rotation_matrix(xyz_decoy_long,xyz_ref_long,method=method) # rotate the entire fragment - xyz_decoy_short = transform.rotation_matrix(xyz_decoy_short,U,center=False) + xyz_decoy_short = transform.rotate(xyz_decoy_short,U, center=self.origin) # compute the RMSD return self.get_rmsd(xyz_decoy_short,xyz_ref_short) @@ -293,7 +294,7 @@ def compute_irmsd_fast(self,izone=None,method='svd',cutoff=10,check=True): U = self.get_rotation_matrix(xyz_contact_decoy,xyz_contact_ref,method=method) # rotate the entire fragment - xyz_contact_decoy = transform.rotation_matrix(xyz_contact_decoy,U,center=False) + xyz_contact_decoy = transform.rotate(xyz_contact_decoy,U,center=self.origin) # return the RMSD return self.get_rmsd(xyz_contact_decoy,xyz_contact_ref) @@ -551,7 +552,7 @@ def compute_lrmsd_pdb2sql(self,exportpath=None,method='svd'): U = self.get_rotation_matrix(xyz_decoy_long,xyz_ref_long,method=method) # rotate the entire fragment - xyz_decoy_short = transform.rotation_matrix(xyz_decoy_short,U,center=False) + xyz_decoy_short = transform.rotate(xyz_decoy_short, U, center=self.origin) # compute the RMSD @@ -569,7 +570,7 @@ def compute_lrmsd_pdb2sql(self,exportpath=None,method='svd'): xyz_decoy += tr_decoy # rotate decoy - xyz_decoy = transform.rotation_matrix(xyz_decoy,U,center=False) + xyz_decoy = transform.rotate(xyz_decoy, U, center=self.origin) # update the sql database sql_decoy.update_column('x',xyz_decoy[:,0]) @@ -726,7 +727,7 @@ def compute_irmsd_pdb2sql(self,cutoff=10,method='svd',izone=None,exportpath=None U = self.get_rotation_matrix(xyz_contact_decoy,xyz_contact_ref,method=method) # rotate the entire fragment - xyz_contact_decoy = transform.rotation_matrix(xyz_contact_decoy,U,center=False) + xyz_contact_decoy = transform.rotate(xyz_contact_decoy, U, center=self.origin) # compute the RMSD irmsd = self.get_rmsd(xyz_contact_decoy,xyz_contact_ref) diff --git a/pdb2sql/__version__.py b/pdb2sql/__version__.py index 7fd229a..fc79d63 100644 --- a/pdb2sql/__version__.py +++ b/pdb2sql/__version__.py @@ -1 +1 @@ -__version__ = '0.2.0' +__version__ = '0.2.1' diff --git a/pdb2sql/transform.py b/pdb2sql/transform.py index 0fec677..4b161e9 100644 --- a/pdb2sql/transform.py +++ b/pdb2sql/transform.py @@ -8,73 +8,51 @@ definition of the data set. ''' -def get_rot_axis_angle(seed=None): - """Get the rotation angle/axis. - - Args: - seed(int): random seed for numpy - - Returns: - list(float): axis of rotation - float: angle of rotation - """ - # define the axis - # uniform distribution on a sphere - # http://mathworld.wolfram.com/SpherePointPicking.html - if seed != None: - np.random.seed(seed) - - u1, u2 = np.random.rand(), np.random.rand() - teta, phi = np.arccos(2 * u1 - 1), 2 * np.pi * u2 - axis = [np.sin(teta) * np.cos(phi), - np.sin(teta) * np.sin(phi), - np.cos(teta)] - - # and the rotation angle - angle = -np.pi + np.pi * np.random.rand() - - return axis, angle - - +######################################################################## +# Translation +######################################################################## def translation(db, vect, **kwargs): xyz = _get_xyz(db, **kwargs) xyz += vect _update(db, xyz, **kwargs) - +######################################################################## +# Rotation using axis–angle presentation +# see https://en.wikipedia.org/wiki/Rotation_matrix#Rotation_matrix_from_axis_and_angle +######################################################################## def rot_axis(db, axis, angle, **kwargs): xyz = _get_xyz(db, **kwargs) xyz = rot_xyz_around_axis(xyz, axis, angle) _update(db, xyz, **kwargs) - -def rot_euler(db, alpha, beta, gamma, **kwargs): - """Rotate molecule from Euler rotation axis. +def get_rot_axis_angle(seed=None): + """Get the rotation angle and axis. Args: - alpha (float): angle of rotation around the x axis - beta (float): angle of rotation around the y axis - gamma (float): angle of rotation around the z axis - **kwargs: keyword argument to select the atoms. - See pdb2sql.get() - """ - xyz = _get_xyz(db, **kwargs) - xyz = _rotation_euler(xyz, alpha, beta, gamma) - _update(db, xyz, **kwargs) + seed(int): random seed for numpy + Returns: + list(float): axis of rotation + float: angle of rotation + """ + if seed is not None: + np.random.seed(seed) -def rot_mat(db, mat, **kwargs): - """Rotate molecule from a rotation matrix. + # define the rotation axis + # uniform distribution on a sphere + # eq1,2 in http://mathworld.wolfram.com/SpherePointPicking.html + u1, u2 = np.random.rand(), np.random.rand() + theta = 2 * np.pi * u1 # [0, 2*pi) + phi = np.arccos(2 * u2 - 1) # [0, pi] + # eq19 in http://mathworld.wolfram.com/SphericalCoordinates.html + axis = [np.sin(phi) * np.cos(theta), + np.sin(phi) * np.sin(theta), + np.cos(phi)] - Args: - mat (np.array): 3x3 rotation matrix - **kwargs: keyword argument to select the atoms. - See pdb2sql.get() - """ - xyz = _get_xyz(db, **kwargs) - xyz = _rotation_matrix(xyz, mat) - _update(db, xyz, **kwargs) + # define the rotation angle + angle = 2 * np.pi * np.random.rand() + return axis, angle def rot_xyz_around_axis(xyz, axis, angle, center=None): """Get the rotated xyz. @@ -89,17 +67,11 @@ def rot_xyz_around_axis(xyz, axis, angle, center=None): Returns: np.array: rotated xyz coordinates """ - - # check center - if center is None: - center = np.mean(xyz, 0) - # get the data ct, st = np.cos(angle), np.sin(angle) ux, uy, uz = axis # definition of the rotation matrix - # see https://en.wikipedia.org/wiki/Rotation_matrix rot_mat = np.array([[ct + ux**2 * (1 - ct), ux * uy * (1 - ct) - uz * st, ux * uz * (1 - ct) + uy * st], @@ -111,51 +83,91 @@ def rot_xyz_around_axis(xyz, axis, angle, center=None): ct + uz**2 * (1 - ct)]]) # apply the rotation - return np.dot(rot_mat, (xyz - center).T).T + center + return rotate(xyz, rot_mat, center) +######################################################################## +# Rotation using Euler anlges +# see https://en.wikipedia.org/wiki/Rotation_matrix#General_rotations +######################################################################## -def _rotation_euler(xyz, alpha, beta, gamma): +def rot_euler(db, alpha, beta, gamma, **kwargs): + """Rotate molecule from Euler rotation axis. + + Args: + alpha (float): angle of rotation around the x axis + beta (float): angle