CNRS Nantes University UFIP UFIP
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***  Ct1A  ***

elNémo ID: 19081200483419248

Job options:

ID        	=	 19081200483419248
JOBID     	=	 Ct1A
USERID    	=	 valcarcel
PRIVAT    	=	 0

NMODES    	=	 5
DQMIN     	=	 -100
DQMAX     	=	 100
DQSTEP    	=	 20
DOGRAPHS  	=	 on

DOPROJMODS	=	 0
DORMSD    	=	 0

NRBL      	=	 0
CUTOFF    	=	 0
CAONLY    	=	 0


Input data for this run:

HEADER Ct1A

HEADER    TRANSFERASE                             27-FEB-14   4CRJ              
TITLE     STAPHYLOCOCCUS AUREUS 7,8-DIHYDRO-6-HYDROXYMETHYLPTERIN-              
TITLE    2 PYROPHOSPHOKINASE IN COMPLEX WITH AMPCPP AND AN INHIBITOR            
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: 7,8-DIHYDRO-6-HYDROXYMETHYLPTERIN-PYROPHOSPHOKINASE        
COMPND   3  (HPPK);                                                             
COMPND   4 CHAIN: A;                                                            
COMPND   5 EC: 2.7.6.3;                                                         
COMPND   6 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS;                          
SOURCE   3 ORGANISM_TAXID: 1280;                                                
SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE   5 EXPRESSION_SYSTEM_TAXID: 469008;                                     
SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
SOURCE   7 EXPRESSION_SYSTEM_PLASMID: PET                                       
KEYWDS    TRANSFERASE, FOLATE, STRUCTURE-BASED DRUG DESIGN                      
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    M.L.DENNIS,J.D.SWARBRICK,T.S.PEAT                                     
REVDAT   2   28-DEC-16 4CRJ    1       HETNAM HETATM CONECT                     
REVDAT   1   28-JAN-15 4CRJ    0                                                
JRNL        AUTH   M.L.DENNIS,S.CHHABRA,Z.WANG,A.DEBONO,O.DOLEZAL,J.NEWMAN,     
JRNL        AUTH 2 N.P.PITCHER,R.RAHMANI,B.CLEARY,N.BARLOW,M.HATTARKI,B.GRAHAM, 
JRNL        AUTH 3 T.S.PEAT,J.B.BAELL,J.D.SWARBRICK                             
JRNL        TITL   STRUCTURE-BASED DESIGN AND DEVELOPMENT OF FUNCTIONALIZED     
JRNL        TITL 2 MERCAPTOGUANINE DERIVATIVES AS INHIBITORS OF THE FOLATE      
JRNL        TITL 3 BIOSYNTHESIS PATHWAY ENZYME 6-HYDROXYMETHYL-7,8-             
JRNL        TITL 4 DIHYDROPTERIN PYROPHOSPHOKINASE FROM STAPHYLOCOCCUS AUREUS.  
JRNL        REF    J.MED.CHEM.                   V.  57  9612 2014              
JRNL        REFN                   ISSN 0022-2623                               
JRNL        PMID   25357262                                                     
JRNL        DOI    10.1021/JM501417F                                            
REMARK   2                                                                      
REMARK   2 RESOLUTION.    2.00 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : REFMAC 5.7.0029                                      
REMARK   3   AUTHORS     : MURSHUDOV,SKUBAK,LEBEDEV,PANNU,                      
REMARK   3                 STEINER,NICHOLLS,WINN,LONG,VAGIN                     
REMARK   3                                                                      
REMARK   3    REFINEMENT TARGET : MAXIMUM LIKELIHOOD                            
REMARK   3                                                                      
REMARK   3  DATA USED IN REFINEMENT.                                            
REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) : 2.00                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 42.17                          
REMARK   3   DATA CUTOFF            (SIGMA(F)) : NONE                           
REMARK   3   COMPLETENESS FOR RANGE        (%) : 99.61                          
REMARK   3   NUMBER OF REFLECTIONS             : 13074                          
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) : 0.16447                         
REMARK   3   R VALUE            (WORKING SET) : 0.16269                         
REMARK   3   FREE R VALUE                     : 0.19961                         
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : 5.0                             
REMARK   3   FREE R VALUE TEST SET COUNT      : 685                             
REMARK   3                                                                      
REMARK   3  FIT IN THE HIGHEST RESOLUTION BIN.                                  
REMARK   3   TOTAL NUMBER OF BINS USED           : 20                           
REMARK   3   BIN RESOLUTION RANGE HIGH       (A) : 1.999                        
REMARK   3   BIN RESOLUTION RANGE LOW        (A) : 2.051                        
REMARK   3   REFLECTION IN BIN     (WORKING SET) : 929                          
REMARK   3   BIN COMPLETENESS (WORKING+TEST) (%) : 96.05                        
REMARK   3   BIN R VALUE           (WORKING SET) : 0.239                        
REMARK   3   BIN FREE R VALUE SET COUNT          : 43                           
REMARK   3   BIN FREE R VALUE                    : 0.238                        
REMARK   3                                                                      
REMARK   3  NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.                    
REMARK   3   PROTEIN ATOMS            : 1291                                    
REMARK   3   NUCLEIC ACID ATOMS       : 0                                       
REMARK   3   HETEROGEN ATOMS          : 60                                      
REMARK   3   SOLVENT ATOMS            : 83                                      
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : NULL                           
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : 27.368                         
REMARK   3   OVERALL ANISOTROPIC B VALUE.                                       
REMARK   3    B11 (A**2) : 0.89                                                 
REMARK   3    B22 (A**2) : 0.89                                                 
REMARK   3    B33 (A**2) : -2.89                                                
REMARK   3    B12 (A**2) : 0.89                                                 
REMARK   3    B13 (A**2) : 0.00                                                 
REMARK   3    B23 (A**2) : 0.00                                                 
REMARK   3                                                                      
REMARK   3  ESTIMATED OVERALL COORDINATE ERROR.                                 
REMARK   3   ESU BASED ON R VALUE                            (A): 0.146         
REMARK   3   ESU BASED ON FREE R VALUE                       (A): 0.135         
REMARK   3   ESU BASED ON MAXIMUM LIKELIHOOD                 (A): 0.087         
REMARK   3   ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 3.080         
REMARK   3                                                                      
REMARK   3  CORRELATION COEFFICIENTS.                                           
REMARK   3   CORRELATION COEFFICIENT FO-FC      : 0.963                         
REMARK   3   CORRELATION COEFFICIENT FO-FC FREE : 0.945                         
REMARK   3                                                                      
REMARK   3  RMS DEVIATIONS FROM IDEAL VALUES        COUNT    RMS    WEIGHT      
REMARK   3   BOND LENGTHS REFINED ATOMS        (A):  1376 ; 0.006 ; 0.019       
REMARK   3   BOND LENGTHS OTHERS               (A):  1315 ; 0.001 ; 0.020       
REMARK   3   BOND ANGLES REFINED ATOMS   (DEGREES):  1878 ; 1.362 ; 2.043       
REMARK   3   BOND ANGLES OTHERS          (DEGREES):  3034 ; 0.769 ; 3.000       
REMARK   3   TORSION ANGLES, PERIOD 1    (DEGREES):   162 ; 6.344 ; 5.000       
REMARK   3   TORSION ANGLES, PERIOD 2    (DEGREES):    61 ;34.750 ;24.918       
REMARK   3   TORSION ANGLES, PERIOD 3    (DEGREES):   244 ;12.906 ;15.000       
REMARK   3   TORSION ANGLES, PERIOD 4    (DEGREES):     9 ;14.001 ;15.000       
REMARK   3   CHIRAL-CENTER RESTRAINTS       (A**3):   212 ; 0.070 ; 0.200       
REMARK   3   GENERAL PLANES REFINED ATOMS      (A):  1549 ; 0.005 ; 0.021       
REMARK   3   GENERAL PLANES OTHERS             (A):   289 ; 0.001 ; 0.020       
REMARK   3   NON-BONDED CONTACTS REFINED ATOMS (A):  NULL ;  NULL ;  NULL       
REMARK   3   NON-BONDED CONTACTS OTHERS        (A):  NULL ;  NULL ;  NULL       
REMARK   3   NON-BONDED TORSION REFINED ATOMS  (A):  NULL ;  NULL ;  NULL       
REMARK   3   NON-BONDED TORSION OTHERS         (A):  NULL ;  NULL ;  NULL       
REMARK   3   H-BOND (X...Y) REFINED ATOMS      (A):  NULL ;  NULL ;  NULL       
REMARK   3   H-BOND (X...Y) OTHERS             (A):  NULL ;  NULL ;  NULL       
REMARK   3   POTENTIAL METAL-ION REFINED ATOMS (A):  NULL ;  NULL ;  NULL       
REMARK   3   POTENTIAL METAL-ION OTHERS        (A):  NULL ;  NULL ;  NULL       
REMARK   3   SYMMETRY VDW REFINED ATOMS        (A):  NULL ;  NULL ;  NULL       
REMARK   3   SYMMETRY VDW OTHERS               (A):  NULL ;  NULL ;  NULL       
REMARK   3   SYMMETRY H-BOND REFINED ATOMS     (A):  NULL ;  NULL ;  NULL       
REMARK   3   SYMMETRY H-BOND OTHERS            (A):  NULL ;  NULL ;  NULL       
REMARK   3   SYMMETRY METAL-ION REFINED ATOMS  (A):  NULL ;  NULL ;  NULL       
REMARK   3   SYMMETRY METAL-ION OTHERS         (A):  NULL ;  NULL ;  NULL       
REMARK   3                                                                      
REMARK   3  ISOTROPIC THERMAL FACTOR RESTRAINTS.     COUNT   RMS    WEIGHT      
REMARK   3   MAIN-CHAIN BOND REFINED ATOMS  (A**2):  NULL ;  NULL ;  NULL       
REMARK   3   MAIN-CHAIN BOND OTHER ATOMS    (A**2):  NULL ;  NULL ;  NULL       
REMARK   3   MAIN-CHAIN ANGLE REFINED ATOMS (A**2):  NULL ;  NULL ;  NULL       
REMARK   3   SIDE-CHAIN BOND REFINED ATOMS  (A**2):  NULL ;  NULL ;  NULL       
REMARK   3   SIDE-CHAIN ANGLE REFINED ATOMS (A**2):  NULL ;  NULL ;  NULL       
REMARK   3                                                                      
REMARK   3  ANISOTROPIC THERMAL FACTOR RESTRAINTS.   COUNT   RMS    WEIGHT      
REMARK   3   RIGID-BOND RESTRAINTS          (A**2):  NULL ;  NULL ;  NULL       
REMARK   3   SPHERICITY; FREE ATOMS         (A**2):  NULL ;  NULL ;  NULL       
REMARK   3   SPHERICITY; BONDED ATOMS       (A**2):  NULL ;  NULL ;  NULL       
REMARK   3                                                                      
REMARK   3  NCS RESTRAINTS STATISTICS                                           
REMARK   3   NUMBER OF DIFFERENT NCS GROUPS : NULL                              
REMARK   3                                                                      
REMARK   3  TLS DETAILS                                                         
REMARK   3   NUMBER OF TLS GROUPS  : NULL                                       
REMARK   3                                                                      
REMARK   3  BULK SOLVENT MODELLING.                                             
REMARK   3   METHOD USED : MASK                                                 
REMARK   3   PARAMETERS FOR MASK CALCULATION                                    
REMARK   3   VDW PROBE RADIUS   : 1.20                                          
REMARK   3   ION PROBE RADIUS   : 0.80                                          
REMARK   3   SHRINKAGE RADIUS   : 0.80                                          
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE          
REMARK   3   RIDING POSITIONS. U VALUES REFINED INDIVIDUALLY                    
REMARK   4                                                                      
REMARK   4 4CRJ COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 27-FEB-14.                  
REMARK 100 THE PDBE ID CODE IS EBI-59856.                                       
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 22-AUG-13                          
REMARK 200  TEMPERATURE           (KELVIN) : 100                                
REMARK 200  PH                             : 8                                  
REMARK 200  NUMBER OF CRYSTALS USED        : 1                                  
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : Y                                  
REMARK 200  RADIATION SOURCE               : AUSTRALIAN SYNCHROTRON             
REMARK 200  BEAMLINE                       : MX2                                
REMARK 200  X-RAY GENERATOR MODEL          : NULL                               
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 0.95370                            
REMARK 200  MONOCHROMATOR                  : NULL                               
REMARK 200  OPTICS                         : NULL                               
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : CCD                                
REMARK 200  DETECTOR MANUFACTURER          : ADSC                               
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : XDS                                
REMARK 200  DATA SCALING SOFTWARE          : SCALA                              
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 13792                              
REMARK 200  RESOLUTION RANGE HIGH      (A) : 2.00                               
REMARK 200  RESOLUTION RANGE LOW       (A) : 42.10                              
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : 0.0                                
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : 99.7                               
REMARK 200  DATA REDUNDANCY                : 21.5                               
REMARK 200  R MERGE                    (I) : 0.22                               
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200   FOR THE DATA SET  : 12.20                              
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.00                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : 2.11                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : 98.0                               
REMARK 200  DATA REDUNDANCY IN SHELL       : 19.7                               
REMARK 200  R MERGE FOR SHELL          (I) : 1.02                               
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200   FOR SHELL         : 3.60                               
REMARK 200                                                                      
REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH                              
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT        
REMARK 200 SOFTWARE USED: PHASER                                                
REMARK 200 STARTING MODEL: PDB ENTRY 4AD6                                       
REMARK 200                                                                      
REMARK 200 REMARK: NONE                                                         
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 58.6                                      
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.83                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: PROTEIN 7.5 MG/ML PLUS 1MM               
REMARK 280  AMPCPP PLUS 1MM INHIBITOR, AMMONIUM SULFATE 0.275 M,                
REMARK 280  PEG4000 22.1% W/V, SITTING DROP, 281 K                              
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 61                             
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290       2555   -Y,X-Y,Z+1/3                                            
REMARK 290       3555   -X+Y,-X,Z+2/3                                           
REMARK 290       4555   -X,-Y,Z+1/2                                             
REMARK 290       5555   Y,-X+Y,Z+5/6                                            
REMARK 290       6555   X-Y,X,Z+1/6                                             
REMARK 290                                                                      
REMARK 290     WHERE NNN -> OPERATOR NUMBER                                     
REMARK 290           MMM -> TRANSLATION VECTOR                                  
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS                            
REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM             
REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY                
REMARK 290 RELATED MOLECULES.                                                   
REMARK 290   SMTRY1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 290   SMTRY1   2 -0.500000 -0.866025  0.000000        0.00000            
REMARK 290   SMTRY2   2  0.866025 -0.500000  0.000000        0.00000            
REMARK 290   SMTRY3   2  0.000000  0.000000  1.000000       17.39100            
REMARK 290   SMTRY1   3 -0.500000  0.866025  0.000000        0.00000            
REMARK 290   SMTRY2   3 -0.866025 -0.500000  0.000000        0.00000            
REMARK 290   SMTRY3   3  0.000000  0.000000  1.000000       34.78200            
REMARK 290   SMTRY1   4 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   4  0.000000 -1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   4  0.000000  0.000000  1.000000       26.08650            
REMARK 290   SMTRY1   5  0.500000  0.866025  0.000000        0.00000            
REMARK 290   SMTRY2   5 -0.866025  0.500000  0.000000        0.00000            
REMARK 290   SMTRY3   5  0.000000  0.000000  1.000000       43.47750            
REMARK 290   SMTRY1   6  0.500000 -0.866025  0.000000        0.00000            
REMARK 290   SMTRY2   6  0.866025  0.500000  0.000000        0.00000            
REMARK 290   SMTRY3   6  0.000000  0.000000  1.000000        8.69550            
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: MONOMERIC                         
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC                  
REMARK 350 SOFTWARE USED: PISA                                                  
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 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     SER A    -1                                                      
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    GLU A  50       56.77    -92.05                                   
REMARK 500    ALA A 132       34.93   -144.54                                   
REMARK 500    TYR A 157      -51.34   -121.46                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 620                                                                      
REMARK 620 METAL COORDINATION                                                   
REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE):                             