of rotation around the y axis + gamma (float): angle of rotation around the z axis + **kwargs: keyword argument to select the atoms. + See pdb2sql.get() + """ + xyz = _get_xyz(db, **kwargs) + xyz = rotation_euler(xyz, alpha, beta, gamma) + _update(db, xyz, **kwargs) + +def rotation_euler(xyz, alpha, beta, gamma, center=None): # precomte the trig ca, sa = np.cos(alpha), np.sin(alpha) cb, sb = np.cos(beta), np.sin(beta) cg, sg = np.cos(gamma), np.sin(gamma) - # get the center of the molecule - xyz0 = np.mean(xyz, 0) - # rotation matrices rx = np.array([[1, 0, 0], [0, ca, -sa], [0, sa, ca]]) ry = np.array([[cb, 0, sb], [0, 1, 0], [-sb, 0, cb]]) - rz = np.array([[cg, -sg, 0], [sg, cs, 0], [0, 0, 1]]) + rz = np.array([[cg, -sg, 0], [sg, cg, 0], [0, 0, 1]]) - rot_mat = np.dot(rz, np.dot(ry, rz)) + # get rotation matrix + rot_mat = np.dot(rz, np.dot(ry, rx)) # apply the rotation - return np.dot(rot_mat, (xyz - xyz0).T).T + xyz0 + return rotate(xyz, rot_mat, center) +######################################################################## +# Rotation using provided rotation matrix +######################################################################## -def rotation_matrix(xyz, rot_mat, center=True): - if center: - xyz0 = np.mean(xyz) - return np.dot(rot_mat, (xyz - xyz0).T).T + xyz0 - else: - return np.dot(rot_mat, (xyz).T).T +def rot_mat(db, mat, **kwargs): + """Rotate molecule from a rotation matrix. + Args: + mat (np.array): 3x3 rotation matrix + **kwargs: keyword argument to select the atoms. + See pdb2sql.get() + """ + xyz = _get_xyz(db, **kwargs) + xyz = rotate(xyz, mat) + _update(db, xyz, **kwargs) -def _get_xyz(db, **kwargs): - return np.array(db.get('x,y,z', **kwargs)) +def rotate(xyz, rot_mat, center=None): + """[summary] + Args: + xyz(np.ndarray): x,y,z coordinates + rot_mat(np.ndarray): rotation matrix + center (list or np.ndarray, optional): rotation center. + Defaults to None, i.e. using molecule center as rotation + center. -def _update(db, xyz, **kwargs): - db.update('x,y,z', xyz, **kwargs) + Raises: + TypeError: Rotation center must be list or 1D np.ndarray. + Returns: + np.ndarray: x,y,z coordinates after rotation + """ + # the default rotation center is the center of molecule itself. + if center is None: + center = np.mean(xyz, 0) -if __name__ == "__main__": + if not isinstance(center, (list, np.ndarray)): + raise TypeError("Rotation center must be list or 1D np.ndarray") - t0 = time() - db = pdb2sql('5hvd.pdb') - print('SQL %f' % (time() - t0)) + return np.dot(rot_mat, (xyz - center).T).T + center - tr = np.array([1, 2, 3]) - translation(db, tr, chainID='A') +######################################################################## +# helper functions +######################################################################## +def _get_xyz(db, **kwargs): + return np.array(db.get('x,y,z', **kwargs)) + +def _update(db, xyz, **kwargs): + db.update('x,y,z', xyz, **kwargs) \ No newline at end of file diff --git a/test/pdb/dummy_transform.pdb b/test/pdb/dummy_transform.pdb new file mode 100644 index 0000000..613cd35 --- /dev/null +++ b/test/pdb/dummy_transform.pdb @@ -0,0 +1,6 @@ +ATOM 1 