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              MG A1160  MG                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 ASP A  95   OD1                                                    
REMARK 620 2 ASP A  97   OD1  89.6                                              
REMARK 620 3 APC A1159   O1B  91.8  98.7                                        
REMARK 620 4 HOH A2047   O   172.8  83.6  86.8                                  
REMARK 620 5 APC A1159   O1A  92.4 171.9  89.1  94.7                            
REMARK 620 6 HOH A2034   O    88.3  86.0 175.3  93.7  86.3                      
REMARK 620 N                    1     2     3     4     5                       
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              MG A1161  MG                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 HOH A2046   O                                                      
REMARK 620 2 ASP A  95   OD2  89.7                                              
REMARK 620 3 ASP A  97   OD2  84.9  87.6                                        
REMARK 620 4 APC A1159   O1B 171.1  85.5 102.3                                  
REMARK 620 5 APC A1159   O1G  95.9 174.3  93.9  88.9                            
REMARK 620 6 HOH A2045   O    84.7  90.4 169.4  87.9  89.0                      
REMARK 620 N                    1     2     3     4     5                       
REMARK 800                                                                      
REMARK 800 SITE                                                                 
REMARK 800 SITE_IDENTIFIER: AC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE APC A1159                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC2                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE  MG A1160                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC3                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE  MG A1161                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC4                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NO3 A1162                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC5                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE YH5 A1163                 
REMARK 999                                                                      
REMARK 999 SEQUENCE                                                             
REMARK 999 HEXAHISTIDINE-TAG WITH THROMBIN CLEAVAGE SITE AT THE N-              
REMARK 999 TERMINUS                                                             
DBREF  4CRJ A    1   158  UNP    C8MLE4   C8MLE4_STAAU     1    158             
SEQADV 4CRJ GLY A   -2  UNP  C8MLE4              EXPRESSION TAG                 
SEQADV 4CRJ SER A   -1  UNP  C8MLE4              EXPRESSION TAG                 
SEQADV 4CRJ HIS A    0  UNP  C8MLE4              EXPRESSION TAG                 
SEQRES   1 A  161  GLY SER HIS MET ILE GLN ALA TYR LEU GLY LEU GLY SER          
SEQRES   2 A  161  ASN ILE GLY ASP ARG GLU SER GLN LEU ASN ASP ALA ILE          
SEQRES   3 A  161  LYS ILE LEU ASN GLU TYR ASP GLY ILE SER VAL SER ASN          
SEQRES   4 A  161  ILE SER PRO ILE TYR GLU THR ALA PRO VAL GLY TYR THR          
SEQRES   5 A  161  GLU GLN PRO ASN PHE LEU ASN LEU CYS VAL GLU ILE GLN          
SEQRES   6 A  161  THR THR LEU THR VAL LEU GLN LEU LEU GLU CYS CYS LEU          
SEQRES   7 A  161  LYS THR GLU GLU CYS LEU HIS ARG ILE ARG LYS GLU ARG          
SEQRES   8 A  161  TRP GLY PRO ARG THR LEU ASP VAL ASP ILE LEU LEU TYR          
SEQRES   9 A  161  GLY GLU GLU MET ILE ASP LEU PRO LYS LEU SER VAL PRO          
SEQRES  10 A  161  HIS PRO ARG MET ASN GLU ARG ALA PHE VAL LEU ILE PRO          
SEQRES  11 A  161  LEU ASN ASP ILE ALA ALA ASN VAL VAL GLU PRO ARG SER          
SEQRES  12 A  161  LYS LEU LYS VAL LYS ASP LEU VAL PHE VAL ASP ASP SER          
SEQRES  13 A  161  VAL LYS ARG TYR LYS                                          
HET    APC  A1159      31                                                       
HET     MG  A1160       1                                                       
HET     MG  A1161       1                                                       
HET    NO3  A1162       4                                                       
HET    YH5  A1163      23                                                       
HETNAM     NO3 NITRATE ION                                                      
HETNAM     YH5 2-AMINO-8-{[2-(4-METHOXYPHENYL)-2-OXOETHYL]                      
HETNAM   2 YH5  SULFANYL}-1,9-DIHYDRO-6H-PURIN-6-ONE                            
HETNAM     APC DIPHOSPHOMETHYLPHOSPHONIC ACID ADENOSYL ESTER                    
HETNAM      MG MAGNESIUM ION                                                    
HETSYN     APC ALPHA,BETA-METHYLENEADENOSINE-5'-TRIPHOSPHATE                    
FORMUL   2  NO3    N O3 1-                                                      
FORMUL   3  YH5    C14 H13 N5 O3 S                                              
FORMUL   4  APC    C11 H18 N5 O12 P3                                            
FORMUL   5   MG    2(MG 2+)                                                     
FORMUL   6  HOH   *83(H2 O)                                                     
HELIX    1   1 ASP A   14  TYR A   29  1                                  16    
HELIX    2   2 THR A   66  LEU A   81  1                                  16    
HELIX    3   3 ARG A  117  GLU A  120  5                                   4    
HELIX    4   4 ARG A  121  ALA A  133  1                                  13    
HELIX    5   5 VAL A  144  VAL A  148  1                                   5    
SHEET    1  AA 2 ILE A  32  ILE A  37  0                                        
SHEET    2  AA 2 PHE A  54  THR A  63 -1  O  GLU A  60   N  SER A  35           
SHEET    1  AB 5 ASP A  95  TYR A 101  0                                        
SHEET    2  AB 5 ILE A   2  SER A  10 -1  O  TYR A   5   N  LEU A  99           
SHEET    3  AB 5 PHE A  54  THR A  63 -1  O  LEU A  55   N  SER A  10           
SHEET    4  AB 5 ILE A  40  THR A  43 -1  O  TYR A  41   N  ASN A  56           
SHEET    5  AB 5 VAL A 154  LYS A 158 -1  O  LYS A 155   N  GLU A  42           
SHEET    1  AC 4 ASP A  95  TYR A 101  0                                        
SHEET    2  AC 4 ILE A   2  SER A  10 -1  O  TYR A   5   N  LEU A  99           
SHEET    3  AC 4 PHE A  54  THR A  63 -1  O  LEU A  55   N  SER A  10           
SHEET    4  AC 4 ILE A  32  ILE A  37 -1  O  SER A  33   N  GLN A  62           
SHEET    1  AD 2 ILE A 106  LEU A 108  0                                        
SHEET    2  AD 2 LEU A 111  VAL A 113 -1  O  LEU A 111   N  LEU A 108           
SHEET    1  AE 2 VAL A 136  GLU A 137  0                                        
SHEET    2  AE 2 LEU A 142  LYS A 143 -1  O  LEU A 142   N  GLU A 137           
LINK         O1A APC A1159                MG    MG A1160     1555   1555  2.08  
LINK         O1B APC A1159                MG    MG A1160     1555   1555  2.06  
LINK         O1B APC A1159                MG    MG A1161     1555   1555  2.18  
LINK         O1G APC A1159                MG    MG A1161     1555   1555  2.07  
LINK        MG    MG A1160                 OD1 ASP A  95     1555   1555  2.15  
LINK        MG    MG A1160                 OD1 ASP A  97     1555   1555  2.10  
LINK        MG    MG A1160                 O   HOH A2047     1555   1555  2.07  
LINK        MG    MG A1160                 O   HOH A2034     1555   1555  2.09  
LINK        MG    MG A1161                 OD2 ASP A  95     1555   1555  2.17  
LINK        MG    MG A1161                 OD2 ASP A  97     1555   1555  2.05  
LINK        MG    MG A1161                 O   HOH A2045     1555   1555  2.11  
LINK        MG    MG A1161                 O   HOH A2046     1555   1555  2.15  
CISPEP   1 VAL A  113    PRO A  114          0        -4.83                     
SITE     1 AC1 23 LEU A  71  ARG A  83  ARG A  88  ARG A  92                    
SITE     2 AC1 23 ASP A  95  ASP A  97  ILE A  98  LYS A 110                    
SITE     3 AC1 23 LEU A 111  SER A 112  HIS A 115  ARG A 117                    
SITE     4 AC1 23 ARG A 121   MG A1160   MG A1161  HOH A2033                    
SITE     5 AC1 23 HOH A2034  HOH A2039  HOH A2040  HOH A2041                    
SITE     6 AC1 23 HOH A2045  HOH A2047  HOH A2083                               
SITE     1 AC2  6 ASP A  95  ASP A  97  APC A1159   MG A1161                    
SITE     2 AC2  6 HOH A2034  HOH A2047                                          
SITE     1 AC3  6 ASP A  95  ASP A  97  APC A1159   MG A1160                    
SITE     2 AC3  6 HOH A2045  HOH A2046                                          
SITE     1 AC4  6 ILE A  12  ARG A  83  ILE A  84  ARG A  85                    
SITE     2 AC4  6 ARG A  92  THR A  93                                          
SITE     1 AC5 14 THR A  43  ALA A  44  PRO A  45  VAL A  46                    
SITE     2 AC5 14 GLY A  47  PHE A  54  ASN A  56  GLU A 104                    
SITE     3 AC5 14 MET A 105  ILE A 106  ARG A 121  PHE A 123                    
SITE     4 AC5 14 HOH A2044  HOH A2045                                          
CRYST1   82.480   82.480   52.173  90.00  90.00 120.00 P 61          6          
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      0.012124  0.007000  0.000000        0.00000                         
SCALE2      0.000000  0.014000  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.019167        0.00000                         
ATOM      1  N   HIS A   0      23.542 -11.177 -21.879  1.00 45.88           N  
ATOM      2  CA  HIS A   0      24.475 -12.342 -21.984  1.00 40.93           C  
ATOM      3  C   HIS A   0      24.658 -13.048 -20.638  1.00 38.92           C  
ATOM      4  O   HIS A   0      24.871 -12.412 -19.601  1.00 37.08           O  
ATOM      5  CB  HIS A   0      25.841 -11.912 -22.526  1.00 40.98           C  
ATOM      6  CG  HIS A   0      26.851 -13.016 -22.550  1.00 38.33           C  
ATOM      7  ND1 HIS A   0      26.892 -13.963 -23.551  1.00 38.57           N  
ATOM      8  CD2 HIS A   0      27.844 -13.337 -21.687  1.00 36.81           C  
ATOM      9  CE1 HIS A   0      27.873 -14.815 -23.308  1.00 38.21           C  
ATOM     10  NE2 HIS A   0      28.465 -14.458 -22.182  1.00 37.45           N  
ATOM     11  N   MET A   1      24.617 -14.373 -20.676  1.00 37.81           N  
ATOM     12  CA  MET A   1      24.598 -15.165 -19.459  1.00 37.21           C  
ATOM     13  C   MET A   1      25.837 -16.026 -19.334  1.00 35.50           C  
ATOM     14  O   MET A   1      26.367 -16.515 -20.332  1.00 35.26           O  
ATOM     15  CB  MET A   1      23.355 -16.045 -19.448  1.00 38.18           C  
ATOM     16  CG  MET A   1      22.099 -15.268 -19.101  1.00 43.41           C  
ATOM     17  SD  MET A   1      20.590 -16.186 -19.441  1.00 52.68           S  
ATOM     18  CE  MET A   1      19.572 -15.636 -18.069  1.00 56.55           C  
ATOM     19  N   ILE A   2      26.298 -16.208 -18.102  1.00 31.40           N  
ATOM     20  CA  ILE A   2      27.381 -17.145 -17.860  1.00 30.58           C  
ATOM     21  C   ILE A   2      26.810 -18.417 -17.257  1.00 28.33           C  
ATOM     22  O   ILE A   2      25.791 -18.406 -16.562  1.00 27.11           O  
ATOM     23  CB  ILE A   2      28.529 -16.540 -17.017  1.00 32.34           C  
ATOM     24  CG1 ILE A   2      29.806 -17.385 -17.195  1.00 34.86           C  
ATOM     25  CG2 ILE A   2      28.134 -16.390 -15.558  1.00 31.46           C  
ATOM     26  CD1 ILE A   2      31.045 -16.814 -16.530  1.00 34.59           C  
ATOM     27  N   GLN A   3      27.467 -19.517 -17.574  1.00 27.38           N  
ATOM     28  CA  GLN A   3      27.051 -20.816 -17.126  1.00 28.09           C  
ATOM     29  C   GLN A   3      27.751 -21.104 -15.802  1.00 26.44           C  
ATOM     30  O   GLN A   3      28.981 -21.053 -15.717  1.00 24.28           O  
ATOM     31  CB  GLN A   3      27.442 -21.833 -18.178  1.00 30.06           C  
ATOM     32  CG  GLN A   3      26.967 -23.233 -17.904  1.00 33.93           C  
ATOM     33  CD  GLN A   3      27.069 -24.085 -19.146  1.00 38.35           C  
ATOM     34  OE1 GLN A   3      26.250 -23.954 -20.064  1.00 39.79           O  
ATOM     35  NE2 GLN A   3      28.089 -24.944 -19.200  1.00 38.94           N  
ATOM     36  N   ALA A   4      26.964 -21.380 -14.767  1.00 23.02           N  
ATOM     37  CA  ALA A   4      27.504 -21.735 -13.463  1.00 20.25           C  
ATOM     38  C   ALA A   4      26.885 -23.036 -12.948  1.00 20.29           C  
ATOM     39  O   ALA A   4      25.831 -23.478 -13.428  1.00 19.96           O  
ATOM     40  CB  ALA A   4      27.281 -20.608 -12.479  1.00 20.22           C  
ATOM     41  N   TYR A   5      27.552 -23.648 -11.972  1.00 19.11           N  
ATOM     42  CA  TYR A   5      27.080 -24.901 -11.390  1.00 20.03           C  
ATOM     43  C   TYR A   5      27.017 -24.768  -9.887  1.00 20.09           C  
ATOM     44  O   TYR A   5      27.958 -24.262  -9.264  1.00 19.52           O  
ATOM     45  CB  TYR A   5      27.968 -26.084 -11.798  1.00 19.00           C  
ATOM     46  CG  TYR A   5      27.868 -26.384 -13.262  1.00 20.60           C  
ATOM     47  CD1 TYR A   5      28.680 -25.726 -14.184  1.00 20.86           C  
ATOM     48  CD2 TYR A   5      26.912 -27.274 -13.742  1.00 21.55           C  
ATOM     49  CE1 TYR A   5      28.568 -25.975 -15.537  1.00 22.23           C  
ATOM     50  CE2 TYR A   5      26.784 -27.523 -15.094  1.00 22.45           C  
ATOM     51  CZ  TYR A   5      27.613 -26.878 -15.986  1.00 23.80           C  
ATOM     52  OH  TYR A   5      27.485 -27.142 -17.325  1.00 26.60           O  
ATOM     53  N   LEU A   6      25.888 -25.196  -9.319  1.00 18.36           N  
ATOM     54  CA  LEU A   6      25.671 -25.163  -7.887  1.00 17.49           C  
ATOM     55  C   LEU A   6      25.542 -26.585  -7.352  1.00 18.15           C  
ATOM     56  O   LEU A   6      25.045 -27.472  -8.039  1.00 17.42           O  
ATOM     57  CB  LEU A   6      24.412 -24.378  -7.531  1.00 17.89           C  
ATOM     58  CG  LEU A   6      24.254 -22.969  -8.089  1.00 18.09           C  
ATOM     59  CD1 LEU A   6      22.913 -22.401  -7.658  1.00 17.88           C  
ATOM     60  CD2 LEU A   6      25.385 -22.064  -7.636  1.00 17.75           C  
ATOM     61  N   GLY A   7      26.025 -26.787  -6.126  1.00 18.69           N  
ATOM     62  CA  GLY A   7      25.836 -28.039  -5.397  1.00 18.31           C  
ATOM     63  C   GLY A   7      24.825 -27.773  -4.301  1.00 19.60           C  
ATOM     64  O   GLY A   7      24.952 -26.798  -3.563  1.00 19.15           O  
ATOM     65  N   LEU A   8      23.804 -28.624  -4.227  1.00 20.34           N  
ATOM     66  CA  LEU A   8      22.757 -28.523  -3.220  1.00 20.26           C  
ATOM     67  C   LEU A   8      22.775 -29.746  -2.317  1.00 19.35           C  
ATOM     68  O   LEU A   8      22.968 -30.857  -2.785  1.00 18.93           O  
ATOM     69  CB  LEU A   8      21.384 -28.418  -3.881  1.00 21.38           C  
ATOM     70  CG  LEU A   8      20.980 -27.031  -4.369  1.00 24.40           C  
ATOM     71  CD1 LEU A   8      21.819 -26.584  -5.544  1.00 24.89           C  
ATOM     72  CD2 LEU A   8      19.512 -27.026  -4.764  1.00 27.28           C  
ATOM     73  N   GLY A   9      22.562 -29.523  -1.025  1.00 19.60           N  
ATOM     74  CA  GLY A   9      22.531 -30.594  -0.044  1.00 20.22           C  
ATOM     75  C   GLY A   9      21.482 -30.339   1.010  1.00 20.12           C  
ATOM     76  O   GLY A   9      21.163 -29.191   1.310  1.00 20.60           O  
ATOM     77  N   SER A  10      20.947 -31.415   1.572  1.00 20.35           N  
ATOM     78  CA  SER A  10      20.005 -31.316   2.691  1.00 20.19           C  
ATOM     79  C   SER A  10      20.091 -32.594   3.499  1.00 18.99           C  
ATOM     80  O   SER A  10      20.058 -33.678   2.928  1.00 18.54           O  
ATOM     81  CB  SER A  10      18.565 -31.122   2.183  1.00 20.41           C  
ATOM     82  OG  SER A  10      17.643 -31.073   3.277  1.00 21.42           O  
ATOM     83  N   ASN A  11      20.206 -32.474   4.819  1.00 19.32           N  
ATOM     84  CA  ASN A  11      20.159 -33.656   5.673  1.00 19.59           C  
ATOM     85  C   ASN A  11      19.306 -33.487   6.930  1.00 20.49           C  
ATOM     86  O   ASN A  11      19.561 -34.124   7.936  1.00 21.45           O  
ATOM     87  CB  ASN A  11      21.575 -34.164   5.995  1.00 19.27           C  
ATOM     88  CG  ASN A  11      22.296 -33.321   7.043  1.00 17.71           C  
ATOM     89  OD1 ASN A  11      22.023 -32.142   7.212  1.00 17.21           O  
ATOM     90  ND2 ASN A  11      23.205 -33.951   7.766  1.00 17.94           N  
ATOM     91  N   ILE A  12      18.286 -32.634   6.852  1.00 21.81           N  
ATOM     92  CA  ILE A  12      17.362 -32.405   7.960  1.00 22.15           C  
ATOM     93  C   ILE A  12      15.949 -32.370   7.393  1.00 23.14           C  
ATOM     94  O   ILE A  12      15.652 -31.587   6.487  1.00 21.82           O  
ATOM     95  CB  ILE A  12      17.625 -31.061   8.695  1.00 23.49           C  
ATOM     96  CG1 ILE A  12      18.938 -31.091   9.485  1.00 23.20           C  
ATOM     97  CG2 ILE A  12      16.475 -30.705   9.649  1.00 23.31           C  
ATOM     98  CD1 ILE A  12      18.962 -32.072  10.642  1.00 22.35           C  
ATOM     99  N   GLY A  13      15.080 -33.221   7.927  1.00 23.96           N  
ATOM    100  CA  GLY A  13      13.659 -33.122   7.630  1.00 23.79           C  
ATOM    101  C   GLY A  13      13.316 -33.742   6.295  1.00 22.69           C  
ATOM    102  O   GLY A  13      13.892 -34.757   5.906  1.00 21.64           O  
ATOM    103  N   ASP A  14      12.367 -33.125   5.601  1.00 24.13           N  
ATOM    104  CA  ASP A  14      11.883 -33.618   4.314  1.00 24.85           C  
ATOM    105  C   ASP A  14      12.844 -33.075   3.255  1.00 23.52           C  
ATOM    106  O   ASP A  14      12.608 -32.025   2.655  1.00 21.58           O  
ATOM    107  CB  ASP A  14      10.442 -33.144   4.092  1.00 26.39           C  
ATOM    108  CG  ASP A  14       9.839 -33.642   2.795  1.00 27.67           C  
ATOM    109  OD1 ASP A  14      10.535 -34.311   1.996  1.00 27.57           O  
ATOM    110  OD2 ASP A  14       8.644 -33.331   2.566  1.00 34.18           O  
ATOM    111  N   ARG A  15      13.934 -33.815   3.061  1.00 22.56           N  
ATOM    112  CA  ARG A  15      15.086 -33.357   2.290  1.00 22.21           C  
ATOM    113  C   ARG A  15      14.714 -33.095   0.836  1.00 22.84           C  
ATOM    114  O   ARG A  15      15.084 -32.064   0.272  1.00 21.67           O  
ATOM    115  CB  ARG A  15      16.223 -34.391   2.368  1.00 20.49           C  
ATOM    116  CG  ARG A  15      16.762 -34.608   3.775  1.00 19.60           C  
ATOM    117  CD  ARG A  15      17.591 -35.874   3.875  1.00 19.50           C  
ATOM    118  NE  ARG A  15      16.839 -37.058   3.477  1.00 18.25           N  
ATOM    119  CZ  ARG A  15      17.388 -38.225   3.141  1.00 18.20           C  
ATOM    120  NH1 ARG A  15      18.711 -38.394   3.149  1.00 16.67           N  
ATOM    121  NH2 ARG A  15      16.611 -39.237   2.775  1.00 18.30           N  
ATOM    122  N   GLU A  16      13.958 -34.013   0.246  1.00 22.65           N  
ATOM    123  CA  GLU A  16      13.581 -33.892  -1.156  1.00 25.89           C  
ATOM    124  C   GLU A  16      12.726 -32.666  -1.414  1.00 26.02           C  
ATOM    125  O   GLU A  16      12.940 -31.948  -2.392  1.00 25.67           O  
ATOM    126  CB  GLU A  16      12.840 -35.128  -1.646  1.00 28.70           C  
ATOM    127  CG  GLU A  16      12.796 -35.191  -3.164  1.00 33.46           C  
ATOM    128  CD  GLU A  16      11.978 -36.346  -3.690  1.00 37.39           C  
ATOM    129  OE1 GLU A  16      11.736 -37.308  -2.932  1.00 38.72           O  
ATOM    130  OE2 GLU A  16      11.581 -36.280  -4.870  1.00 43.88           O  
ATOM    131  N   SER A  17      11.757 -32.433  -0.542  1.00 25.73           N  
ATOM    132  CA  SER A  17      10.880 -31.277  -0.683  1.00 27.62           C  
ATOM    133  C   SER A  17      11.668 -29.965  -0.523  1.00 27.49           C  
ATOM    134  O   SER A  17      11.410 -28.977  -1.207  1.00 27.22           O  
ATOM    135  CB  SER A  17       9.734 -31.368   0.326  1.00 29.10           C  
ATOM    136  OG  SER A  17       9.150 -30.104   0.545  1.00 33.43           O  
ATOM    137  N   GLN A  18      12.644 -29.960   0.370  1.00 28.61           N  
ATOM    138  CA  GLN A  18      13.455 -28.763   0.580  1.00 29.39           C  
ATOM    139  C   GLN A  18      14.346 -28.449  -0.629  1.00 25.79           C  
ATOM    140  O   GLN A  18      14.482 -27.293  -1.005  1.00 23.88           O  
ATOM    141  CB  GLN A  18      14.276 -28.911   1.848  1.00 31.62           C  
ATOM    142  CG  GLN A  18      13.400 -28.815   3.089  1.00 35.21           C  
ATOM    143  CD  GLN A  18      14.054 -29.317   4.359  1.00 36.34           C  
ATOM    144  OE1 GLN A  18      13.604 -28.982   5.451  1.00 41.55           O  
ATOM    145  NE2 GLN A  18      15.103 -30.124   4.234  1.00 37.16           N  
ATOM    146  N   LEU A  19      14.924 -29.481  -1.236  1.00 24.70           N  
ATOM    147  CA  LEU A  19      15.718 -29.318  -2.453  1.00 24.54           C  
ATOM    148  C   LEU A  19      14.847 -28.841  -3.605  1.00 25.79           C  
ATOM    149  O   LEU A  19      15.246 -27.967  -4.375  1.00 25.42           O  
ATOM    150  CB  LEU A  19      16.402 -30.632  -2.836  1.00 22.94           C  
ATOM    151  CG  LEU A  19      17.499 -31.116  -1.881  1.00 22.67           C  
ATOM    152  CD1 LEU A  19      17.941 -32.508  -2.275  1.00 22.51           C  
ATOM    153  CD2 LEU A  19      18.704 -30.185  -1.838  1.00 23.03           C  
ATOM    154  N   ASN A  20      13.653 -29.408  -3.712  1.00 26.09           N  
ATOM    155  CA  ASN A  20      12.717 -28.988  -4.739  1.00 28.46           C  
ATOM    156  C   ASN A  20      12.374 -27.516  -4.597  1.00 26.85           C  
ATOM    157  O   ASN A  20      12.426 -26.773  -5.570  1.00 25.98           O  
ATOM    158  CB  ASN A  20      11.442 -29.822  -4.693  1.00 33.08           C  
ATOM    159  CG  ASN A  20      10.563 -29.583  -5.898  1.00 38.74           C  
ATOM    160  OD1 ASN A  20       9.533 -28.913  -5.805  1.00 44.76           O  
ATOM    161  ND2 ASN A  20      10.980 -30.105  -7.047  1.00 41.14           N  
ATOM    162  N   ASP A  21      12.034 -27.098  -3.384  1.00 26.44           N  
ATOM    163  CA  ASP A  21      11.759 -25.692  -3.109  1.00 27.40           C  
ATOM    164  C   ASP A  21      12.960 -24.806  -3.426  1.00 26.20           C  
ATOM    165  O   ASP A  21      12.798 -23.695  -3.928  1.00 25.73           O  
ATOM    166  CB  ASP A  21      11.367 -25.495  -1.642  1.00 30.86           C  
ATOM    167  CG  ASP A  21       9.986 -26.047  -1.323  1.00 35.62           C  
ATOM    168  OD1 ASP A  21       9.272 -26.470  -2.260  1.00 38.98           O  
ATOM    169  OD2 ASP A  21       9.618 -26.060  -0.128  1.00 41.30           O  
ATOM    170  N   ALA A  22      14.160 -25.292  -3.115  1.00 23.97           N  
ATOM    171  CA  ALA A  22      15.380 -24.530  -3.361  1.00 23.88           C  
ATOM    172  C   ALA A  22      15.550 -24.249  -4.853  1.00 22.37           C  
ATOM    173  O   ALA A  22      15.843 -23.124  -5.243  1.00 21.43           O  
ATOM    174  CB  ALA A  22      16.593 -25.269  -2.814  1.00 24.46           C  
ATOM    175  N   ILE A  23      15.352 -25.268  -5.678  1.00 22.67           N  
ATOM    176  CA  ILE A  23      15.445 -25.107  -7.132  1.00 25.00           C  
ATOM    177  C   ILE A  23      14.422 -24.087  -7.649  1.00 26.26           C  
ATOM    178  O   ILE A  23      14.762 -23.210  -8.452  1.00 24.73           O  
ATOM    179  CB  ILE A  23      15.260 -26.450  -7.862  1.00 26.52           C  
ATOM    180  CG1 ILE A  23      16.462 -27.360  -7.582  1.00 27.25           C  
ATOM    181  CG2 ILE A  23      15.096 -26.226  -9.362  1.00 27.57           C  
ATOM    182  CD1 ILE A  23      16.253 -28.801  -7.988  1.00 28.85           C  
ATOM    183  N   LYS A  24      13.181 -24.194  -7.184  1.00 27.85           N  
ATOM    184  CA  LYS A  24      12.154 -23.224  -7.573  1.00 30.38           C  
ATOM    185  C   LYS A  24      12.524 -21.803  -7.152  1.00 28.49           C  
ATOM    186  O   LYS A  24      12.394 -20.871  -7.937  1.00 29.41           O  
ATOM    187  CB  LYS A  24      10.797 -23.603  -6.990  1.00 34.29           C  
ATOM    188  CG  LYS A  24      10.286 -24.946  -7.489  1.00 39.40           C  
ATOM    189  CD  LYS A  24       8.786 -24.925  -7.729  1.00 44.65           C  
ATOM    190  CE  LYS A  24       8.232 -26.329  -7.948  1.00 47.88           C  
ATOM    191  NZ  LYS A  24       7.920 -27.004  -6.659  1.00 50.71           N  
ATOM    192  N   ILE A  25      12.997 -21.644  -5.921  1.00 27.97           N  
ATOM    193  CA  ILE A  25      13.395 -20.331  -5.421  1.00 27.65           C  
ATOM    194  C   ILE A  25      14.573 -19.772  -6.220  1.00 28.74           C  
ATOM    195  O   ILE A  25      14.578 -18.592  -6.586  1.00 26.20           O  
ATOM    196  CB  ILE A  25      13.757 -20.375  -3.921  1.00 27.63           C  
ATOM    197  CG1 ILE A  25      12.493 -20.588  -3.080  1.00 29.20           C  
ATOM    198  CG2 ILE A  25      14.437 -19.079  -3.489  1.00 27.90           C  
ATOM    199  CD1 ILE A  25      12.761 -20.877  -1.614  1.00 29.60           C  
ATOM    200  N   LEU A  26      15.575 -20.614  -6.471  1.00 27.76           N  
ATOM    201  CA  LEU A  26      16.741 -20.193  -7.256  1.00 29.83           C  
ATOM    202  C   LEU A  26      16.326 -19.710  -8.642  1.00 29.69           C  
ATOM    203  O   LEU A  26      16.838 -18.702  -9.140  1.00 29.19           O  
ATOM    204  CB  LEU A  26      17.754 -21.328  -7.394  1.00 29.20           C  
ATOM    205  CG  LEU A  26      18.618 -21.558  -6.152  1.00 29.21           C  
ATOM    206  CD1 LEU A  26      19.292 -22.918  -6.252  1.00 29.37           C  
ATOM    207  CD2 LEU A  26      19.648 -20.445  -5.987  1.00 28.84           C  
ATOM    208  N   ASN A  27      15.382 -20.426  -9.246  1.00 29.96           N  
ATOM    209  CA  ASN A  27      14.913 -20.104 -10.587  1.00 30.49           C  
ATOM    210  C   ASN A  27      14.083 -18.813 -10.623  1.00 31.93           C  
ATOM    211  O   ASN A  27      13.893 -18.240 -11.690  1.00 31.31           O  
ATOM    212  CB  ASN A  27      14.126 -21.276 -11.179  1.00 30.20           C  
ATOM    213  CG  ASN A  27      13.917 -21.150 -12.682  1.00 31.80           C  
ATOM    214  OD1 ASN A  27      14.871 -21.032 -13.446  1.00 30.34           O  
ATOM    215  ND2 ASN A  27      12.658 -21.179 -13.113  1.00 33.69           N  
ATOM    216  N   GLU A  28      13.621 -18.355  -9.460  1.00 33.85           N  
ATOM    217  CA  GLU A  28      12.806 -17.137  -9.361  1.00 35.38           C  
ATOM    218  C   GLU A  28      13.597 -15.832  -9.182  1.00 35.03           C  
ATOM    219  O   GLU A  28      13.039 -14.760  -9.400  1.00 37.08           O  
ATOM    220  CB  GLU A  28      11.771 -17.291  -8.239  1.00 38.50           C  
ATOM    221  CG  GLU A  28      10.614 -18.200  -8.632  1.00 43.96           C  
ATOM    222  CD  GLU A  28       9.757 -18.657  -7.458  1.00 48.31           C  
ATOM    223  OE1 GLU A  28       9.961 -18.167  -6.328  1.00 50.04           O  
ATOM    224  OE2 GLU A  28       8.867 -19.511  -7.673  1.00 47.62           O  
ATOM    225  N   TYR A  29      14.872 -15.901  -8.790  1.00 32.70           N  
ATOM    226  CA  TYR A  29      15.698 -14.688  -8.704  1.00 33.40           C  
ATOM    227  C   TYR A  29      15.881 -14.076 -10.085  1.00 34.31           C  
ATOM    228  O   TYR A  29      16.149 -14.785 -11.053  1.00 34.47           O  
ATOM    229  CB  TYR A  29      17.086 -14.969  -8.116  1.00 34.02           C  
ATOM    230  CG  TYR A  29      17.080 -15.358  -6.661  1.00 33.61           C  
ATOM    231  CD1 TYR A  29      16.960 -14.399  -5.657  1.00 36.51           C  
ATOM    232  CD2 TYR A  29      17.202 -16.686  -6.287  1.00 33.28           C  
ATOM    233  CE1 TYR A  29      16.953 -14.762  -4.317  1.00 37.62           C  
ATOM    234  CE2 TYR A  29      17.190 -17.063  -4.958  1.00 33.58           C  
ATOM    235  CZ  TYR A  29      17.065 -16.102  -3.977  1.00 35.59           C  
ATOM    236  OH  TYR A  29      17.063 -16.480  -2.659  1.00 37.87           O  
ATOM    237  N   ASP A  30      15.726 -12.759 -10.178  1.00 37.08           N  
ATOM    238  CA  ASP A  30      16.067 -12.050 -11.403  1.00 39.01           C  
ATOM    239  C   ASP A  30      17.559 -12.250 -11.637  1.00 35.42           C  
ATOM    240  O   ASP A  30      18.368 -12.052 -10.734  1.00 38.46           O  
ATOM    241  CB  ASP A  30      15.757 -10.554 -11.292  1.00 45.58           C  
ATOM    242  CG  ASP A  30      14.265 -10.264 -11.137  1.00 50.94           C  
ATOM    243  OD1 ASP A  30      13.438 -10.948 -11.782  1.00 55.15           O  
ATOM    244  OD2 ASP A  30      13.920  -9.342 -10.368  1.00 56.46           O  
ATOM    245  N   GLY A  31      17.914 -12.684 -12.835  1.00 32.97           N  
ATOM    246  CA  GLY A  31      19.312 -12.919 -13.170  1.00 33.21           C  
ATOM    247  C   GLY A  31      19.759 -14.362 -13.031  1.00 30.68           C  
ATOM    248  O   GLY A  31      20.924 -14.654 -13.269  1.00 30.19           O  
ATOM    249  N   ILE A  32      18.847 -15.262 -12.653  1.00 29.04           N  
ATOM    250  CA  ILE A  32      19.150 -16.699 -12.573  1.00 28.30           C  
ATOM    251  C   ILE A  32      18.078 -17.508 -13.301  1.00 28.67           C  
ATOM    252  O   ILE A  32      16.888 -17.319 -13.062  1.00 29.88           O  
ATOM    253  CB  ILE A  32      19.249 -17.200 -11.112  1.00 27.48           C  
ATOM    254  CG1 ILE A  32      20.455 -16.572 -10.408  1.00 27.79           C  
ATOM    255  CG2 ILE A  32      19.373 -18.722 -11.065  1.00 26.56           C  
ATOM    256  CD1 ILE A  32      20.512 -16.820  -8.910  1.00 27.48           C  
ATOM    257  N   SER A  33      18.515 -18.391 -14.194  1.00 27.50           N  
ATOM    258  CA  SER A  33      17.661 -19.422 -14.771  1.00 29.34           C  
ATOM    259  C   SER A  33      18.308 -20.779 -14.554  1.00 27.63           C  
ATOM    260  O   SER A  33      19.470 -20.991 -14.935  1.00 24.44           O  
ATOM    261  CB  SER A  33      17.459 -19.199 -16.268  1.00 30.55           C  
ATOM    262  OG  SER A  33      17.081 -17.860 -16.527  1.00 37.93           O  
ATOM    263  N   VAL A  34      17.558 -21.697 -13.953  1.00 25.06           N  
ATOM    264  CA  VAL A  34      18.016 -23.068 -13.809  1.00 25.47           C  
ATOM    265  C   VAL A  34      17.923 -23.728 -15.179  1.00 25.55           C  
ATOM    266  O   VAL A  34      16.858 -23.735 -15.790  1.00 26.23           O  
ATOM    267  CB  VAL A  34      17.168 -23.851 -12.791  1.00 26.32           C  
ATOM    268  CG1 VAL A  34      17.541 -25.326 -12.806  1.00 26.03           C  
ATOM    269  CG2 VAL A  34      17.341 -23.267 -11.395  1.00 27.00           C  
ATOM    270  N   SER A  35      19.035 -24.268 -15.671  1.00 22.92           N  
ATOM    271  CA  SER A  35      19.082 -24.742 -17.051  1.00 22.83           C  
ATOM    272  C   SER A  35      19.396 -26.222 -17.182  1.00 21.44           C  
ATOM    273  O   SER A  35      19.302 -26.768 -18.267  1.00 22.00           O  
ATOM    274  CB  SER A  35      20.083 -23.915 -17.866  1.00 25.06           C  
ATOM    275  OG  SER A  35      21.369 -23.930 -17.278  1.00 24.14           O  
ATOM    276  N   ASN A  36      19.777 -26.867 -16.088  1.00 20.46           N  
ATOM    277  CA  ASN A  36      19.980 -28.316 -16.084  1.00 21.51           C  
ATOM    278  C   ASN A  36      19.959 -28.807 -14.643  1.00 20.16           C  
ATOM    279  O   ASN A  36      20.391 -28.103 -13.739  1.00 20.87           O  
ATOM    280  CB  ASN A  36      21.295 -28.695 -16.787  1.00 21.45           C  
ATOM    281  CG  ASN A  36      21.266 -30.091 -17.400  1.00 21.72           C  
ATOM    282  OD1 ASN A  36      20.249 -30.801 -17.357  1.00 20.09           O  
ATOM    283  ND2 ASN A  36      22.384 -30.487 -17.989  1.00 20.03           N  
ATOM    284  N   ILE A  37      19.435 -30.011 -14.437  1.00 19.87           N  
ATOM    285  CA  ILE A  37      19.227 -30.564 -13.102  1.00 19.75           C  
ATOM    286  C   ILE A  37      19.752 -31.983 -13.079  1.00 18.17           C  
ATOM    287  O   ILE A  37      19.352 -32.796 -13.906  1.00 17.98           O  
ATOM    288  CB  ILE A  37      17.725 -30.594 -12.739  1.00 20.76           C  
ATOM    289  CG1 ILE A  37      17.150 -29.183 -12.753  1.00 21.75           C  
ATOM    290  CG2 ILE A  37      17.507 -31.223 -11.366  1.00 22.28           C  
ATOM    291  CD1 ILE A  37      15.642 -29.128 -12.614  1.00 22.82           C  
ATOM    292  N   SER A  38      20.639 -32.289 -12.137  1.00 17.07           N  
ATOM    293  CA  SER A  38      21.177 -33.648 -12.027  1.00 16.66           C  
ATOM    294  C   SER A  38      20.200 -34.556 -11.290  1.00 17.30           C  
ATOM    295  O   SER A  38      19.273 -34.073 -10.656  1.00 16.99           O  
ATOM    296  CB  SER A  38      22.517 -33.655 -11.288  1.00 16.02           C  
ATOM    297  OG  SER A  38      22.319 -33.616  -9.891  1.00 16.02           O  
ATOM    298  N   PRO A  39      20.431 -35.878 -11.346  1.00 18.28           N  
ATOM    299  CA  PRO A  39      19.700 -36.769 -10.451  1.00 19.34           C  
ATOM    300  C   PRO A  39      20.072 -36.496  -8.990  1.00 21.22           C  
ATOM    301  O   PRO A  39      21.169 -35.981  -8.708  1.00 19.71           O  
ATOM    302  CB  PRO A  39      20.186 -38.166 -10.859  1.00 19.06           C  
ATOM    303  CG  PRO A  39      20.816 -38.000 -12.191  1.00 19.21           C  
ATOM    304  CD  PRO A  39      21.393 -36.615 -12.179  1.00 18.30           C  
ATOM    305  N   ILE A  40      19.161 -36.837  -8.088  1.00 21.77           N  
ATOM    306  CA  ILE A  40      19.394 -36.747  -6.650  1.00 22.14           C  
ATOM    307  C   ILE A  40      20.034 -38.041  -6.174  1.00 21.49           C  
ATOM    308  O   ILE A  40      19.601 -39.144  -6.554  1.00 21.37           O  
ATOM    309  CB  ILE A  40      18.081 -36.527  -5.875  1.00 25.68           C  
ATOM    310  CG1 ILE A  40      17.451 -35.194  -6.264  1.00 29.24           C  
ATOM    311  CG2 ILE A  40      18.324 -36.525  -4.369  1.00 26.45           C  
ATOM    312  CD1 ILE A  40      15.999 -35.062  -5.857  1.00 32.14           C  
ATOM    313  N   TYR A  41      21.040 -37.900  -5.319  1.00 19.16           N  
ATOM    314  CA  TYR A  41      21.703 -39.032  -4.685  1.00 19.84           C  
ATOM    315  C   TYR A  41      21.556 -38.966  -3.162  1.00 20.29           C  
ATOM    316  O   TYR A  41      21.589 -37.878  -2.564  1.00 18.90           O  
ATOM    317  CB  TYR A  41      23.185 -39.048  -5.073  1.00 19.75           C  
ATOM    318  CG  TYR A  41      23.397 -39.352  -6.528  1.00 19.87           C  
ATOM    319  CD1 TYR A  41      23.250 -38.367  -7.485  1.00 20.04           C  
ATOM    320  CD2 TYR A  41      23.728 -40.638  -6.947  1.00 20.93           C  
ATOM    321  CE1 TYR A  41      23.432 -38.641  -8.823  1.00 20.62           C  
ATOM    322  CE2 TYR A  41      23.918 -40.923  -8.282  1.00 20.98           C  
ATOM    323  CZ  TYR A  41      23.764 -39.921  -9.216  1.00 20.45           C  
ATOM    324  OH  TYR A  41      23.947 -40.203 -10.540  1.00 20.51           O  
ATOM    325  N   GLU A  42      21.379 -40.127  -2.535  1.00 19.77           N  
ATOM    326  CA  GLU A  42      21.477 -40.217  -1.091  1.00 20.04           C  
ATOM    327  C   GLU A  42      22.914 -40.549  -0.734  1.00 20.78           C  
ATOM    328  O   GLU A  42      23.503 -41.476  -1.294  1.00 20.85           O  
ATOM    329  CB  GLU A  42      20.545 -41.269  -0.504  1.00 22.95           C  
ATOM    330  CG  GLU A  42      20.568 -41.251   1.019  1.00 24.36           C  
ATOM    331  CD  GLU A  42      19.272 -41.738   1.628  1.00 26.67           C  
ATOM    332  OE1 GLU A  42      18.820 -42.828   1.238  1.00 30.13           O  
ATOM    333  OE2 GLU A  42      18.721 -41.034   2.497  1.00 26.80           O  
ATOM    334  N   THR A  43      23.475 -39.779   0.194  1.00 20.35           N  
ATOM    335  CA  THR A  43      24.897 -39.839   0.466  1.00 20.86           C  
ATOM    336  C   THR A  43      25.175 -39.885   1.962  1.00 20.52           C  
ATOM    337  O   THR A  43      24.545 -39.179   2.758  1.00 20.44           O  
ATOM    338  CB  THR A  43      25.642 -38.657  -0.215  1.00 21.83           C  
ATOM    339  OG1 THR A  43      25.184 -37.408   0.305  1.00 21.45           O  
ATOM    340  CG2 THR A  43      25.388 -38.659  -1.715  1.00 22.70           C  