N THR A 1 1.000 0.000 0.000 1.00 0.69 N +ATOM 2 CA THR A 1 -1.000 0.000 0.000 1.00 0.50 C +ATOM 3 C THR A 1 0.000 1.000 0.000 1.00 0.45 C +ATOM 4 O THR A 1 0.000 -1.000 0.000 1.00 0.69 O +ATOM 5 CB THR A 1 0.000 0.000 1.000 1.00 0.50 C +ATOM 6 H1 THR A 1 0.000 0.000 -1.000 1.00 0.45 H diff --git a/test/test_transform.py b/test/test_transform.py new file mode 100644 index 0000000..83fb97a --- /dev/null +++ b/test/test_transform.py @@ -0,0 +1,174 @@ +import unittest +import numpy as np +from pdb2sql import pdb2sql +from pdb2sql import transform + +class TestTools(unittest.TestCase): + + def setUp(self): + self.db = pdb2sql('./pdb/dummy_transform.pdb') + self.xyz = self.db.get('x,y,z') + + def tearDown(self): + self.db.close() + + def test_get_xyz(self): + """Verfify getting xyz from sql""" + + result = transform._get_xyz(self.db) + target = np.array([[1., 0., 0.], [-1., 0., 0.], + [ 0., 1., 0.], [ 0., -1., 0.], + [ 0., 0., 1.], [ 0., 0., -1.]]) + np.testing.assert_equal(result, target) + + def test_translation(self): + """Verify sql translation""" + trans_vec = np.array([1,1,1]) + target = np.array([[2., 1., 1.], [ 0., 1., 1.], + [ 1., 2., 1.], [ 1., 0., 1.], + [ 1., 1., 2.], [ 1., 1., 0.]]) + transform.translation(self.db, trans_vec) + result = self.db.get('x,y,z') + np.testing.assert_almost_equal(result, target) + + def test_rot_axis(self): + """Verify sql rotation using axis and angle""" + # rotate pi around x axis + angle = np.pi + axis = (1., 0., 0.) + target = np.array([[1., 0., 0.], [-1., 0., 0.], + [ 0., -1., 0.], [ 0., 1., 0.], + [ 0., 0., -1.], [ 0., 0., 1.]]) + transform.rot_axis(self.db, axis, angle) + result = self.db.get('x,y,z') + np.testing.assert_almost_equal(result, target) + + def test_rot_xyz_around_axis(self): + """Verify xyz values rot ation using axis and angle""" + # rotate pi around x, y and z axis + angle = np.pi + axes_xyz = [(1., 0., 0.), + (0., 1., 0.), + (0., 0., 1.)] + targets = [np.array([[1., 0., 0.], [-1., 0., 0.], + [ 0., -1., 0.], [ 0., 1., 0.], + [ 0., 0., -1.], [ 0., 0., 1.]]), + np.array([[-1., 0., 0.], [ 1., 0., 0.], + [ 0., 1., 0.], [ 0., -1., 0.], + [ 0., 0., -1.], [ 0., 0., 1.]]), + np.array([[-1., 0., 0.], [ 1., 0., 0.], + [ 0., -1., 0.], [ 0., 1., 0.], + [ 0., 0., 1.], [ 0., 0., -1.]])] + for axis, target in zip(axes_xyz, targets): + with self.subTest(axis=axis, target=target): + xyz_rot = transform.rot_xyz_around_axis(self.xyz, axis, angle) + np.testing.assert_almost_equal(xyz_rot, target) + + def test_get_rot_axis_angle(self): + """Verify generation of random axis and angle""" + # number of repeats + n = 1000 + for i in range(n): + with self.subTest(i=i): + axis, angle = transform.get_rot_axis_angle() + # axis verctor must be unit vector + result = axis[0]**2 + axis[1]**2 + axis[2]**2 + target = 1. + np.testing.assert_almost_equal(result, target) + # angle in the range [0, 2π） + self.assertTrue(0. <= angle < 2 * np.pi) + + def test_get_rot_axis_angle_seed(self): + """Verify specific random seed""" + seed = 2019 + axis1, angle1 = transform.get_rot_axis_angle(seed) + axis2, angle2 = transform.get_rot_axis_angle(seed) + self.assertEqual(axis1, axis2) + self.assertEqual(angle1, angle2) + + def