ATOM    341  N   ALA A  44      26.105 -40.756   2.344  1.00 20.95           N  
ATOM    342  CA  ALA A  44      26.562 -40.828   3.722  1.00 21.74           C  
ATOM    343  C   ALA A  44      27.232 -39.497   4.057  1.00 20.28           C  
ATOM    344  O   ALA A  44      27.912 -38.933   3.207  1.00 20.66           O  
ATOM    345  CB  ALA A  44      27.544 -41.965   3.901  1.00 22.54           C  
ATOM    346  N   PRO A  45      27.039 -39.000   5.286  1.00 20.46           N  
ATOM    347  CA  PRO A  45      27.616 -37.708   5.629  1.00 22.67           C  
ATOM    348  C   PRO A  45      29.124 -37.828   5.677  1.00 22.83           C  
ATOM    349  O   PRO A  45      29.640 -38.835   6.146  1.00 23.54           O  
ATOM    350  CB  PRO A  45      27.048 -37.404   7.016  1.00 22.12           C  
ATOM    351  CG  PRO A  45      26.624 -38.712   7.577  1.00 22.26           C  
ATOM    352  CD  PRO A  45      26.503 -39.707   6.459  1.00 22.43           C  
ATOM    353  N   VAL A  46      29.798 -36.818   5.148  1.00 25.16           N  
ATOM    354  CA  VAL A  46      31.260 -36.757   5.113  1.00 27.20           C  
ATOM    355  C   VAL A  46      31.726 -35.690   6.110  1.00 26.59           C  
ATOM    356  O   VAL A  46      31.103 -34.632   6.247  1.00 23.61           O  
ATOM    357  CB  VAL A  46      31.769 -36.415   3.692  1.00 28.96           C  
ATOM    358  CG1 VAL A  46      33.289 -36.519   3.615  1.00 30.82           C  
ATOM    359  CG2 VAL A  46      31.150 -37.351   2.662  1.00 29.85           C  
ATOM    360  N   GLY A  47      32.828 -35.975   6.796  1.00 27.91           N  
ATOM    361  CA  GLY A  47      33.335 -35.101   7.846  1.00 27.94           C  
ATOM    362  C   GLY A  47      32.785 -35.563   9.180  1.00 28.09           C  
ATOM    363  O   GLY A  47      33.224 -36.577   9.718  1.00 29.52           O  
ATOM    364  N   TYR A  48      31.834 -34.813   9.722  1.00 27.36           N  
ATOM    365  CA  TYR A  48      31.126 -35.229  10.929  1.00 30.15           C  
ATOM    366  C   TYR A  48      30.146 -36.344  10.549  1.00 29.05           C  
ATOM    367  O   TYR A  48      29.217 -36.126   9.776  1.00 26.93           O  
ATOM    368  CB  TYR A  48      30.396 -34.043  11.559  1.00 31.31           C  
ATOM    369  CG  TYR A  48      29.680 -34.364  12.860  1.00 35.06           C  
ATOM    370  CD1 TYR A  48      30.306 -35.101  13.866  1.00 37.83           C  
ATOM    371  CD2 TYR A  48      28.383 -33.915  13.088  1.00 38.43           C  
ATOM    372  CE1 TYR A  48      29.652 -35.390  15.057  1.00 42.48           C  
ATOM    373  CE2 TYR A  48      27.721 -34.194  14.277  1.00 41.95           C  
ATOM    374  CZ  TYR A  48      28.356 -34.933  15.257  1.00 42.67           C  
ATOM    375  OH  TYR A  48      27.695 -35.210  16.438  1.00 54.04           O  
ATOM    376  N   THR A  49      30.369 -37.546  11.060  1.00 32.28           N  
ATOM    377  CA  THR A  49      29.588 -38.696  10.602  1.00 34.88           C  
ATOM    378  C   THR A  49      28.392 -39.003  11.509  1.00 34.97           C  
ATOM    379  O   THR A  49      27.541 -39.811  11.141  1.00 40.18           O  
ATOM    380  CB  THR A  49      30.483 -39.937  10.369  1.00 37.32           C  
ATOM    381  OG1 THR A  49      31.393 -40.099  11.457  1.00 37.01           O  
ATOM    382  CG2 THR A  49      31.292 -39.774   9.085  1.00 37.71           C  
ATOM    383  N   GLU A  50      28.301 -38.335  12.662  1.00 33.87           N  
ATOM    384  CA  GLU A  50      27.155 -38.500  13.568  1.00 35.26           C  
ATOM    385  C   GLU A  50      26.075 -37.465  13.263  1.00 30.48           C  
ATOM    386  O   GLU A  50      25.676 -36.662  14.113  1.00 30.26           O  
ATOM    387  CB  GLU A  50      27.596 -38.442  15.040  1.00 39.60           C  
ATOM    388  CG  GLU A  50      28.177 -39.753  15.549  1.00 44.54           C  
ATOM    389  CD  GLU A  50      29.262 -40.302  14.644  1.00 49.67           C  
ATOM    390  OE1 GLU A  50      30.346 -39.680  14.572  1.00 56.04           O  
ATOM    391  OE2 GLU A  50      29.030 -41.350  13.998  1.00 53.32           O  
ATOM    392  N   GLN A  51      25.629 -37.476  12.014  1.00 27.02           N  
ATOM    393  CA  GLN A  51      24.563 -36.602  11.569  1.00 23.87           C  
ATOM    394  C   GLN A  51      23.836 -37.326  10.450  1.00 21.63           C  
ATOM    395  O   GLN A  51      24.297 -38.373  10.005  1.00 22.39           O  
ATOM    396  CB  GLN A  51      25.114 -35.248  11.099  1.00 22.95           C  
ATOM    397  CG  GLN A  51      25.978 -35.322   9.855  1.00 21.87           C  
ATOM    398  CD  GLN A  51      26.371 -33.945   9.342  1.00 22.61           C  
ATOM    399  OE1 GLN A  51      25.544 -33.023   9.276  1.00 20.48           O  
ATOM    400  NE2 GLN A  51      27.630 -33.802   8.954  1.00 22.99           N  
ATOM    401  N   PRO A  52      22.684 -36.798  10.019  1.00 20.39           N  
ATOM    402  CA  PRO A  52      21.876 -37.575   9.075  1.00 20.41           C  
ATOM    403  C   PRO A  52      22.459 -37.686   7.665  1.00 19.62           C  
ATOM    404  O   PRO A  52      23.210 -36.815   7.224  1.00 20.32           O  
ATOM    405  CB  PRO A  52      20.548 -36.808   9.029  1.00 20.26           C  
ATOM    406  CG  PRO A  52      20.505 -36.025  10.293  1.00 21.30           C  
ATOM    407  CD  PRO A  52      21.933 -35.656  10.568  1.00 20.77           C  
ATOM    408  N   ASN A  53      22.089 -38.757   6.973  1.00 19.40           N  
ATOM    409  CA  ASN A  53      22.392 -38.924   5.555  1.00 19.28           C  
ATOM    410  C   ASN A  53      21.850 -37.761   4.745  1.00 18.92           C  
ATOM    411  O   ASN A  53      20.758 -37.227   5.029  1.00 17.19           O  
ATOM    412  CB  ASN A  53      21.781 -40.222   5.022  1.00 20.98           C  
ATOM    413  CG  ASN A  53      22.299 -41.438   5.746  1.00 22.24           C  
ATOM    414  OD1 ASN A  53      23.457 -41.472   6.145  1.00 22.48           O  
ATOM    415  ND2 ASN A  53      21.448 -42.438   5.932  1.00 22.61           N  
ATOM    416  N   PHE A  54      22.611 -37.384   3.729  1.00 17.91           N  
ATOM    417  CA  PHE A  54      22.253 -36.268   2.884  1.00 18.61           C  
ATOM    418  C   PHE A  54      21.510 -36.731   1.641  1.00 17.49           C  
ATOM    419  O   PHE A  54      21.677 -37.857   1.175  1.00 16.92           O  
ATOM    420  CB  PHE A  54      23.516 -35.541   2.413  1.00 18.40           C  
ATOM    421  CG  PHE A  54      24.130 -34.624   3.433  1.00 19.15           C  
ATOM    422  CD1 PHE A  54      24.920 -35.130   4.462  1.00 18.62           C  
ATOM    423  CD2 PHE A  54      23.952 -33.243   3.341  1.00 19.13           C  
ATOM    424  CE1 PHE A  54      25.505 -34.282   5.384  1.00 18.12           C  
ATOM    425  CE2 PHE A  54      24.538 -32.391   4.264  1.00 17.99           C  
ATOM    426  CZ  PHE A  54      25.318 -32.907   5.281  1.00 18.72           C  
ATOM    427  N   LEU A  55      20.708 -35.827   1.104  1.00 16.69           N  
ATOM    428  CA  LEU A  55      20.403 -35.828  -0.309  1.00 17.19           C  
ATOM    429  C   LEU A  55      21.229 -34.728  -0.957  1.00 17.25           C  
ATOM    430  O   LEU A  55      21.293 -33.595  -0.452  1.00 17.30           O  
ATOM    431  CB  LEU A  55      18.910 -35.590  -0.575  1.00 17.36           C  
ATOM    432  CG  LEU A  55      17.966 -36.699  -0.106  1.00 18.35           C  
ATOM    433  CD1 LEU A  55      16.563 -36.471  -0.654  1.00 19.15           C  
ATOM    434  CD2 LEU A  55      18.456 -38.098  -0.485  1.00 18.58           C  
ATOM    435  N   ASN A  56      21.859 -35.073  -2.074  1.00 17.90           N  
ATOM    436  CA  ASN A  56      22.698 -34.135  -2.825  1.00 18.25           C  
ATOM    437  C   ASN A  56      22.328 -34.152  -4.307  1.00 18.66           C  
ATOM    438  O   ASN A  56      21.985 -35.199  -4.873  1.00 18.78           O  
ATOM    439  CB  ASN A  56      24.187 -34.502  -2.685  1.00 17.19           C  
ATOM    440  CG  ASN A  56      24.790 -34.077  -1.357  1.00 17.10           C  
ATOM    441  OD1 ASN A  56      25.191 -34.912  -0.543  1.00 16.04           O  
ATOM    442  ND2 ASN A  56      24.874 -32.769  -1.137  1.00 18.22           N  
ATOM    443  N   LEU A  57      22.411 -32.981  -4.929  1.00 18.92           N  
ATOM    444  CA  LEU A  57      22.332 -32.856  -6.373  1.00 19.68           C  
ATOM    445  C   LEU A  57      23.183 -31.680  -6.829  1.00 19.50           C  
ATOM    446  O   LEU A  57      23.725 -30.926  -6.003  1.00 20.03           O  
ATOM    447  CB  LEU A  57      20.873 -32.678  -6.836  1.00 20.84           C  
ATOM    448  CG  LEU A  57      20.153 -31.435  -6.318  1.00 24.81           C  
ATOM    449  CD1 LEU A  57      20.384 -30.230  -7.218  1.00 27.11           C  
ATOM    450  CD2 LEU A  57      18.660 -31.669  -6.170  1.00 28.72           C  
ATOM    451  N   CYS A  58      23.305 -31.549  -8.147  1.00 19.29           N  
ATOM    452  CA  CYS A  58      23.905 -30.370  -8.782  1.00 19.91           C  
ATOM    453  C   CYS A  58      22.941 -29.789  -9.785  1.00 19.09           C  
ATOM    454  O   CYS A  58      22.157 -30.522 -10.382  1.00 20.55           O  
ATOM    455  CB  CYS A  58      25.203 -30.747  -9.504  1.00 19.11           C  
ATOM    456  SG  CYS A  58      26.485 -31.306  -8.377  1.00 22.53           S  
ATOM    457  N   VAL A  59      22.992 -28.471  -9.958  1.00 19.18           N  
ATOM    458  CA  VAL A  59      22.252 -27.796 -11.014  1.00 21.08           C  
ATOM    459  C   VAL A  59      23.161 -26.875 -11.804  1.00 21.36           C  
ATOM    460  O   VAL A  59      24.121 -26.308 -11.278  1.00 21.50           O  
ATOM    461  CB  VAL A  59      21.035 -26.980 -10.500  1.00 22.23           C  
ATOM    462  CG1 VAL A  59      20.042 -27.908  -9.826  1.00 24.17           C  
ATOM    463  CG2 VAL A  59      21.452 -25.881  -9.544  1.00 22.36           C  
ATOM    464  N   GLU A  60      22.854 -26.757 -13.084  1.00 21.23           N  
ATOM    465  CA  GLU A  60      23.476 -25.764 -13.929  1.00 20.88           C  
ATOM    466  C   GLU A  60      22.532 -24.592 -13.933  1.00 21.41           C  
ATOM    467  O   GLU A  60      21.314 -24.782 -14.011  1.00 20.14           O  
ATOM    468  CB  GLU A  60      23.617 -26.307 -15.336  1.00 21.33           C  
ATOM    469  CG  GLU A  60      24.271 -25.383 -16.344  1.00 22.49           C  
ATOM    470  CD  GLU A  60      24.115 -25.929 -17.750  1.00 24.76           C  
ATOM    471  OE1 GLU A  60      23.021 -25.772 -18.342  1.00 26.64           O  
ATOM    472  OE2 GLU A  60      25.075 -26.535 -18.249  1.00 25.62           O  
ATOM    473  N   ILE A  61      23.091 -23.390 -13.848  1.00 19.82           N  
ATOM    474  CA  ILE A  61      22.319 -22.183 -14.036  1.00 21.65           C  
ATOM    475  C   ILE A  61      22.940 -21.336 -15.145  1.00 23.59           C  
ATOM    476  O   ILE A  61      24.151 -21.432 -15.425  1.00 22.84           O  
ATOM    477  CB  ILE A  61      22.224 -21.341 -12.752  1.00 21.34           C  
ATOM    478  CG1 ILE A  61      23.615 -20.884 -12.284  1.00 21.89           C  
ATOM    479  CG2 ILE A  61      21.474 -22.111 -11.676  1.00 21.24           C  
ATOM    480  CD1 ILE A  61      23.602 -19.994 -11.065  1.00 21.92           C  
ATOM    481  N   GLN A  62      22.091 -20.553 -15.796  1.00 24.23           N  
ATOM    482  CA  GLN A  62      22.529 -19.441 -16.638  1.00 27.65           C  
ATOM    483  C   GLN A  62      22.274 -18.174 -15.827  1.00 28.91           C  
ATOM    484  O   GLN A  62      21.174 -17.983 -15.290  1.00 29.53           O  
ATOM    485  CB  GLN A  62      21.752 -19.399 -17.956  1.00 29.53           C  
ATOM    486  CG  GLN A  62      21.751 -20.704 -18.737  1.00 31.33           C  
ATOM    487  CD  GLN A  62      23.150 -21.194 -19.054  1.00 35.87           C  
ATOM    488  OE1 GLN A  62      24.010 -20.412 -19.471  1.00 39.47           O  
ATOM    489  NE2 GLN A  62      23.393 -22.490 -18.853  1.00 37.20           N  
ATOM    490  N   THR A  63      23.286 -17.321 -15.709  1.00 27.99           N  
ATOM    491  CA  THR A  63      23.168 -16.165 -14.835  1.00 28.20           C  
ATOM    492  C   THR A  63      23.843 -14.928 -15.395  1.00 28.49           C  
ATOM    493  O   THR A  63      24.824 -15.015 -16.130  1.00 28.14           O  
ATOM    494  CB  THR A  63      23.672 -16.468 -13.401  1.00 27.65           C  
ATOM    495  OG1 THR A  63      23.308 -15.399 -12.529  1.00 27.85           O  
ATOM    496  CG2 THR A  63      25.194 -16.676 -13.335  1.00 28.12           C  
ATOM    497  N   THR A  64      23.261 -13.779 -15.059  1.00 30.88           N  
ATOM    498  CA  THR A  64      23.830 -12.469 -15.366  1.00 30.98           C  
ATOM    499  C   THR A  64      24.379 -11.846 -14.092  1.00 31.37           C  
ATOM    500  O   THR A  64      24.863 -10.719 -14.101  1.00 29.69           O  
ATOM    501  CB  THR A  64      22.755 -11.520 -15.932  1.00 30.26           C  
ATOM    502  OG1 THR A  64      21.675 -11.436 -15.000  1.00 31.35           O  
ATOM    503  CG2 THR A  64      22.239 -12.020 -17.266  1.00 30.82           C  
ATOM    504  N   LEU A  65      24.297 -12.582 -12.988  1.00 30.35           N  
ATOM    505  CA  LEU A  65      24.768 -12.078 -11.717  1.00 29.01           C  
ATOM    506  C   LEU A  65      26.267 -12.250 -11.601  1.00 27.98           C  
ATOM    507  O   LEU A  65      26.850 -13.169 -12.186  1.00 26.73           O  
ATOM    508  CB  LEU A  65      24.085 -12.809 -10.563  1.00 30.54           C  
ATOM    509  CG  LEU A  65      22.569 -12.628 -10.483  1.00 31.28           C  
ATOM    510  CD1 LEU A  65      22.027 -13.455  -9.333  1.00 32.42           C  
ATOM    511  CD2 LEU A  65      22.195 -11.159 -10.315  1.00 32.54           C  
ATOM    512  N   THR A  66      26.881 -11.365 -10.829  1.00 27.72           N  
ATOM    513  CA  THR A  66      28.273 -11.540 -10.443  1.00 28.33           C  
ATOM    514  C   THR A  66      28.355 -12.687  -9.444  1.00 26.94           C  
ATOM    515  O   THR A  66      27.353 -13.095  -8.851  1.00 25.18           O  
ATOM    516  CB  THR A  66      28.850 -10.291  -9.771  1.00 27.58           C  
ATOM    517  OG1 THR A  66      28.123 -10.027  -8.569  1.00 26.86           O  
ATOM    518  CG2 THR A  66      28.779  -9.080 -10.700  1.00 28.22           C  
ATOM    519  N   VAL A  67      29.562 -13.187  -9.239  1.00 25.72           N  
ATOM    520  CA  VAL A  67      29.757 -14.327  -8.365  1.00 26.09           C  
ATOM    521  C   VAL A  67      29.387 -13.987  -6.915  1.00 26.27           C  
ATOM    522  O   VAL A  67      28.861 -14.832  -6.205  1.00 23.31           O  
ATOM    523  CB  VAL A  67      31.186 -14.918  -8.509  1.00 26.37           C  
ATOM    524  CG1 VAL A  67      32.238 -14.028  -7.856  1.00 25.79           C  
ATOM    525  CG2 VAL A  67      31.234 -16.333  -7.951  1.00 27.33           C  
ATOM    526  N   LEU A  68      29.612 -12.745  -6.485  1.00 26.06           N  
ATOM    527  CA  LEU A  68      29.206 -12.345  -5.135  1.00 28.60           C  
ATOM    528  C   LEU A  68      27.686 -12.188  -4.991  1.00 26.94           C  
ATOM    529  O   LEU A  68      27.136 -12.528  -3.952  1.00 26.55           O  
ATOM    530  CB  LEU A  68      29.929 -11.076  -4.673  1.00 33.24           C  
ATOM    531  CG  LEU A  68      31.449 -11.216  -4.465  1.00 37.29           C  
ATOM    532  CD1 LEU A  68      32.090  -9.845  -4.270  1.00 37.36           C  
ATOM    533  CD2 LEU A  68      31.784 -12.146  -3.301  1.00 37.41           C  
ATOM    534  N   GLN A  69      27.019 -11.688  -6.026  1.00 26.91           N  
ATOM    535  CA  GLN A  69      25.552 -11.628  -6.039  1.00 27.51           C  
ATOM    536  C   GLN A  69      24.962 -13.031  -6.042  1.00 27.60           C  
ATOM    537  O   GLN A  69      23.994 -13.310  -5.343  1.00 28.19           O  
ATOM    538  CB  GLN A  69      25.059 -10.898  -7.270  1.00 28.91           C  
ATOM    539  CG  GLN A  69      25.310  -9.406  -7.220  1.00 30.30           C  
ATOM    540  CD  GLN A  69      25.100  -8.748  -8.561  1.00 31.36           C  
ATOM    541  OE1 GLN A  69      25.136  -9.398  -9.607  1.00 31.79           O  
ATOM    542  NE2 GLN A  69      24.871  -7.440  -8.539  1.00 36.37           N  
ATOM    543  N   LEU A  70      25.557 -13.907  -6.840  1.00 26.53           N  
ATOM    544  CA  LEU A  70      25.175 -15.302  -6.844  1.00 26.09           C  
ATOM    545  C   LEU A  70      25.292 -15.882  -5.434  1.00 25.57           C  
ATOM    546  O   LEU A  70      24.357 -16.531  -4.953  1.00 26.25           O  
ATOM    547  CB  LEU A  70      26.024 -16.092  -7.838  1.00 24.71           C  
ATOM    548  CG  LEU A  70      25.702 -17.581  -7.963  1.00 24.12           C  
ATOM    549  CD1 LEU A  70      24.229 -17.787  -8.286  1.00 23.77           C  
ATOM    550  CD2 LEU A  70      26.601 -18.196  -9.029  1.00 24.23           C  
ATOM    551  N   LEU A  71      26.414 -15.619  -4.761  1.00 25.69           N  
ATOM    552  CA  LEU A  71      26.607 -16.098  -3.392  1.00 27.38           C  
ATOM    553  C   LEU A  71      25.505 -15.606  -2.451  1.00 29.38           C  
ATOM    554  O   LEU A  71      24.967 -16.397  -1.666  1.00 27.80           O  
ATOM    555  CB  LEU A  71      27.981 -15.717  -2.832  1.00 27.71           C  
ATOM    556  CG  LEU A  71      28.243 -16.168  -1.388  1.00 29.35           C  
ATOM    557  CD1 LEU A  71      28.249 -17.691  -1.275  1.00 30.11           C  
ATOM    558  CD2 LEU A  71      29.550 -15.608  -0.847  1.00 29.17           C  
ATOM    559  N  AGLU A  72      25.178 -14.312  -2.526  0.50 29.35           N  
ATOM    560  CA AGLU A  72      24.063 -13.739  -1.759  0.50 30.99           C  
ATOM    561  C  AGLU A  72      22.770 -14.513  -1.989  0.50 30.18           C  
ATOM    562  O  AGLU A  72      22.044 -14.818  -1.041  0.50 29.75           O  
ATOM    563  CB AGLU A  72      23.818 -12.275  -2.141  0.50 33.56           C  
ATOM    564  CG AGLU A  72      24.905 -11.309  -1.711  0.50 35.71           C  
ATOM    565  CD AGLU A  72      24.819  -9.976  -2.438  0.50 39.68           C  
ATOM    566  OE1AGLU A  72      23.692  -9.485  -2.666  0.50 43.04           O  
ATOM    567  OE2AGLU A  72      25.883  -9.417  -2.781  0.50 41.65           O  
ATOM    568  N  BGLU A  72      25.199 -14.312  -2.521  0.50 29.51           N  
ATOM    569  CA BGLU A  72      24.094 -13.739  -1.761  0.50 31.82           C  
ATOM    570  C  BGLU A  72      22.786 -14.506  -1.991  0.50 30.55           C  
ATOM    571  O  BGLU A  72      22.073 -14.817  -1.035  0.50 30.04           O  
ATOM    572  CB BGLU A  72      23.904 -12.262  -2.119  0.50 35.45           C  
ATOM    573  CG BGLU A  72      22.794 -11.593  -1.329  0.50 39.56           C  
ATOM    574  CD BGLU A  72      22.598 -10.132  -1.693  0.50 44.66           C  
ATOM    575  OE1BGLU A  72      23.286  -9.641  -2.615  0.50 48.98           O  
ATOM    576  OE2BGLU A  72      21.752  -9.472  -1.052  0.50 47.51           O  
ATOM    577  N   CYS A  73      22.480 -14.813  -3.251  1.00 30.63           N  
ATOM    578  CA  CYS A  73      21.257 -15.554  -3.604  1.00 31.14           C  
ATOM    579  C   CYS A  73      21.269 -16.981  -3.062  1.00 30.77           C  
ATOM    580  O   CYS A  73      20.230 -17.494  -2.646  1.00 29.94           O  
ATOM    581  CB  CYS A  73      21.035 -15.584  -5.117  1.00 33.59           C  
ATOM    582  SG  CYS A  73      20.653 -13.973  -5.854  1.00 38.24           S  
ATOM    583  N   CYS A  74      22.440 -17.615  -3.079  1.00 28.76           N  
ATOM    584  CA  CYS A  74      22.619 -18.927  -2.462  1.00 27.99           C  
ATOM    585  C   CYS A  74      22.325 -18.887  -0.959  1.00 29.33           C  
ATOM    586  O   CYS A  74      21.592 -19.744  -0.434  1.00 26.95           O  
ATOM    587  CB  CYS A  74      24.031 -19.461  -2.729  1.00 28.38           C  
ATOM    588  SG  CYS A  74      24.327 -19.867  -4.473  1.00 30.83           S  
ATOM    589  N   LEU A  75      22.872 -17.882  -0.279  1.00 27.46           N  
ATOM    590  CA  LEU A  75      22.700 -17.742   1.166  1.00 29.26           C  
ATOM    591  C   LEU A  75      21.271 -17.345   1.528  1.00 28.98           C  
ATOM    592  O   LEU A  75      20.724 -17.865   2.499  1.00 27.20           O  
ATOM    593  CB  LEU A  75      23.699 -16.738   1.751  1.00 30.61           C  
ATOM    594  CG  LEU A  75      25.172 -17.125   1.570  1.00 32.76           C  
ATOM    595  CD1 LEU A  75      26.077 -16.014   2.077  1.00 33.38           C  
ATOM    596  CD2 LEU A  75      25.503 -18.444   2.253  1.00 33.32           C  
ATOM    597  N   LYS A  76      20.677 -16.437   0.752  1.00 28.89           N  
ATOM    598  CA  LYS A  76      19.251 -16.101   0.909  1.00 30.62           C  
ATOM    599  C   LYS A  76      18.329 -17.315   0.734  1.00 28.32           C  
ATOM    600  O   LYS A  76      17.313 -17.422   1.414  1.00 29.98           O  
ATOM    601  CB  LYS A  76      18.819 -15.010  -0.075  1.00 32.96           C  
ATOM    602  CG  LYS A  76      18.980 -13.589   0.450  1.00 40.15           C  
ATOM    603  CD  LYS A  76      18.291 -12.563  -0.452  1.00 43.45           C  
ATOM    604  CE  LYS A  76      19.136 -12.197  -1.666  1.00 44.80           C  
ATOM    605  NZ  LYS A  76      18.377 -11.447  -2.708  1.00 46.51           N  
ATOM    606  N   THR A  77      18.659 -18.203  -0.196  1.00 26.53           N  
ATOM    607  CA  THR A  77      17.852 -19.410  -0.420  1.00 26.66           C  
ATOM    608  C   THR A  77      17.906 -20.312   0.816  1.00 27.32           C  
ATOM    609  O   THR A  77      16.883 -20.857   1.248  1.00 25.74           O  
ATOM    610  CB  THR A  77      18.292 -20.172  -1.688  1.00 25.82           C  
ATOM    611  OG1 THR A  77      18.185 -19.307  -2.819  1.00 26.78           O  
ATOM    612  CG2 THR A  77      17.417 -21.393  -1.955  1.00 25.12           C  
ATOM    613  N   GLU A  78      19.094 -20.450   1.400  1.00 26.38           N  
ATOM    614  CA  GLU A  78      19.247 -21.204   2.642  1.00 26.43           C  
ATOM    615  C   GLU A  78      18.380 -20.610   3.771  1.00 27.92           C  
ATOM    616  O   GLU A  78      17.740 -21.348   4.534  1.00 24.65           O  
ATOM    617  CB  GLU A  78      20.717 -21.246   3.067  1.00 26.29           C  
ATOM    618  CG  GLU A  78      21.598 -22.059   2.136  1.00 26.42           C  
ATOM    619  CD  GLU A  78      23.063 -22.028   2.546  1.00 28.25           C  
ATOM    620  OE1 GLU A  78      23.385 -21.512   3.636  1.00 29.20           O  
ATOM    621  OE2 GLU A  78      23.899 -22.530   1.777  1.00 30.94           O  
ATOM    622  N   GLU A  79      18.358 -19.285   3.870  1.00 28.83           N  
ATOM    623  CA  GLU A  79      17.521 -18.614   4.867  1.00 32.18           C  
ATOM    624  C   GLU A  79      16.043 -18.916   4.619  1.00 30.53           C  
ATOM    625  O   GLU A  79      15.305 -19.199   5.553  1.00 30.04           O  
ATOM    626  CB  GLU A  79      17.723 -17.097   4.835  1.00 36.76           C  
ATOM    627  CG  GLU A  79      19.114 -16.599   5.192  1.00 41.74           C  
ATOM    628  CD  GLU A  79      19.303 -15.135   4.807  1.00 51.31           C  
ATOM    629  OE1 GLU A  79      18.323 -14.361   4.917  1.00 52.79           O  
ATOM    630  OE2 GLU A  79      20.422 -14.754   4.386  1.00 57.33           O  
ATOM    631  N   CYS A  80      15.619 -18.852   3.361  1.00 31.41           N  
ATOM    632  CA  CYS A  80      14.241 -19.168   2.994  1.00 33.90           C  
ATOM    633  C   CYS A  80      13.851 -20.579   3.413  1.00 33.79           C  
ATOM    634  O   CYS A  80      12.705 -20.818   3.778  1.00 30.10           O  
ATOM    635  CB  CYS A  80      14.024 -19.026   1.489  1.00 36.51           C  
ATOM    636  SG  CYS A  80      14.162 -17.329   0.887  1.00 43.81           S  
ATOM    637  N   LEU A  81      14.802 -21.511   3.366  1.00 30.67           N  
ATOM    638  CA  LEU A  81      14.530 -22.893   3.776  1.00 29.95           C  
ATOM    639  C   LEU A  81      14.852 -23.127   5.257  1.00 28.29           C  
ATOM    640  O   LEU A  81      14.990 -24.270   5.706  1.00 30.11           O  
ATOM    641  CB  LEU A  81      15.265 -23.890   2.865  1.00 30.22           C  
ATOM    642  CG  LEU A  81      14.533 -24.390   1.603  1.00 32.60           C  
ATOM    643  CD1 LEU A  81      13.192 -25.043   1.924  1.00 33.00           C  
ATOM    644  CD2 LEU A  81      14.339 -23.290   0.572  1.00 32.10           C  
ATOM    645  N   HIS A  82      14.957 -22.032   6.007  1.00 28.02           N  
ATOM    646  CA  HIS A  82      15.030 -22.054   7.470  1.00 30.14           C  
ATOM    647  C   HIS A  82      16.279 -22.743   7.983  1.00 29.73           C  
ATOM    648  O   HIS A  82      16.228 -23.473   8.972  1.00 29.24           O  
ATOM    649  CB  HIS A  82      13.766 -22.688   8.075  1.00 33.15           C  
ATOM    650  CG  HIS A  82      12.499 -22.145   7.499  1.00 36.94           C  
ATOM    651  ND1 HIS A  82      12.090 -20.845   7.707  1.00 39.61           N  
ATOM    652  CD2 HIS A  82      11.564 -22.711   6.699  1.00 40.63           C  
ATOM    653  CE1 HIS A  82      10.952 -20.635   7.070  1.00 40.33           C  
ATOM    654  NE2 HIS A  82      10.611 -21.752   6.451  1.00 43.97           N  
ATOM    655  N   ARG A  83      17.404 -22.520   7.305  1.00 28.63           N  
ATOM    656  CA  ARG A  83      18.670 -22.990   7.829  1.00 28.32           C  
ATOM    657  C   ARG A  83      19.010 -22.140   9.035  1.00 30.22           C  
ATOM    658  O   ARG A  83      19.322 -20.955   8.907  1.00 29.22           O  
ATOM    659  CB  ARG A  83      19.804 -22.927   6.809  1.00 26.62           C  
ATOM    660  CG  ARG A  83      21.098 -23.465   7.391  1.00 26.13           C  
ATOM    661  CD  ARG A  83      22.242 -23.439   6.412  1.00 25.36           C  
ATOM    662  NE  ARG A  83      23.455 -23.979   7.014  1.00 26.02           N  
ATOM    663  CZ  ARG A  83      24.608 -24.152   6.368  1.00 26.89           C  
ATOM    664  NH1 ARG A  83      24.724 -23.826   5.084  1.00 26.00           N  
ATOM    665  NH2 ARG A  83      25.658 -24.646   7.014  1.00 27.74           N  
ATOM    666  N   ILE A  84      18.943 -22.756  10.207  1.00 32.09           N  
ATOM    667  CA  ILE A  84      19.197 -22.059  11.461  1.00 35.87           C  
ATOM    668  C   ILE A  84      20.602 -22.389  11.932  1.00 35.86           C  
ATOM    669  O   ILE A  84      21.344 -21.504  12.334  1.00 35.61           O  
ATOM    670  CB  ILE A  84      18.144 -22.426  12.529  1.00 39.16           C  
ATOM    671  CG1 ILE A  84      16.771 -21.894  12.094  1.00 42.22           C  
ATOM    672  CG2 ILE A  84      18.517 -21.827  13.882  1.00 42.04           C  
ATOM    673  CD1 ILE A  84      15.600 -22.409  12.908  1.00 45.55           C  
ATOM    674  N   ARG A  85      20.965 -23.664  11.877  1.00 35.28           N  
ATOM    675  CA  ARG A  85      22.319 -24.079  12.214  1.00 35.33           C  
ATOM    676  C   ARG A  85      23.333 -23.418  11.285  1.00 39.11           C  
ATOM    677  O   ARG A  85      23.159 -23.431  10.063  1.00 38.12           O  
ATOM    678  CB  ARG A  85      22.460 -25.592  12.091  1.00 34.95           C  
ATOM    679  CG  ARG A  85      21.629 -26.397  13.075  1.00 34.56           C  
ATOM    680  CD  ARG A  85      21.755 -27.877  12.748  1.00 33.58           C  
ATOM    681  NE  ARG A  85      21.246 -28.711  13.823  1.00 30.94           N  
ATOM    682  CZ  ARG A  85      20.001 -29.159  13.923  1.00 28.76           C  
ATOM    683  NH1 ARG A  85      19.086 -28.867  13.008  1.00 29.51           N  
ATOM    684  NH2 ARG A  85      19.673 -29.907  14.966  1.00 28.26           N  
ATOM    685  N   LYS A  86      24.393 -22.860  11.864  1.00 41.42           N  
ATOM    686  CA  LYS A  86      25.489 -22.292  11.076  1.00 45.21           C  
ATOM    687  C   LYS A  86      26.854 -22.947  11.367  1.00 44.58           C  
ATOM    688  O   LYS A  86      27.889 -22.462  10.898  1.00 44.00           O  
ATOM    689  CB  LYS A  86      25.546 -20.772  11.276  1.00 47.67           C  
ATOM    690  CG  LYS A  86      24.264 -20.032  10.880  1.00 50.29           C  
ATOM    691  CD  LYS A  86      23.808 -20.282   9.439  1.00 55.12           C  
ATOM    692  CE  LYS A  86      24.902 -20.009   8.411  1.00 60.40           C  
ATOM    693  NZ  LYS A  86      24.363 -19.816   7.032  1.00 62.82           N  
ATOM    694  N   GLU A  87      26.858 -24.057  12.106  1.00 39.59           N  
ATOM    695  CA  GLU A  87      28.089 -24.817  12.321  1.00 38.52           C  
ATOM    696  C   GLU A  87      28.409 -25.512  11.006  1.00 36.55           C  
ATOM    697  O   GLU A  87      27.614 -26.325  10.511  1.00 34.20           O  
ATOM    698  CB  GLU A  87      27.951 -25.852  13.446  1.00 39.70           C  
ATOM    699  CG  GLU A  87      27.665 -25.259  14.819  1.00 40.41           C  
ATOM    700  CD  GLU A  87      26.234 -24.752  14.972  1.00 43.13           C  
ATOM    701  OE1 GLU A  87      25.324 -25.270  14.282  1.00 41.39           O  
ATOM    702  OE2 GLU A  87      26.013 -23.824  15.781  1.00 47.06           O  
ATOM    703  N   ARG A  88      29.565 -25.179  10.437  1.00 32.17           N  
ATOM    704  CA  ARG A  88      29.966 -25.685   9.127  1.00 32.30           C  
ATOM    705  C   ARG A  88      29.971 -27.209   9.084  1.00 29.33           C  
ATOM    706  O   ARG A  88      29.634 -27.813   8.070  1.00 30.13           O  
ATOM    707  CB  ARG A  88      31.365 -25.163   8.762  1.00 35.13           C  
ATOM    708  CG  ARG A  88      31.445 -23.650   8.574  1.00 38.26           C  
ATOM    709  CD  ARG A  88      32.884 -23.225   8.322  1.00 38.50           C  
ATOM    710  NE  ARG A  88      33.390 -23.802   7.079  1.00 38.05           N  
ATOM    711  CZ  ARG A  88      33.424 -23.179   5.902  1.00 41.08           C  
ATOM    712  NH1 ARG A  88      32.990 -21.925   5.775  1.00 41.54           N  
ATOM    713  NH2 ARG A  88      33.904 -23.815   4.835  1.00 41.16           N  
ATOM    714  N   TRP A  89      30.376 -27.819  10.192  1.00 27.99           N  
ATOM    715  CA  TRP A  89      30.471 -29.280  10.287  1.00 28.79           C  
ATOM    716  C   TRP A  89      29.120 -29.962  10.537  1.00 27.57           C  
ATOM    717  O   TRP A  89      29.008 -31.179  10.392  1.00 29.21           O  
ATOM    718  CB  TRP A  89      31.456 -29.678  11.398  1.00 28.51           C  
ATOM    719  CG  TRP A  89      31.182 -29.036  12.737  1.00 29.56           C  
ATOM    720  CD1 TRP A  89      31.777 -27.911  13.246  1.00 30.34           C  
ATOM    721  CD2 TRP A  89      30.243 -29.476  13.730  1.00 30.42           C  
ATOM    722  NE1 TRP A  89      31.264 -27.624  14.484  1.00 32.25           N  
ATOM    723  CE2 TRP A  89      30.323 -28.570  14.809  1.00 32.57           C  
ATOM    724  CE3 TRP A  89      29.338 -30.548  13.809  1.00 31.81           C  
ATOM    725  CZ2 TRP A  89      29.534 -28.702  15.961  1.00 33.94           C  
ATOM    726  CZ3 TRP A  89      28.552 -30.679  14.952  1.00 31.87           C  
ATOM    727  CH2 TRP A  89      28.655 -29.760  16.011  1.00 33.58           C  
ATOM    728  N   GLY A  90      28.112 -29.176  10.916  1.00 25.24           N  
ATOM    729  CA  GLY A  90      26.854 -29.708  11.422  1.00 25.61           C  
ATOM    730  C   GLY A  90      25.778 -29.832  10.361  1.00 24.70           C  
ATOM    731  O   GLY A  90      25.970 -29.409   9.232  1.00 25.46           O  
ATOM    732  N   PRO A  91      24.622 -30.409  10.731  1.00 24.52           N  
ATOM    733  CA  PRO A  91      23.539 -30.628   9.761  1.00 24.10           C  
ATOM    734  C   PRO A  91      22.855 -29.344   9.315  1.00 22.83           C  
ATOM    735  O   PRO A  91      23.008 -28.303   9.955  1.00 25.15           O  
ATOM    736  CB  PRO A  91      22.556 -31.534  10.511  1.00 24.02           C  
ATOM    737  CG  PRO A  91      22.918 -31.441  11.951  1.00 25.06           C  
ATOM    738  CD  PRO A  91      24.363 -31.052  12.033  1.00 23.90           C  
ATOM    739  N   ARG A  92      22.103 -29.431   8.221  1.00 22.04           N  
ATOM    740  CA  ARG A  92      21.396 -28.274   7.676  1.00 21.51           C  
ATOM    741  C   ARG A  92      20.204 -28.665   6.798  1.00 20.47           C  
ATOM    742  O   ARG A  92      20.240 -29.666   6.061  1.00 20.26           O  
ATOM    743  CB  ARG A  92      22.358 -27.340   6.907  1.00 21.28           C  
ATOM    744  CG  ARG A  92      22.869 -27.854   5.565  1.00 20.72           C  
ATOM    745  CD  ARG A  92      23.833 -29.030   5.687  1.00 21.12           C  
ATOM    746  NE  ARG A  92      24.945 -28.707   6.577  1.00 22.50           N  
ATOM    747  CZ  ARG A  92      26.092 -28.129   6.204  1.00 23.04           C  
ATOM    748  NH1 ARG A  92      26.322 -27.810   4.932  1.00 23.08           N  
ATOM    749  NH2 ARG A  92      27.018 -27.863   7.120  1.00 22.04           N  
ATOM    750  N   THR A  93      19.149 -27.860   6.885  1.00 21.67           N  
ATOM    751  CA  THR A  93      17.964 -28.026   6.031  1.00 22.67           C  
ATOM    752  C   THR A  93      18.293 -27.848   4.551  1.00 22.28           C  
ATOM    753  O   THR A  93      17.718 -28.516   3.692  1.00 22.05           O  
ATOM    754  CB  THR A  93      16.850 -27.019   6.386  1.00 22.92           C  
ATOM    755  OG1 THR A  93      17.362 -25.682   6.295  1.00 24.30           O  
ATOM    756  CG2 THR A  93      16.308 -27.263   7.788  1.00 23.59           C  
ATOM    757  N   LEU A  94      19.196 -26.917   4.258  1.00 22.03           N  
ATOM    758  CA  LEU A  94      19.621 -26.661   2.896  1.00 20.55           C  
ATOM    759  C   LEU A  94      21.018 -26.041   2.869  1.00 20.49           C  
ATOM    760  O   LEU A  94      21.344 -25.177   3.683  1.00 22.38           O  
ATOM    761  CB  LEU A  94      18.635 -25.732   2.170  1.00 20.56           C  
ATOM    762  CG  LEU A  94      18.986 -25.460   0.703  1.00 20.51           C  
ATOM    763  CD1 LEU A  94      18.753 -26.692  -0.154  1.00 20.29           C  
ATOM    764  CD2 LEU A  94      18.241 -24.254   0.131  1.00 22.47           C  
ATOM    765  N   ASP A  95      21.814 -26.495   1.911  1.00 19.54           N  
ATOM    766  CA  ASP A  95      23.155 -25.971   1.642  1.00 18.93           C  
ATOM    767  C   ASP A  95      23.238 -25.741   0.140  1.00 18.23           C  
ATOM    768  O   ASP A  95      22.926 -26.634  -0.637  1.00 18.78           O  
ATOM    769  CB  ASP A  95      24.206 -26.993   2.077  1.00 18.30           C  
ATOM    770  CG  ASP A  95      25.630 -26.486   1.903  1.00 18.43           C  
ATOM    771  OD1 ASP A  95      25.869 -25.283   2.095  1.00 17.20           O  
ATOM    772  OD2 ASP A  95      26.515 -27.303   1.569  1.00 19.14           O  
ATOM    773  N   VAL A  96      23.599 -24.526  -0.262  1.00 18.12           N  
ATOM    774  CA  VAL A  96      23.764 -24.186  -1.667  1.00 17.74           C  
ATOM    775  C   VAL A  96      25.180 -23.656  -1.867  1.00 18.12           C  
ATOM    776  O   VAL A  96      25.519 -22.566  -1.397  1.00 18.96           O  
ATOM    777  CB  VAL A  96      22.756 -23.111  -2.118  1.00 18.45           C  
ATOM    778  CG1 VAL A  96      22.870 -22.845  -3.614  1.00 18.83           C  
ATOM    779  CG2 VAL A  96      21.339 -23.542  -1.772  1.00 19.29           C  
ATOM    780  N   ASP A  97      25.986 -24.429  -2.584  1.00 18.12           N  
ATOM    781  CA  ASP A  97      27.401 -24.138  -2.778  1.00 18.01           C  
ATOM    782  C   ASP A  97      27.654 -23.797  -4.235  1.00 18.29           C  
ATOM    783  O   ASP A  97      27.124 -24.454  -5.130  1.00 17.76           O  
ATOM    784  CB  ASP A  97      28.245 -25.352  -2.370  1.00 18.04           C  
ATOM    785  CG  ASP A  97      28.212 -25.617  -0.872  1.00 17.05           C  
ATOM    786  OD1 ASP A  97      27.830 -24.720  -0.101  1.00 16.24           O  
ATOM    787  OD2 ASP A  97      28.558 -26.739  -0.439  1.00 17.49           O  
ATOM    788  N   ILE A  98      28.448 -22.757  -4.482  1.00 17.98           N  
ATOM    789  CA  ILE A  98      28.879 -22.466  -5.840  1.00 18.21           C  
ATOM    790  C   ILE A  98      30.061 -23.363  -6.179  1.00 18.38           C  
ATOM    791  O   ILE A  98      31.117 -23.269  -5.547  1.00 19.82           O  
ATOM    792  CB  ILE A  98      29.294 -20.997  -6.039  1.00 18.97           C  
ATOM    793  CG1 ILE A  98      28.118 -20.057  -5.724  1.00 20.35           C  
ATOM    794  CG2 ILE A  98      29.752 -20.796  -7.479  1.00 17.82           C  
ATOM    795  CD1 ILE A  98      28.518 -18.599  -5.570  1.00 21.75           C  
ATOM    796  N   LEU A  99      29.887 -24.222  -7.178  1.00 18.14           N  
ATOM    797  CA  LEU A  99      30.916 -25.176  -7.565  1.00 18.48           C  
ATOM    798  C   LEU A  99      31.830 -24.622  -8.644  1.00 18.29           C  