test_rot_euler(self): + """Verify sql rotation using Euler angles""" + # rotate pi around z axis + alpha, beta, gamma = 0, 0, np.pi + target = np.array([[-1., 0., 0.], [ 1., 0., 0.], + [ 0., -1., 0.], [ 0., 1., 0.], + [ 0., 0., 1.], [ 0., 0., -1.]]) + transform.rot_euler(self.db, alpha, beta, gamma) + result = self.db.get('x,y,z') + np.testing.assert_almost_equal(result, target) + + def test_rotation_euler(self): + """Verify xyz values rotation using Euler angles""" + alpha, beta, gamma = 0, 0, np.pi + # rotate pi around x, y and z axis + angles = [(np.pi, 0., 0.), + (0., np.pi, 0.), + (0., 0., np.pi)] + targets = [np.array([[1., 0., 0.], [-1., 0., 0.], + [ 0., -1., 0.], [ 0., 1., 0.], + [ 0., 0., -1.], [ 0., 0., 1.]]), + np.array([[-1., 0., 0.], [ 1., 0., 0.], + [ 0., 1., 0.], [ 0., -1., 0.], + [ 0., 0., -1.], [ 0., 0., 1.]]), + np.array([[-1., 0., 0.], [ 1., 0., 0.], + [ 0., -1., 0.], [ 0., 1., 0.], + [ 0., 0., 1.], [ 0., 0., -1.]])] + for angle, target in zip(angles, targets): + with self.subTest(angle=angle, target=target): + result = transform.rotation_euler( + self.xyz, angle[0], angle[1], angle[2]) + np.testing.assert_almost_equal(result, target) + + def test_rot_mat(self): + """Verify sql roation using rotation matrix""" + # rotate pi around z-axis + theta = np.pi + cosa = np.cos(theta) + sina = np.sin(theta) + rot_mat = np.array([[cosa, -sina, 0], + [sina, cosa, 0], + [0, 0, 1]]) + target = np.array([[-1., 0., 0.], [ 1., 0., 0.], + [ 0., -1., 0.], [ 0., 1., 0.], + [ 0., 0., 1.], [ 0., 0., -1.]]) + transform.rot_mat(self.db, rot_mat) + result = self.db.get('x,y,z') + np.testing.assert_almost_equal(result, target) + + def test_rotation_matrix(self): + """Verify xyz values roation using rotation matrix""" + theta = np.pi + cosa = np.cos(theta) + sina = np.sin(theta) + # rotate pi around x, y and z axis + rot_mats = [np.array([[1, 0, 0], [0, cosa, -sina], [0, sina, cosa]]), + np.array([[cosa, 0, sina], [0, 1, 0], [-sina, 0, cosa]]), + np.array([[cosa, -sina, 0], [sina, cosa, 0], [0, 0, 1]])] + targets = [np.array([[1., 0., 0.], [-1., 0., 0.], + [ 0., -1., 0.], [ 0., 1., 0.], + [ 0., 0., -1.], [ 0., 0., 1.]]), + np.array([[-1., 0., 0.], [ 1., 0., 0.], + [ 0., 1., 0.], [ 0., -1., 0.], + [ 0., 0., -1.], [ 0., 0., 1.]]), + np.array([[-1., 0., 0.], [ 1., 0., 0.], + [ 0., -1., 0.], [ 0., 1., 0.], + [0., 0., 1.], [0., 0., - 1.]])] + for mat, target in zip(rot_mats, targets): + with self.subTest(mat=mat, target=target): + result = transform.rotate(self.xyz, mat) + np.testing.assert_almost_equal(result, target) + + def test_rotation_matrix_center(self): + """Verify specific rotation center""" + # rotate pi around z-axis with rotation center [1,1,1,] + xyz = np.array([0., 0., 0.]) + rot_mat = np.array([[cosa, -sina, 0], [sina, cosa, 0], [0, 0, 1]]) + centers = [np.array([1., 1., 1.]), [1., 1., 1.]] + for center in centers: + with self.subTest(center=center): + result = transform.rotate(xyz, rot_mat) + target = np.array([2., 2., 0.]) + np.testing.assert_almost_equal(result, target) + +if __name__ == "__main__": + unittest.main() \ No newline at end of file