ATOM    799  O   LEU A  99      33.047 -24.758  -8.553  1.00 18.49           O  
ATOM    800  CB  LEU A  99      30.277 -26.475  -8.054  1.00 18.89           C  
ATOM    801  CG  LEU A  99      29.404 -27.188  -7.032  1.00 19.61           C  
ATOM    802  CD1 LEU A  99      28.769 -28.415  -7.667  1.00 21.05           C  
ATOM    803  CD2 LEU A  99      30.201 -27.578  -5.798  1.00 20.02           C  
ATOM    804  N   LEU A 100      31.217 -24.042  -9.671  1.00 18.35           N  
ATOM    805  CA  LEU A 100      31.909 -23.507 -10.840  1.00 19.01           C  
ATOM    806  C   LEU A 100      31.179 -22.255 -11.286  1.00 20.13           C  
ATOM    807  O   LEU A 100      29.936 -22.177 -11.210  1.00 18.76           O  
ATOM    808  CB  LEU A 100      31.908 -24.518 -11.988  1.00 20.11           C  
ATOM    809  CG  LEU A 100      32.622 -25.853 -11.753  1.00 21.59           C  
ATOM    810  CD1 LEU A 100      32.269 -26.858 -12.834  1.00 21.87           C  
ATOM    811  CD2 LEU A 100      34.133 -25.636 -11.695  1.00 21.73           C  
ATOM    812  N   TYR A 101      31.950 -21.271 -11.736  1.00 20.16           N  
ATOM    813  CA  TYR A 101      31.404 -20.039 -12.291  1.00 22.26           C  
ATOM    814  C   TYR A 101      32.171 -19.772 -13.593  1.00 23.23           C  
ATOM    815  O   TYR A 101      33.257 -19.186 -13.590  1.00 22.77           O  
ATOM    816  CB  TYR A 101      31.540 -18.907 -11.274  1.00 22.37           C  
ATOM    817  CG  TYR A 101      30.905 -17.601 -11.694  1.00 23.03           C  
ATOM    818  CD1 TYR A 101      31.625 -16.665 -12.431  1.00 24.97           C  
ATOM    819  CD2 TYR A 101      29.598 -17.288 -11.336  1.00 23.31           C  
ATOM    820  CE1 TYR A 101      31.060 -15.458 -12.812  1.00 24.80           C  
ATOM    821  CE2 TYR A 101      29.019 -16.081 -11.708  1.00 23.72           C  
ATOM    822  CZ  TYR A 101      29.757 -15.167 -12.447  1.00 25.25           C  
ATOM    823  OH  TYR A 101      29.210 -13.959 -12.830  1.00 23.09           O  
ATOM    824  N   GLY A 102      31.617 -20.266 -14.700  1.00 23.64           N  
ATOM    825  CA  GLY A 102      32.360 -20.387 -15.952  1.00 24.24           C  
ATOM    826  C   GLY A 102      33.683 -21.098 -15.703  1.00 24.19           C  
ATOM    827  O   GLY A 102      33.743 -22.074 -14.956  1.00 23.33           O  
ATOM    828  N   GLU A 103      34.760 -20.590 -16.296  1.00 23.78           N  
ATOM    829  CA  GLU A 103      36.099 -21.131 -16.043  1.00 24.62           C  
ATOM    830  C   GLU A 103      36.884 -20.231 -15.098  1.00 23.00           C  
ATOM    831  O   GLU A 103      38.101 -20.344 -15.000  1.00 22.91           O  
ATOM    832  CB  GLU A 103      36.849 -21.313 -17.371  1.00 25.86           C  
ATOM    833  CG  GLU A 103      36.290 -22.443 -18.219  1.00 28.51           C  
ATOM    834  CD  GLU A 103      36.535 -23.804 -17.592  1.00 29.52           C  
ATOM    835  OE1 GLU A 103      37.698 -24.071 -17.202  1.00 31.23           O  
ATOM    836  OE2 GLU A 103      35.574 -24.603 -17.490  1.00 29.95           O  
ATOM    837  N   GLU A 104      36.183 -19.355 -14.384  1.00 23.02           N  
ATOM    838  CA  GLU A 104      36.835 -18.404 -13.499  1.00 23.88           C  
ATOM    839  C   GLU A 104      37.313 -19.065 -12.206  1.00 24.47           C  
ATOM    840  O   GLU A 104      36.730 -20.042 -11.738  1.00 20.83           O  
ATOM    841  CB  GLU A 104      35.899 -17.234 -13.171  1.00 24.06           C  
ATOM    842  CG  GLU A 104      35.479 -16.412 -14.389  1.00 25.21           C  
ATOM    843  CD  GLU A 104      36.593 -15.532 -14.961  1.00 26.54           C  
ATOM    844  OE1 GLU A 104      37.727 -15.542 -14.437  1.00 26.40           O  
ATOM    845  OE2 GLU A 104      36.331 -14.807 -15.936  1.00 27.62           O  
ATOM    846  N   MET A 105      38.384 -18.510 -11.645  1.00 23.91           N  
ATOM    847  CA  MET A 105      38.927 -18.955 -10.370  1.00 24.35           C  
ATOM    848  C   MET A 105      39.080 -17.762  -9.438  1.00 24.60           C  
ATOM    849  O   MET A 105      39.503 -16.674  -9.860  1.00 25.43           O  
ATOM    850  CB  MET A 105      40.296 -19.606 -10.562  1.00 26.74           C  
ATOM    851  CG  MET A 105      40.285 -20.848 -11.429  1.00 29.84           C  
ATOM    852  SD  MET A 105      41.924 -21.592 -11.596  1.00 34.90           S  
ATOM    853  CE  MET A 105      42.806 -20.263 -12.407  1.00 36.23           C  
ATOM    854  N   ILE A 106      38.730 -17.970  -8.173  1.00 22.92           N  
ATOM    855  CA  ILE A 106      38.876 -16.949  -7.145  1.00 24.72           C  
ATOM    856  C   ILE A 106      39.044 -17.633  -5.787  1.00 24.53           C  
ATOM    857  O   ILE A 106      38.394 -18.649  -5.503  1.00 22.42           O  
ATOM    858  CB  ILE A 106      37.687 -15.949  -7.163  1.00 25.28           C  
ATOM    859  CG1 ILE A 106      38.017 -14.703  -6.341  1.00 28.85           C  
ATOM    860  CG2 ILE A 106      36.398 -16.586  -6.665  1.00 25.61           C  
ATOM    861  CD1 ILE A 106      37.032 -13.565  -6.523  1.00 29.79           C  
ATOM    862  N   ASP A 107      39.945 -17.094  -4.974  1.00 24.36           N  
ATOM    863  CA  ASP A 107      40.190 -17.596  -3.630  1.00 25.65           C  
ATOM    864  C   ASP A 107      40.253 -16.441  -2.646  1.00 26.93           C  
ATOM    865  O   ASP A 107      41.315 -16.134  -2.105  1.00 25.90           O  
ATOM    866  CB  ASP A 107      41.490 -18.405  -3.587  1.00 27.42           C  
ATOM    867  CG  ASP A 107      41.324 -19.786  -4.173  1.00 30.52           C  
ATOM    868  OD1 ASP A 107      40.569 -20.598  -3.590  1.00 32.27           O  
ATOM    869  OD2 ASP A 107      41.947 -20.061  -5.217  1.00 30.30           O  
ATOM    870  N   LEU A 108      39.106 -15.794  -2.452  1.00 27.17           N  
ATOM    871  CA  LEU A 108      38.923 -14.795  -1.403  1.00 28.29           C  
ATOM    872  C   LEU A 108      38.849 -15.518  -0.072  1.00 29.60           C  
ATOM    873  O   LEU A 108      38.449 -16.681  -0.026  1.00 25.83           O  
ATOM    874  CB  LEU A 108      37.619 -14.027  -1.611  1.00 28.29           C  
ATOM    875  CG  LEU A 108      37.651 -12.920  -2.661  1.00 31.18           C  
ATOM    876  CD1 LEU A 108      36.239 -12.574  -3.113  1.00 30.46           C  
ATOM    877  CD2 LEU A 108      38.354 -11.687  -2.106  1.00 32.71           C  
ATOM    878  N   PRO A 109      39.216 -14.835   1.029  1.00 32.57           N  
ATOM    879  CA  PRO A 109      39.144 -15.488   2.335  1.00 32.68           C  
ATOM    880  C   PRO A 109      37.809 -16.192   2.608  1.00 32.50           C  
ATOM    881  O   PRO A 109      37.802 -17.230   3.243  1.00 34.84           O  
ATOM    882  CB  PRO A 109      39.365 -14.328   3.312  1.00 35.14           C  
ATOM    883  CG  PRO A 109      40.246 -13.383   2.564  1.00 35.42           C  
ATOM    884  CD  PRO A 109      39.837 -13.498   1.114  1.00 34.74           C  
ATOM    885  N   LYS A 110      36.702 -15.647   2.110  1.00 34.73           N  
ATOM    886  CA  LYS A 110      35.374 -16.214   2.343  1.00 35.68           C  
ATOM    887  C   LYS A 110      34.695 -16.750   1.079  1.00 33.62           C  
ATOM    888  O   LYS A 110      33.496 -17.020   1.091  1.00 33.20           O  
ATOM    889  CB  LYS A 110      34.473 -15.144   2.956  1.00 42.96           C  
ATOM    890  CG  LYS A 110      34.813 -14.778   4.390  1.00 49.70           C  
ATOM    891  CD  LYS A 110      33.930 -13.632   4.864  1.00 54.90           C  
ATOM    892  CE  LYS A 110      33.821 -13.579   6.379  1.00 59.49           C  
ATOM    893  NZ  LYS A 110      32.834 -12.547   6.806  1.00 62.33           N  
ATOM    894  N   LEU A 111      35.436 -16.886  -0.017  1.00 30.82           N  
ATOM    895  CA  LEU A 111      34.839 -17.385  -1.264  1.00 28.50           C  
ATOM    896  C   LEU A 111      35.896 -17.977  -2.172  1.00 26.54           C  
ATOM    897  O   LEU A 111      36.774 -17.257  -2.670  1.00 23.34           O  
ATOM    898  CB  LEU A 111      34.071 -16.283  -1.994  1.00 28.64           C  
ATOM    899  CG  LEU A 111      33.384 -16.692  -3.309  1.00 30.62           C  
ATOM    900  CD1 LEU A 111      32.369 -17.814  -3.099  1.00 30.81           C  
ATOM    901  CD2 LEU A 111      32.699 -15.499  -3.946  1.00 32.70           C  
ATOM    902  N   SER A 112      35.828 -19.299  -2.337  1.00 23.98           N  
ATOM    903  CA  SER A 112      36.663 -20.013  -3.278  1.00 23.84           C  
ATOM    904  C   SER A 112      35.788 -20.680  -4.347  1.00 22.55           C  
ATOM    905  O   SER A 112      34.904 -21.479  -4.032  1.00 19.91           O  
ATOM    906  CB  SER A 112      37.525 -21.061  -2.564  1.00 26.55           C  
ATOM    907  OG  SER A 112      38.654 -20.473  -1.936  1.00 29.76           O  
ATOM    908  N   VAL A 113      36.052 -20.325  -5.602  1.00 21.39           N  
ATOM    909  CA  VAL A 113      35.442 -20.937  -6.775  1.00 21.95           C  
ATOM    910  C   VAL A 113      36.570 -21.157  -7.784  1.00 21.72           C  
ATOM    911  O   VAL A 113      37.364 -20.246  -8.003  1.00 21.76           O  
ATOM    912  CB  VAL A 113      34.396 -20.015  -7.426  1.00 22.17           C  
ATOM    913  CG1 VAL A 113      33.766 -20.705  -8.638  1.00 21.65           C  
ATOM    914  CG2 VAL A 113      33.330 -19.596  -6.420  1.00 22.18           C  
ATOM    915  N   PRO A 114      36.671 -22.358  -8.383  1.00 20.85           N  
ATOM    916  CA  PRO A 114      35.874 -23.548  -8.117  1.00 21.31           C  
ATOM    917  C   PRO A 114      35.919 -23.929  -6.658  1.00 21.12           C  
ATOM    918  O   PRO A 114      36.915 -23.656  -5.963  1.00 19.79           O  
ATOM    919  CB  PRO A 114      36.558 -24.636  -8.947  1.00 20.70           C  
ATOM    920  CG  PRO A 114      37.233 -23.907 -10.033  1.00 21.94           C  
ATOM    921  CD  PRO A 114      37.675 -22.608  -9.431  1.00 21.63           C  
ATOM    922  N   HIS A 115      34.843 -24.557  -6.199  1.00 21.82           N  
ATOM    923  CA  HIS A 115      34.755 -24.974  -4.829  1.00 21.10           C  
ATOM    924  C   HIS A 115      35.985 -25.825  -4.542  1.00 21.38           C  
ATOM    925  O   HIS A 115      36.223 -26.828  -5.216  1.00 22.13           O  
ATOM    926  CB  HIS A 115      33.474 -25.764  -4.570  1.00 21.18           C  
ATOM    927  CG  HIS A 115      33.154 -25.900  -3.121  1.00 21.10           C  
ATOM    928  ND1 HIS A 115      33.802 -26.796  -2.302  1.00 21.59           N  
ATOM    929  CD2 HIS A 115      32.276 -25.235  -2.335  1.00 21.62           C  
ATOM    930  CE1 HIS A 115      33.327 -26.690  -1.074  1.00 22.26           C  
ATOM    931  NE2 HIS A 115      32.406 -25.742  -1.066  1.00 21.89           N  
ATOM    932  N   PRO A 116      36.785 -25.418  -3.552  1.00 22.77           N  
ATOM    933  CA  PRO A 116      38.109 -26.021  -3.416  1.00 22.32           C  
ATOM    934  C   PRO A 116      38.092 -27.465  -2.903  1.00 23.18           C  
ATOM    935  O   PRO A 116      39.116 -28.130  -2.936  1.00 21.80           O  
ATOM    936  CB  PRO A 116      38.817 -25.089  -2.431  1.00 24.00           C  
ATOM    937  CG  PRO A 116      37.735 -24.463  -1.637  1.00 24.97           C  
ATOM    938  CD  PRO A 116      36.486 -24.462  -2.472  1.00 23.37           C  
ATOM    939  N   ARG A 117      36.940 -27.949  -2.444  1.00 21.83           N  
ATOM    940  CA  ARG A 117      36.836 -29.318  -1.949  1.00 22.17           C  
ATOM    941  C   ARG A 117      36.089 -30.260  -2.891  1.00 21.67           C  
ATOM    942  O   ARG A 117      35.972 -31.459  -2.613  1.00 22.17           O  
ATOM    943  CB  ARG A 117      36.200 -29.307  -0.559  1.00 23.30           C  
ATOM    944  CG  ARG A 117      37.136 -28.734   0.492  1.00 25.37           C  
ATOM    945  CD  ARG A 117      36.408 -28.306   1.757  1.00 27.24           C  
ATOM    946  NE  ARG A 117      35.808 -26.984   1.665  1.00 29.42           N  
ATOM    947  CZ  ARG A 117      36.482 -25.839   1.748  1.00 33.04           C  
ATOM    948  NH1 ARG A 117      37.811 -25.829   1.888  1.00 34.07           N  
ATOM    949  NH2 ARG A 117      35.823 -24.691   1.667  1.00 34.16           N  
ATOM    950  N   MET A 118      35.619 -29.743  -4.018  1.00 21.23           N  
ATOM    951  CA  MET A 118      34.771 -30.538  -4.895  1.00 21.27           C  
ATOM    952  C   MET A 118      35.459 -31.778  -5.462  1.00 20.85           C  
ATOM    953  O   MET A 118      34.820 -32.808  -5.610  1.00 19.76           O  
ATOM    954  CB  MET A 118      34.176 -29.686  -6.014  1.00 23.20           C  
ATOM    955  CG  MET A 118      35.143 -29.234  -7.089  1.00 25.08           C  
ATOM    956  SD  MET A 118      34.370 -28.062  -8.229  1.00 28.37           S  
ATOM    957  CE  MET A 118      33.413 -29.193  -9.220  1.00 27.52           C  
ATOM    958  N   ASN A 119      36.761 -31.703  -5.737  1.00 21.10           N  
ATOM    959  CA  ASN A 119      37.438 -32.796  -6.424  1.00 22.16           C  
ATOM    960  C   ASN A 119      37.636 -34.080  -5.624  1.00 22.03           C  
ATOM    961  O   ASN A 119      37.949 -35.114  -6.215  1.00 22.66           O  
ATOM    962  CB  ASN A 119      38.770 -32.325  -7.034  1.00 25.70           C  
ATOM    963  CG  ASN A 119      38.575 -31.379  -8.209  1.00 27.13           C  
ATOM    964  OD1 ASN A 119      37.446 -31.038  -8.575  1.00 29.33           O  
ATOM    965  ND2 ASN A 119      39.679 -30.948  -8.811  1.00 27.68           N  
ATOM    966  N  AGLU A 120      37.459 -34.029  -4.307  0.50 22.00           N  
ATOM    967  CA AGLU A 120      37.528 -35.238  -3.485  0.50 22.45           C  
ATOM    968  C  AGLU A 120      36.189 -35.541  -2.820  0.50 22.31           C  
ATOM    969  O  AGLU A 120      36.147 -36.217  -1.789  0.50 22.58           O  
ATOM    970  CB AGLU A 120      38.620 -35.098  -2.424  0.50 23.53           C  
ATOM    971  CG AGLU A 120      40.007 -34.849  -3.002  0.50 23.59           C  
ATOM    972  CD AGLU A 120      40.580 -36.063  -3.704  0.50 24.36           C  
ATOM    973  OE1AGLU A 120      40.105 -37.189  -3.444  0.50 25.08           O  
ATOM    974  OE2AGLU A 120      41.507 -35.887  -4.523  0.50 27.16           O  
ATOM    975  N  BGLU A 120      37.455 -34.025  -4.302  0.50 22.07           N  
ATOM    976  CA BGLU A 120      37.535 -35.230  -3.467  0.50 22.57           C  
ATOM    977  C  BGLU A 120      36.170 -35.700  -2.973  0.50 22.41           C  
ATOM    978  O  BGLU A 120      36.091 -36.684  -2.236  0.50 22.86           O  
ATOM    979  CB BGLU A 120      38.435 -35.002  -2.250  0.50 23.68           C  
ATOM    980  CG BGLU A 120      39.258 -33.728  -2.288  0.50 24.34           C  
ATOM    981  CD BGLU A 120      38.939 -32.803  -1.130  0.50 24.24           C  
ATOM    982  OE1BGLU A 120      37.766 -32.779  -0.689  0.50 23.13           O  
ATOM    983  OE2BGLU A 120      39.866 -32.108  -0.662  0.50 20.11           O  
ATOM    984  N   ARG A 121      35.102 -35.023  -3.391  1.00 20.85           N  
ATOM    985  CA  ARG A 121      33.754 -35.321  -2.886  1.00 20.69           C  
ATOM    986  C   ARG A 121      32.919 -36.027  -3.936  1.00 19.63           C  
ATOM    987  O   ARG A 121      32.485 -35.417  -4.900  1.00 18.52           O  
ATOM    988  CB  ARG A 121      33.060 -34.047  -2.451  1.00 20.19           C  
ATOM    989  CG  ARG A 121      33.671 -33.423  -1.215  1.00 20.75           C  
ATOM    990  CD  ARG A 121      33.068 -32.055  -0.980  1.00 20.52           C  
ATOM    991  NE  ARG A 121      33.456 -31.489   0.307  1.00 20.66           N  
ATOM    992  CZ  ARG A 121      32.974 -30.356   0.801  1.00 20.89           C  
ATOM    993  NH1 ARG A 121      32.059 -29.656   0.134  1.00 20.10           N  
ATOM    994  NH2 ARG A 121      33.408 -29.922   1.973  1.00 23.29           N  
ATOM    995  N   ALA A 122      32.693 -37.320  -3.736  1.00 19.50           N  
ATOM    996  CA  ALA A 122      31.850 -38.082  -4.647  1.00 19.95           C  
ATOM    997  C   ALA A 122      30.426 -37.513  -4.685  1.00 17.97           C  
ATOM    998  O   ALA A 122      29.779 -37.507  -5.733  1.00 17.11           O  
ATOM    999  CB  ALA A 122      31.840 -39.548  -4.252  1.00 20.10           C  
ATOM   1000  N   PHE A 123      29.957 -37.000  -3.554  1.00 17.28           N  
ATOM   1001  CA  PHE A 123      28.598 -36.441  -3.485  1.00 18.21           C  
ATOM   1002  C   PHE A 123      28.442 -35.158  -4.302  1.00 19.46           C  
ATOM   1003  O   PHE A 123      27.323 -34.691  -4.520  1.00 19.16           O  
ATOM   1004  CB  PHE A 123      28.130 -36.262  -2.019  1.00 18.33           C  
ATOM   1005  CG  PHE A 123      28.807 -35.141  -1.262  1.00 18.85           C  
ATOM   1006  CD1 PHE A 123      28.451 -33.816  -1.479  1.00 18.58           C  
ATOM   1007  CD2 PHE A 123      29.760 -35.419  -0.293  1.00 19.22           C  
ATOM   1008  CE1 PHE A 123      29.057 -32.792  -0.780  1.00 18.07           C  
ATOM   1009  CE2 PHE A 123      30.352 -34.397   0.428  1.00 19.85           C  
ATOM   1010  CZ  PHE A 123      29.992 -33.083   0.186  1.00 19.39           C  
ATOM   1011  N   VAL A 124      29.563 -34.581  -4.737  1.00 18.81           N  
ATOM   1012  CA  VAL A 124      29.535 -33.509  -5.718  1.00 19.71           C  
ATOM   1013  C   VAL A 124      29.780 -34.049  -7.123  1.00 20.55           C  
ATOM   1014  O   VAL A 124      29.008 -33.787  -8.032  1.00 21.35           O  
ATOM   1015  CB  VAL A 124      30.599 -32.441  -5.408  1.00 18.87           C  
ATOM   1016  CG1 VAL A 124      30.696 -31.426  -6.533  1.00 19.39           C  
ATOM   1017  CG2 VAL A 124      30.287 -31.756  -4.099  1.00 19.35           C  
ATOM   1018  N   LEU A 125      30.868 -34.791  -7.295  1.00 20.48           N  
ATOM   1019  CA  LEU A 125      31.342 -35.156  -8.626  1.00 19.89           C  
ATOM   1020  C   LEU A 125      30.433 -36.107  -9.379  1.00 18.89           C  
ATOM   1021  O   LEU A 125      30.328 -36.025 -10.588  1.00 18.05           O  
ATOM   1022  CB  LEU A 125      32.738 -35.768  -8.547  1.00 20.05           C  
ATOM   1023  CG  LEU A 125      33.881 -34.826  -8.166  1.00 20.87           C  
ATOM   1024  CD1 LEU A 125      35.200 -35.583  -8.182  1.00 21.29           C  
ATOM   1025  CD2 LEU A 125      33.964 -33.639  -9.096  1.00 21.86           C  
ATOM   1026  N   ILE A 126      29.794 -37.023  -8.666  1.00 19.74           N  
ATOM   1027  CA  ILE A 126      28.892 -37.965  -9.314  1.00 19.91           C  
ATOM   1028  C   ILE A 126      27.709 -37.229  -9.954  1.00 19.34           C  
ATOM   1029  O   ILE A 126      27.536 -37.312 -11.169  1.00 19.73           O  
ATOM   1030  CB  ILE A 126      28.516 -39.121  -8.371  1.00 19.95           C  
ATOM   1031  CG1 ILE A 126      29.774 -39.997  -8.190  1.00 20.28           C  
ATOM   1032  CG2 ILE A 126      27.361 -39.938  -8.937  1.00 20.82           C  
ATOM   1033  CD1 ILE A 126      29.630 -41.144  -7.213  1.00 21.72           C  
ATOM   1034  N   PRO A 127      26.930 -36.468  -9.169  1.00 20.56           N  
ATOM   1035  CA  PRO A 127      25.877 -35.683  -9.834  1.00 20.48           C  
ATOM   1036  C   PRO A 127      26.397 -34.605 -10.794  1.00 20.43           C  
ATOM   1037  O   PRO A 127      25.718 -34.285 -11.769  1.00 19.88           O  
ATOM   1038  CB  PRO A 127      25.113 -35.038  -8.673  1.00 20.35           C  
ATOM   1039  CG  PRO A 127      26.005 -35.165  -7.485  1.00 20.43           C  
ATOM   1040  CD  PRO A 127      26.820 -36.401  -7.702  1.00 20.29           C  
ATOM   1041  N   LEU A 128      27.578 -34.045 -10.533  1.00 20.54           N  
ATOM   1042  CA  LEU A 128      28.134 -33.057 -11.453  1.00 19.85           C  
ATOM   1043  C   LEU A 128      28.444 -33.705 -12.793  1.00 20.39           C  
ATOM   1044  O   LEU A 128      28.128 -33.158 -13.843  1.00 20.96           O  
ATOM   1045  CB  LEU A 128      29.404 -32.407 -10.887  1.00 20.95           C  
ATOM   1046  CG  LEU A 128      29.897 -31.194 -11.677  1.00 21.24           C  
ATOM   1047  CD1 LEU A 128      28.799 -30.156 -11.829  1.00 20.15           C  
ATOM   1048  CD2 LEU A 128      31.138 -30.587 -11.032  1.00 22.03           C  
ATOM   1049  N   ASN A 129      29.073 -34.875 -12.750  1.00 21.35           N  
ATOM   1050  CA  ASN A 129      29.394 -35.619 -13.961  1.00 22.30           C  
ATOM   1051  C   ASN A 129      28.146 -35.975 -14.760  1.00 22.89           C  
ATOM   1052  O   ASN A 129      28.184 -36.017 -15.986  1.00 22.96           O  
ATOM   1053  CB  ASN A 129      30.165 -36.896 -13.621  1.00 23.11           C  
ATOM   1054  CG  ASN A 129      30.576 -37.675 -14.855  1.00 23.49           C  
ATOM   1055  OD1 ASN A 129      31.386 -37.211 -15.656  1.00 23.49           O  
ATOM   1056  ND2 ASN A 129      30.006 -38.859 -15.022  1.00 23.56           N  
ATOM   1057  N   ASP A 130      27.040 -36.216 -14.063  1.00 22.74           N  
ATOM   1058  CA  ASP A 130      25.781 -36.515 -14.735  1.00 23.66           C  
ATOM   1059  C   ASP A 130      25.351 -35.406 -15.671  1.00 22.67           C  
ATOM   1060  O   ASP A 130      24.738 -35.697 -16.695  1.00 23.05           O  
ATOM   1061  CB  ASP A 130      24.660 -36.769 -13.731  1.00 23.47           C  
ATOM   1062  CG  ASP A 130      24.798 -38.090 -13.013  1.00 24.14           C  
ATOM   1063  OD1 ASP A 130      25.466 -39.009 -13.532  1.00 26.58           O  
ATOM   1064  OD2 ASP A 130      24.209 -38.217 -11.924  1.00 24.56           O  
ATOM   1065  N   ILE A 131      25.640 -34.151 -15.308  1.00 20.76           N  
ATOM   1066  CA  ILE A 131      25.226 -32.987 -16.116  1.00 21.03           C  
ATOM   1067  C   ILE A 131      26.352 -32.192 -16.772  1.00 21.83           C  
ATOM   1068  O   ILE A 131      26.079 -31.321 -17.593  1.00 22.94           O  
ATOM   1069  CB  ILE A 131      24.381 -31.964 -15.297  1.00 20.89           C  
ATOM   1070  CG1 ILE A 131      25.165 -31.416 -14.098  1.00 20.69           C  
ATOM   1071  CG2 ILE A 131      23.082 -32.605 -14.841  1.00 20.57           C  
ATOM   1072  CD1 ILE A 131      24.500 -30.241 -13.406  1.00 20.97           C  
ATOM   1073  N   ALA A 132      27.603 -32.446 -16.399  1.00 21.21           N  
ATOM   1074  CA  ALA A 132      28.692 -31.582 -16.830  1.00 20.54           C  
ATOM   1075  C   ALA A 132      29.974 -32.366 -17.091  1.00 20.95           C  
ATOM   1076  O   ALA A 132      31.061 -31.849 -16.886  1.00 20.04           O  
ATOM   1077  CB  ALA A 132      28.929 -30.508 -15.786  1.00 21.30           C  
ATOM   1078  N   ALA A 133      29.826 -33.590 -17.599  1.00 20.12           N  
ATOM   1079  CA  ALA A 133      30.953 -34.512 -17.809  1.00 20.54           C  
ATOM   1080  C   ALA A 133      32.122 -33.905 -18.598  1.00 21.13           C  
ATOM   1081  O   ALA A 133      33.283 -34.188 -18.305  1.00 19.94           O  
ATOM   1082  CB  ALA A 133      30.461 -35.768 -18.505  1.00 20.44           C  
ATOM   1083  N   ASN A 134      31.806 -33.076 -19.588  1.00 21.21           N  
ATOM   1084  CA  ASN A 134      32.822 -32.487 -20.463  1.00 24.90           C  
ATOM   1085  C   ASN A 134      33.226 -31.059 -20.071  1.00 24.49           C  
ATOM   1086  O   ASN A 134      34.006 -30.425 -20.778  1.00 24.39           O  
ATOM   1087  CB  ASN A 134      32.339 -32.510 -21.920  1.00 26.01           C  
ATOM   1088  CG  ASN A 134      32.190 -33.920 -22.462  1.00 28.65           C  
ATOM   1089  OD1 ASN A 134      33.091 -34.746 -22.328  1.00 32.70           O  
ATOM   1090  ND2 ASN A 134      31.055 -34.200 -23.085  1.00 29.53           N  
ATOM   1091  N   VAL A 135      32.709 -30.551 -18.955  1.00 22.22           N  
ATOM   1092  CA  VAL A 135      33.105 -29.225 -18.486  1.00 22.89           C  
ATOM   1093  C   VAL A 135      34.487 -29.312 -17.835  1.00 23.37           C  
ATOM   1094  O   VAL A 135      34.792 -30.271 -17.120  1.00 21.47           O  
ATOM   1095  CB  VAL A 135      32.064 -28.622 -17.526  1.00 23.08           C  
ATOM   1096  CG1 VAL A 135      32.539 -27.286 -16.941  1.00 23.60           C  
ATOM   1097  CG2 VAL A 135      30.743 -28.439 -18.268  1.00 23.60           C  
ATOM   1098  N   VAL A 136      35.324 -28.309 -18.093  1.00 23.93           N  
ATOM   1099  CA  VAL A 136      36.686 -28.296 -17.546  1.00 24.41           C  
ATOM   1100  C   VAL A 136      36.695 -27.665 -16.154  1.00 23.85           C  
ATOM   1101  O   VAL A 136      36.192 -26.566 -15.969  1.00 25.02           O  
ATOM   1102  CB  VAL A 136      37.661 -27.515 -18.459  1.00 25.59           C  
ATOM   1103  CG1 VAL A 136      39.021 -27.349 -17.789  1.00 26.09           C  
ATOM   1104  CG2 VAL A 136      37.827 -28.232 -19.788  1.00 27.01           C  
ATOM   1105  N   GLU A 137      37.269 -28.371 -15.184  1.00 22.15           N  
ATOM   1106  CA  GLU A 137      37.466 -27.838 -13.844  1.00 22.28           C  
ATOM   1107  C   GLU A 137      38.777 -27.022 -13.896  1.00 21.72           C  
ATOM   1108  O   GLU A 137      39.829 -27.591 -14.149  1.00 21.49           O  
ATOM   1109  CB  GLU A 137      37.536 -28.993 -12.842  1.00 23.08           C  
ATOM   1110  CG  GLU A 137      37.476 -28.598 -11.377  1.00 25.18           C  
ATOM   1111  CD  GLU A 137      38.777 -27.988 -10.909  1.00 27.31           C  
ATOM   1112  OE1 GLU A 137      39.795 -28.721 -10.864  1.00 28.86           O  
ATOM   1113  OE2 GLU A 137      38.783 -26.770 -10.626  1.00 27.16           O  
ATOM   1114  N   PRO A 138      38.703 -25.690 -13.710  1.00 21.59           N  
ATOM   1115  CA  PRO A 138      39.861 -24.843 -14.057  1.00 22.77           C  
ATOM   1116  C   PRO A 138      41.104 -24.962 -13.190  1.00 24.00           C  
ATOM   1117  O   PRO A 138      42.168 -24.550 -13.642  1.00 26.21           O  
ATOM   1118  CB  PRO A 138      39.322 -23.407 -13.971  1.00 22.83           C  
ATOM   1119  CG  PRO A 138      37.986 -23.486 -13.364  1.00 21.90           C  
ATOM   1120  CD  PRO A 138      37.492 -24.899 -13.441  1.00 21.23           C  
ATOM   1121  N   ARG A 139      40.982 -25.470 -11.968  1.00 25.20           N  
ATOM   1122  CA  ARG A 139      42.154 -25.631 -11.095  1.00 27.71           C  
ATOM   1123  C   ARG A 139      43.016 -26.784 -11.592  1.00 27.58           C  
ATOM   1124  O   ARG A 139      44.192 -26.612 -11.875  1.00 27.78           O  
ATOM   1125  CB  ARG A 139      41.740 -25.889  -9.645  1.00 29.40           C  
ATOM   1126  CG  ARG A 139      40.989 -24.743  -8.967  1.00 28.91           C  
ATOM   1127  CD  ARG A 139      40.880 -25.011  -7.463  1.00 29.60           C  
ATOM   1128  NE  ARG A 139      39.907 -24.135  -6.807  1.00 29.73           N  
ATOM   1129  CZ  ARG A 139      40.174 -22.909  -6.367  1.00 28.54           C  
ATOM   1130  NH1 ARG A 139      41.395 -22.402  -6.500  1.00 28.69           N  
ATOM   1131  NH2 ARG A 139      39.227 -22.187  -5.788  1.00 27.32           N  
ATOM   1132  N   SER A 140      42.409 -27.957 -11.728  1.00 27.19           N  
ATOM   1133  CA  SER A 140      43.111 -29.123 -12.245  1.00 26.59           C  
ATOM   1134  C   SER A 140      43.260 -29.101 -13.777  1.00 26.10           C  
ATOM   1135  O   SER A 140      44.122 -29.782 -14.318  1.00 24.90           O  
ATOM   1136  CB  SER A 140      42.375 -30.390 -11.820  1.00 26.82           C  
ATOM   1137  OG  SER A 140      41.130 -30.491 -12.485  1.00 27.95           O  
ATOM   1138  N   LYS A 141      42.402 -28.334 -14.457  1.00 24.09           N  
ATOM   1139  CA  LYS A 141      42.305 -28.307 -15.922  1.00 24.96           C  
ATOM   1140  C   LYS A 141      41.904 -29.658 -16.524  1.00 25.79           C  
ATOM   1141  O   LYS A 141      42.199 -29.953 -17.683  1.00 27.77           O  
ATOM   1142  CB  LYS A 141      43.595 -27.766 -16.557  1.00 27.00           C  
ATOM   1143  CG  LYS A 141      43.986 -26.408 -15.991  1.00 27.35           C  
ATOM   1144  CD  LYS A 141      45.189 -25.801 -16.678  1.00 29.24           C  
ATOM   1145  CE  LYS A 141      45.455 -24.409 -16.119  1.00 29.53           C  
ATOM   1146  NZ  LYS A 141      46.537 -23.714 -16.863  1.00 31.74           N  
ATOM   1147  N   LEU A 142      41.214 -30.465 -15.732  1.00 24.84           N  
ATOM   1148  CA  LEU A 142      40.698 -31.735 -16.189  1.00 25.29           C  
ATOM   1149  C   LEU A 142      39.186 -31.616 -16.352  1.00 25.79           C  
ATOM   1150  O   LEU A 142      38.536 -30.814 -15.673  1.00 23.27           O  
ATOM   1151  CB  LEU A 142      41.023 -32.828 -15.182  1.00 26.96           C  
ATOM   1152  CG  LEU A 142      42.504 -33.079 -14.910  1.00 28.13           C  
ATOM   1153  CD1 LEU A 142      42.640 -34.136 -13.831  1.00 28.56           C  
ATOM   1154  CD2 LEU A 142      43.241 -33.505 -16.173  1.00 28.96           C  
ATOM   1155  N   LYS A 143      38.633 -32.401 -17.267  1.00 26.27           N  
ATOM   1156  CA  LYS A 143      37.183 -32.487 -17.401  1.00 25.81           C  
ATOM   1157  C   LYS A 143      36.618 -33.238 -16.212  1.00 23.23           C  
ATOM   1158  O   LYS A 143      37.278 -34.106 -15.642  1.00 22.61           O  
ATOM   1159  CB  LYS A 143      36.786 -33.167 -18.710  1.00 28.09           C  
ATOM   1160  CG  LYS A 143      37.146 -32.340 -19.930  1.00 30.74           C  
ATOM   1161  CD  LYS A 143      36.774 -33.024 -21.230  1.00 34.78           C  
ATOM   1162  CE  LYS A 143      36.950 -32.070 -22.404  1.00 38.88           C  
ATOM   1163  NZ  LYS A 143      36.558 -32.700 -23.698  1.00 43.31           N  
ATOM   1164  N   VAL A 144      35.387 -32.901 -15.846  1.00 22.92           N  
ATOM   1165  CA  VAL A 144      34.714 -33.543 -14.730  1.00 21.68           C  
ATOM   1166  C   VAL A 144      34.743 -35.064 -14.893  1.00 21.36           C  
ATOM   1167  O   VAL A 144      34.990 -35.781 -13.925  1.00 20.08           O  
ATOM   1168  CB  VAL A 144      33.259 -33.050 -14.594  1.00 22.30           C  
ATOM   1169  CG1 VAL A 144      32.497 -33.888 -13.576  1.00 22.31           C  
ATOM   1170  CG2 VAL A 144      33.240 -31.576 -14.204  1.00 21.31           C  
ATOM   1171  N   LYS A 145      34.531 -35.552 -16.112  1.00 22.13           N  
ATOM   1172  CA  LYS A 145      34.540 -36.999 -16.362  1.00 24.29           C  
ATOM   1173  C   LYS A 145      35.905 -37.641 -16.071  1.00 24.90           C  
ATOM   1174  O   LYS A 145      35.982 -38.842 -15.840  1.00 23.87           O  
ATOM   1175  CB  LYS A 145      34.112 -37.312 -17.796  1.00 26.34           C  
ATOM   1176  CG  LYS A 145      35.152 -36.979 -18.854  1.00 28.74           C  
ATOM   1177  CD  LYS A 145      34.543 -36.953 -20.236  1.00 30.13           C  
ATOM   1178  CE  LYS A 145      35.599 -36.673 -21.293  1.00 31.36           C  
ATOM   1179  NZ  LYS A 145      34.981 -36.553 -22.642  1.00 32.25           N  
ATOM   1180  N   ASP A 146      36.969 -36.841 -16.066  1.00 24.93           N  
ATOM   1181  CA  ASP A 146      38.305 -37.345 -15.710  1.00 26.08           C  
ATOM   1182  C   ASP A 146      38.633 -37.168 -14.227  1.00 26.17           C  
ATOM   1183  O   ASP A 146      39.675 -37.616 -13.763  1.00 26.86           O  
ATOM   1184  CB  ASP A 146      39.367 -36.694 -16.594  1.00 28.40           C  
ATOM   1185  CG  ASP A 146      39.184 -37.048 -18.065  1.00 30.94           C  
ATOM   1186  OD1 ASP A 146      38.933 -38.244 -18.364  1.00 27.94           O  
ATOM   1187  OD2 ASP A 146      39.257 -36.131 -18.920  1.00 34.68           O  
ATOM   1188  N   LEU A 147      37.725 -36.537 -13.486  1.00 24.26           N  
ATOM   1189  CA  LEU A 147      37.854 -36.389 -12.038  1.00 22.57           C  
ATOM   1190  C   LEU A 147      36.973 -37.373 -11.271  1.00 21.60           C  
ATOM   1191  O   LEU A 147      37.359 -37.853 -10.207  1.00 20.75           O  
ATOM   1192  CB  LEU A 147      37.501 -34.963 -11.629  1.00 22.10           C  
ATOM   1193  CG  LEU A 147      38.509 -33.899 -12.088  1.00 23.19           C  
ATOM   1194  CD1 LEU A 147      37.911 -32.504 -11.973  1.00 23.06           C  
ATOM   1195  CD2 LEU A 147      39.812 -33.999 -11.298  1.00 23.58           C  
ATOM   1196  N   VAL A 148      35.786 -37.666 -11.805  1.00 21.67           N  
ATOM   1197  CA  VAL A 148      34.798 -38.449 -11.081  1.00 21.96           C  
ATOM   1198  C   VAL A 148      35.332 -39.839 -10.754  1.00 22.96           C  
ATOM   1199  O   VAL A 148      36.118 -40.401 -11.520  1.00 24.12           O  
ATOM   1200  CB  VAL A 148      33.455 -38.528 -11.863  1.00 23.52           C  
ATOM   1201  CG1 VAL A 148      33.597 -39.348 -13.136  1.00 23.16           C  
ATOM   1202  CG2 VAL A 148      32.340 -39.070 -10.976  1.00 22.66           C  
ATOM   1203  N   PHE A 149      34.918 -40.368  -9.604  1.00 24.09           N  
ATOM   1204  CA  PHE A 149      35.306 -41.710  -9.166  1.00 24.48           C  
ATOM   1205  C   PHE A 149      34.150 -42.446  -8.511  1.00 24.80           C  
ATOM   1206  O   PHE A 149      33.200 -41.829  -8.022  1.00 23.75           O  
ATOM   1207  CB  PHE A 149      36.509 -41.647  -8.201  1.00 23.70           C  
ATOM   1208  CG  PHE A 149      36.303 -40.737  -7.009  1.00 23.35           C  
ATOM   1209  CD1 PHE A 149      35.707 -41.206  -5.847  1.00 23.19           C  
ATOM   1210  CD2 PHE A 149      36.725 -39.411  -7.046  1.00 23.74           C  
ATOM   1211  CE1 PHE A 149      35.518 -40.373  -4.753  1.00 23.20           C  
ATOM   1212  CE2 PHE A 149      36.533 -38.568  -5.957  1.00 23.12           C  
ATOM   1213  CZ  PHE A 149      35.937 -39.053  -4.806  1.00 23.48           C  
ATOM   1214  N   VAL A 150      34.253 -43.777  -8.493  1.00 27.80           N  
ATOM   1215  CA  VAL A 150      33.257 -44.647  -7.854  1.00 28.74           C  
ATOM   1216  C   VAL A 150      33.255 -44.461  -6.338  1.00 29.20           C  
ATOM   1217  O   VAL A 150      34.305 -44.348  -5.727  1.00 30.91           O  
ATOM   1218  CB  VAL A 150      33.532 -46.144  -8.175  1.00 30.23           C  
ATOM   1219  CG1 VAL A 150      32.741 -47.065  -7.259  1.00 30.26           C  
ATOM   1220  CG2 VAL A 150      33.219 -46.440  -9.633  1.00 31.68           C  
ATOM   1221  N   ASP A 151      32.070 -44.434  -5.737  1.00 30.69           N  
ATOM   1222  CA  ASP A 151      31.944 -44.334  -4.287  1.00 31.26           C  
ATOM   1223  C   ASP A 151      30.625 -44.959  -3.849  1.00 31.81           C  
ATOM   1224  O   ASP A 151      29.546 -44.427  -4.137  1.00 29.03           O  
ATOM   1225  CB  ASP A 151      32.016 -42.872  -3.841  1.00 32.05           C  
ATOM   1226  CG  ASP A 151      32.240 -42.718  -2.337  1.00 33.59           C  
ATOM   1227  OD1 ASP A 151      31.666 -43.483  -1.530  1.00 34.89           O  
ATOM   1228  OD2 ASP A 151      32.990 -41.804  -1.955  1.00 37.54           O  
ATOM   1229  N   ASP A 152      30.725 -46.079  -3.137  1.00 33.57           N  
ATOM   1230  CA  ASP A 152      29.550 -46.847  -2.716  1.00 36.40           C  
ATOM   1231  C   ASP A 152      28.682 -46.134  -1.673  1.00 33.79           C  
ATOM   1232  O   ASP A 152      27.531 -46.510  -1.471  1.00 33.14           O  
ATOM   1233  CB  ASP A 152      29.975 -48.215  -2.172  1.00 41.06           C  
ATOM   1234  CG  ASP A 152      30.577 -49.120  -3.245  1.00 45.92           C  
ATOM   1235  OD1 ASP A 152      30.369 -48.865  -4.455  1.00 47.07           O  
ATOM   1236  OD2 ASP A 152      31.257 -50.099  -2.869  1.00 53.64           O  
ATOM   1237  N   SER A 153      29.221 -45.113  -1.015  1.00 30.43           N  
ATOM   1238  CA  SER A 153      28.433 -44.325  -0.070  1.00 31.88           C  
ATOM   1239  C   SER A 153      27.480 -43.351  -0.768  1.00 29.38           C  
ATOM   1240  O   SER A 153      26.726 -42.653  -0.102  1.00 30.52           O  
ATOM   1241  CB  SER A 153      29.345 -43.541   0.873  1.00 32.81           C  
ATOM   1242  OG  SER A 153      29.824 -42.360   0.247  1.00 34.32           O  
ATOM   1243  N   VAL A 154      27.546 -43.279  -2.097  1.00 27.28           N  
ATOM   1244  CA  VAL A 154      26.696 -42.393  -2.879  1.00 26.61           C  
ATOM   1245  C   VAL A 154      25.720 -43.262  -3.651  1.00 27.65           C  
ATOM   1246  O   VAL A 154      26.131 -44.034  -4.499  1.00 29.35           O  
ATOM   1247  CB  VAL A 154      27.529 -41.538  -3.850  1.00 25.38           C  
ATOM   1248  CG1 VAL A 154      26.642 -40.768  -4.812  1.00 24.72           C  
ATOM   1249  CG2 VAL A 154      28.410 -40.573  -3.068  1.00 26.05           C  
ATOM   1250  N   LYS A 155      24.434 -43.129  -3.353  1.00 27.75           N  
ATOM   1251  CA  LYS A 155      23.430 -44.007  -3.933  1.00 29.98           C  
ATOM   1252  C   LYS A 155      22.389 -43.235  -4.702  1.00 27.91           C  
ATOM   1253  O   LYS A 155      21.915 -42.195  -4.258  1.00 23.85           O  
ATOM   1254  CB  LYS A 155      22.761 -44.838  -2.840  1.00 30.85           C  
ATOM   1255  CG  LYS A 155      23.723 -45.813  -2.190  1.00 36.14           C  
ATOM   1256  CD  LYS A 155      23.088 -46.590  -1.053  1.00 38.88           C  
ATOM   1257  CE  LYS A 155      24.152 -47.245  -0.184  1.00 43.08           C  
ATOM   1258  NZ  LYS A 155      25.036 -48.162  -0.961  1.00 47.12           N  
ATOM   1259  N   ARG A 156      22.035 -43.767  -5.866  1.00 28.72           N  
ATOM   1260  CA  ARG A 156      20.891 -43.284  -6.623  1.00 30.19           C  
ATOM   1261  C   ARG A 156      19.658 -43.204  -5.730  1.00 29.22           C  
ATOM   1262  O   ARG A 156      19.342 -44.142  -5.005  1.00 26.91           O  
ATOM   1263  CB  ARG A 156      20.606 -44.228  -7.793  1.00 36.14           C  
ATOM   1264  CG  ARG A 156      21.338 -43.876  -9.077  1.00 39.29           C  
ATOM   1265  CD  ARG A 156      22.069 -45.062  -9.682  1.00 42.97           C  
ATOM   1266  NE  ARG A 156      21.315 -46.316  -9.578  1.00 45.05           N  
ATOM   1267  CZ  ARG A 156      21.863 -47.520  -9.413  1.00 46.26           C  
ATOM   1268  NH1 ARG A 156      23.183 -47.674  -9.331  1.00 48.07           N  
ATOM   1269  NH2 ARG A 156      21.083 -48.588  -9.323  1.00 50.91           N  
ATOM   1270  N   TYR A 157      18.988 -42.063  -5.777  1.00 29.17           N  
ATOM   1271  CA  TYR A 157      17.763 -41.838  -5.035  1.00 33.95           C  
ATOM   1272  C   TYR A 157      16.643 -41.487  -6.007  1.00 38.50           C  
ATOM   1273  O   TYR A 157      15.574 -42.091  -5.963  1.00 42.36           O  
ATOM   1274  CB  TYR A 157      17.977 -40.696  -4.048  1.00 33.37           C  
ATOM   1275  CG  TYR A 157      16.845 -40.451  -3.081  1.00 31.76           C  
ATOM   1276  CD1 TYR A 157      16.761 -41.158  -1.884  1.00 33.03           C  
ATOM   1277  CD2 TYR A 157      15.879 -39.491  -3.343  1.00 33.46           C  
ATOM   1278  CE1 TYR A 157      15.737 -40.924  -0.983  1.00 34.77           C  
ATOM   1279  CE2 TYR A 157      14.845 -39.254  -2.455  1.00 34.05           C  
ATOM   1280  CZ  TYR A 157      14.778 -39.970  -1.278  1.00 36.41           C  
ATOM   1281  OH  TYR A 157      13.753 -39.730  -0.391  1.00 41.60           O  
ATOM   1282  N   LYS A 158      16.895 -40.507  -6.880  1.00 43.25           N  
ATOM   1283  CA  LYS A 158      15.878 -40.007  -7.818  1.00 47.84           C  
ATOM   1284  C   LYS A 158      16.485 -39.202  -8.989  1.00 47.64           C  
ATOM   1285  O   LYS A 158      16.685 -37.984  -8.935  1.00 43.37           O  
ATOM   1286  CB  LYS A 158      14.846 -39.160  -7.058  1.00 48.41           C  
ATOM   1287  CG  LYS A 158      13.473 -39.134  -7.704  1.00 53.58           C  
ATOM   1288  CD  LYS A 158      12.499 -38.310  -6.882  1.00 54.27           C  
ATOM   1289  CE  LYS A 158      11.077 -38.455  -7.399  1.00 56.86           C  
ATOM   1290  NZ  LYS A 158      10.080 -37.924  -6.429  1.00 58.13           N  
ATOM   1291  OXT LYS A 158      16.789 -39.751 -10.048  1.00 52.08           O  
TER    1292      LYS A 158                                                      
HETATM 1293  PG  APC A1159      31.599 -26.606   2.096  1.00 19.11           P  
HETATM 1294  O1G APC A1159      30.726 -27.654   1.435  1.00 19.40           O  
HETATM 1295  O2G APC A1159      33.048 -27.070   2.228  1.00 19.09           O  
HETATM 1296  O3G APC A1159      31.454 -25.238   1.512  1.00 21.18           O  
HETATM 1297  PB  APC A1159      29.623 -25.841   3.945  1.00 20.62           P  
HETATM 1298  O1B APC A1159      28.782 -25.799   2.710  1.00 17.88           O  
HETATM 1299  O2B APC A1159      29.011 -26.782   5.068  1.00 19.25           O  
HETATM 1300  O3B APC A1159      31.071 -26.488   3.605  1.00 19.88           O  
HETATM 1301  PA  APC A1159      28.541 -23.213   4.930  1.00 20.87           P  
HETATM 1302  O1A APC A1159      27.543 -23.445   3.859  1.00 20.66           O  
HETATM 1303  O2A APC A1159      27.993 -23.433   6.397  1.00 20.17           O  
HETATM 1304  C3A APC A1159      30.004 -24.225   4.644  1.00 19.67           C  
HETATM 1305  O5' APC A1159      29.046 -21.701   4.930  1.00 23.46           O  
HETATM 1306  C5' APC A1159      28.831 -20.859   3.838  1.00 25.46           C  
HETATM 1307  C4' APC A1159      30.030 -19.937   3.768  1.00 25.34           C  
HETATM 1308  O4' APC A1159      31.155 -20.547   3.132  1.00 25.04           O  
HETATM 1309  C3' APC A1159      29.612 -18.770   2.935  1.00 26.37           C  
HETATM 1310  O3' APC A1159      29.066 -17.801   3.831  1.00 27.35           O  
HETATM 1311  C2' APC A1159      30.876 -18.375   2.194  1.00 26.98           C  
HETATM 1312  O2' APC A1159      31.476 -17.221   2.802  1.00 28.17           O  
HETATM 1313  C1' APC A1159      31.797 -19.592   2.305  1.00 25.55           C  
HETATM 1314  N9  APC A1159      32.114 -20.133   0.958  1.00 25.00           N  
HETATM 1315  C8  APC A1159      33.367 -20.227   0.473  1.00 25.19           C  
HETATM 1316  N7  APC A1159      33.367 -20.729  -0.784  1.00 23.52           N  
HETATM 1317  C5  APC A1159      32.080 -20.962  -1.111  1.00 22.21           C  
HETATM 1318  C6  APC A1159      31.376 -21.501  -2.295  1.00 21.15           C  
HETATM 1319  N6  APC A1159      32.107 -21.872  -3.373  1.00 19.92           N  
HETATM 1320  N1  APC A1159      30.013 -21.602  -2.250  1.00 19.81           N  
HETATM 1321  C2  APC A1159      29.314 -21.222  -1.159  1.00 20.83           C  
HETATM 1322  N3  APC A1159      29.900 -20.725  -0.047  1.00 22.31           N  
HETATM 1323  C4  APC A1159      31.254 -20.576   0.037  1.00 22.94           C  
HETATM 1324 MG    MG A1160      27.725 -24.212   1.939  1.00 18.91          MG  
HETATM 1325 MG    MG A1161      28.662 -27.563   1.434  1.00 18.83          MG  
HETATM 1326  N   NO3 A1162      19.200 -26.267  10.230  1.00 34.06           N  
HETATM 1327  O1  NO3 A1162      19.217 -27.653  10.387  1.00 33.90           O  
HETATM 1328  O2  NO3 A1162      18.868 -25.528  11.147  1.00 38.98           O  
HETATM 1329  O3  NO3 A1162      19.562 -25.732   9.006  1.00 34.20           O  
HETATM 1330  C1  YH5 A1163      27.151 -32.930   1.929  1.00 19.57           C  
HETATM 1331  O1  YH5 A1163      26.574 -31.936   1.191  1.00 19.65           O  
HETATM 1332  N1  YH5 A1163      28.355 -31.468   3.569  1.00 22.23           N  
HETATM 1333  S1  YH5 A1163      29.944 -30.782   5.678  1.00 29.73           S  
HETATM 1334  C10 YH5 A1163      34.889 -32.087   6.538  1.00 37.04           C  
HETATM 1335  C11 YH5 A1163      35.529 -33.174   5.973  1.00 39.07           C  
HETATM 1336  C12 YH5 A1163      35.022 -33.742   4.832  1.00 38.53           C  
HETATM 1337  C13 YH5 A1163      33.885 -33.237   4.248  1.00 38.92           C  
HETATM 1338  C14 YH5 A1163      37.123 -33.228   7.669  1.00 39.53           C  
HETATM 1339  N2  YH5 A1163      29.238 -33.196   4.682  1.00 21.50           N  
HETATM 1340  C2  YH5 A1163      27.959 -32.650   3.007  1.00 21.14           C  
HETATM 1341  O2  YH5 A1163      31.653 -32.370   3.174  1.00 39.97           O  
HETATM 1342  N3  YH5 A1163      28.299 -35.000   3.394  1.00 18.72           N  
HETATM 1343  C3  YH5 A1163      29.116 -31.842   4.574  1.00 24.71           C  
HETATM 1344  O3  YH5 A1163      36.683 -33.794   6.446  1.00 39.25           O  
HETATM 1345  C4  YH5 A1163      28.491 -33.720   3.677  1.00 20.62           C  
HETATM 1346  N4  YH5 A1163      26.937 -34.199   1.587  1.00 19.46           N  
HETATM 1347  C5  YH5 A1163      27.512 -35.155   2.326  1.00 18.58           C  
HETATM 1348  N5  YH5 A1163      27.255 -36.454   1.942  1.00 18.38           N  
HETATM 1349  C6  YH5 A1163      31.314 -30.434   4.542  1.00 34.07           C  
HETATM 1350  C7  YH5 A1163      32.034 -31.692   4.119  1.00 37.27           C  
HETATM 1351  C8  YH5 A1163      33.247 -32.155   4.812  1.00 39.06           C  
HETATM 1352  C9  YH5 A1163      33.745 -31.573   5.959  1.00 37.22           C  
HETATM 1353  O   HOH A2001      24.833  -9.144 -23.721  1.00 40.47           O  
HETATM 1354  O   HOH A2002      27.114 -29.904  -2.903  1.00 21.95           O  
HETATM 1355  O   HOH A2003      29.848 -19.817 -19.423  1.00 46.07           O  
HETATM 1356  O   HOH A2004      30.456 -23.605 -17.765  1.00 47.09           O  
HETATM 1357  O   HOH A2005      31.036 -23.316 -15.125  1.00 41.93           O  
HETATM 1358  O   HOH A2006      24.656 -29.063 -17.680  1.00 33.49           O  
HETATM 1359  O   HOH A2007      25.672 -28.704  -1.002  1.00 24.63           O  
HETATM 1360  O   HOH A2008      14.184 -36.720   7.415  1.00 30.48           O  
HETATM 1361  O   HOH A2009      14.126 -36.899   3.479  1.00 21.78           O  
HETATM 1362  O   HOH A2010      11.118 -30.619   6.480  1.00 35.41           O  
HETATM 1363  O   HOH A2011      12.699 -36.356   1.393  1.00 30.85           O  
HETATM 1364  O   HOH A2012       7.481 -31.089   3.849  1.00 47.49           O  
HETATM 1365  O   HOH A2013      16.492 -39.952   5.922  1.00 40.91           O  
HETATM 1366  O   HOH A2014      12.993 -26.122   5.562  1.00 38.13           O  
HETATM 1367  O   HOH A2015      10.855 -21.178 -10.310  1.00 39.25           O  
HETATM 1368  O   HOH A2016      14.734 -15.992 -12.997  1.00 34.50           O  
HETATM 1369  O   HOH A2017      12.821 -14.401 -12.276  1.00 50.48           O  
HETATM 1370  O   HOH A2018      22.600 -33.166 -19.549  1.00 21.41           O  
HETATM 1371  O   HOH A2019      19.818 -40.817  -8.754  1.00 33.50           O  
HETATM 1372  O   HOH A2020      24.868 -41.562 -12.931  1.00 32.66           O  
HETATM 1373  O   HOH A2021      18.750 -42.295   4.992  1.00 31.45           O  
HETATM 1374  O   HOH A2022      28.974 -39.733   0.623  1.00 22.57           O  
HETATM 1375  O   HOH A2023      30.932 -32.454   8.580  1.00 25.57           O  
HETATM 1376  O   HOH A2024      33.611 -38.682   6.437  1.00 35.35           O  
HETATM 1377  O   HOH A2025      24.545 -36.862  16.442  1.00 35.37           O  
HETATM 1378  O   HOH A2026      26.477 -41.713   9.699  1.00 30.40           O  
HETATM 1379  O   HOH A2027      33.659 -42.023  10.331  1.00 36.90           O  
HETATM 1380  O   HOH A2028      23.983 -40.835   9.217  1.00 23.67           O  
HETATM 1381  O   HOH A2029      26.094 -32.121  -4.434  1.00 24.13           O  
HETATM 1382  O   HOH A2030      22.500 -26.696 -20.857  1.00 35.02           O  
HETATM 1383  O   HOH A2031      31.394 -10.528  -7.552  1.00 33.05           O  
HETATM 1384  O   HOH A2032      31.739 -12.296 -11.079  1.00 35.03           O  
HETATM 1385  O   HOH A2033      25.777 -21.253   4.196  1.00 37.91           O  
HETATM 1386  O   HOH A2034      26.633 -22.537   1.314  1.00 19.19           O  
HETATM 1387  O   HOH A2035      24.880 -25.911   9.806  1.00 31.53           O  
HETATM 1388  O   HOH A2036      23.592 -28.999  15.948  1.00 43.43           O  
HETATM 1389  O   HOH A2037      25.244 -28.074  14.217  1.00 37.72           O  
HETATM 1390  O   HOH A2038      31.316 -23.362  12.016  1.00 46.78           O  
HETATM 1391  O   HOH A2039      31.718 -27.840   6.248  1.00 27.26           O  
HETATM 1392  O   HOH A2040      33.061 -23.352   2.232  1.00 44.56           O  
HETATM 1393  O   HOH A2041      33.985 -26.720   4.857  1.00 29.04           O  
HETATM 1394  O   HOH A2042      33.299 -28.401   8.375  1.00 32.23           O  
HETATM 1395  O   HOH A2043      33.839 -27.069  10.961  1.00 28.72           O  
HETATM 1396  O   HOH A2044      25.542 -29.822   2.626  1.00 24.26           O  
HETATM 1397  O   HOH A2045      28.646 -28.738   3.189  1.00 19.92           O  
HETATM 1398  O   HOH A2046      28.359 -29.432   0.419  1.00 19.97           O  
HETATM 1399  O   HOH A2047      29.553 -23.323   1.575  1.00 14.19           O  
HETATM 1400  O   HOH A2048      29.645 -28.824  -2.123  1.00 21.79           O  
HETATM 1401  O   HOH A2049      34.652 -21.861 -12.137  1.00 17.81           O  
HETATM 1402  O   HOH A2050      40.664 -24.040 -17.773  1.00 32.38           O  
HETATM 1403  O   HOH A2051      34.771 -26.384 -20.104  1.00 24.52           O  
HETATM 1404  O   HOH A2052      39.599 -16.079 -12.673  1.00 22.91           O  
HETATM 1405  O   HOH A2053      33.420 -13.665 -15.773  1.00 44.34           O  
HETATM 1406  O   HOH A2054      44.626 -23.657 -12.930  1.00 37.20           O  
HETATM 1407  O   HOH A2055      42.058 -22.758  -2.565  1.00 32.23           O  
HETATM 1408  O   HOH A2056      44.538 -20.765  -2.899  1.00 43.98           O  
HETATM 1409  O   HOH A2057      36.416 -12.661   1.410  1.00 32.36           O  
HETATM 1410  O   HOH A2058      38.442 -29.337  -5.764  1.00 33.59           O  
HETATM 1411  O   HOH A2059      38.508 -27.120  -7.126  1.00 29.06           O  
HETATM 1412  O   HOH A2060      32.264 -29.029  -2.944  1.00 22.57           O  
HETATM 1413  O   HOH A2061      39.016 -36.533  -8.226  1.00 26.92           O  
HETATM 1414  O   HOH A2062      42.000 -32.592  -8.200  1.00 40.73           O  
HETATM 1415  O   HOH A2063      33.619 -39.003  -1.443  1.00 32.42           O  
HETATM 1416  O   HOH A2064      30.781 -38.477  -1.043  1.00 25.18           O  
HETATM 1417  O   HOH A2065      27.977 -39.505 -12.653  1.00 26.89           O  
HETATM 1418  O   HOH A2066      31.571 -39.706 -17.380  1.00 38.61           O  
HETATM 1419  O   HOH A2067      29.094 -32.072 -20.457  1.00 32.97           O  
HETATM 1420  O   HOH A2068      42.337 -22.565 -15.869  1.00 27.65           O  
HETATM 1421  O   HOH A2069      45.599 -31.672 -13.383  1.00 40.37           O  
HETATM 1422  O   HOH A2070      41.207 -31.558 -20.032  1.00 37.06           O  
HETATM 1423  O   HOH A2071      47.021 -21.440 -15.437  1.00 40.19           O  
HETATM 1424  O   HOH A2072      40.377 -33.898 -18.981  1.00 31.31           O  
HETATM 1425  O   HOH A2073      33.985 -40.654 -16.599  1.00 38.14           O  
HETATM 1426  O   HOH A2074      37.115 -40.360 -13.970  1.00 33.97           O  
HETATM 1427  O   HOH A2075      39.164 -36.622 -21.602  1.00 48.75           O  
HETATM 1428  O   HOH A2076      33.488 -39.187  -7.515  1.00 21.29           O  
HETATM 1429  O   HOH A2077      36.774 -44.818  -9.658  1.00 41.47           O  
HETATM 1430  O   HOH A2078      29.719 -44.785  -7.401  1.00 27.80           O  
HETATM 1431  O   HOH A2079      33.522 -47.243  -2.943  1.00 33.90           O  
HETATM 1432  O   HOH A2080      26.343 -46.918  -4.900  1.00 41.02           O  
HETATM 1433  O   HOH A2081      27.095 -43.775  -7.164  1.00 36.94           O  
HETATM 1434  O   HOH A2082      18.194 -46.139  -9.821  1.00 37.63           O  
HETATM 1435  O   HOH A2083      29.628 -15.174   3.485  1.00 44.74           O  
CONECT  771 1324                                                                
CONECT  772 1325                                                                
CONECT  786 1324                                                                
CONECT  787 1325                                                                
CONECT 1293 1294 1295 1296 1300                                                 
CONECT 1294 1293 1325                                                           
CONECT 1295 1293                                                                
CONECT 1296 1293                                                                
CONECT 1297 1298 1299 1300 1304                                                 
CONECT 1298 1297 1324 1325                                                      
CONECT 1299 1297                                                                
CONECT 1300 1293 1297                                                           
CONECT 1301 1302 1303 1304 1305                                                 
CONECT 1302 1301 1324                                                           
CONECT 1303 1301                                                                
CONECT 1304 1297 1301                                                           
CONECT 1305 1301 1306                                                           
CONECT 1306 1305 1307                                                           
CONECT 1307 1306 1308 1309                                                      
CONECT 1308 1307 1313                                                           
CONECT 1309 1307 1310 1311                                                      
CONECT 1310 1309                                                                
CONECT 1311 1309 1312 1313                                                      
CONECT 1312 1311                                                                
CONECT 1313 1308 1311 1314                                                      
CONECT 1314 1313 1315 1323                                                      
CONECT 1315 1314 1316                                                           
CONECT 1316 1315 1317                                                           
CONECT 1317 1316 1318 1323                                                      
CONECT 1318 1317 1319 1320                                                      
CONECT 1319 1318                                                                
CONECT 1320 1318 1321                                                           
CONECT 1321 1320 1322                                                           
CONECT 1322 1321 1323                                                           
CONECT 1323 1314 1317 1322                                                      
CONECT 1324  771  786 1298 1302                                                 
CONECT 1324 1386 1399                                                           
CONECT 1325  772  787 1294 1298                                                 
CONECT 1325 1397 1398                                                           
CONECT 1326 1327 1328 1329                                                      
CONECT 1327 1326                                                                
CONECT 1328 1326                                                                
CONECT 1329 1326                                                                
CONECT 1330 1331 1340 1346                                                      
CONECT 1331 1330                                                                
CONECT 1332 1340 1343                                                           
CONECT 1333 1343 1349                                                           
CONECT 1334 1335 1352                                                           
CONECT 1335 1334 1336 1344                                                      
CONECT 1336 1335 1337                                                           
CONECT 1337 1336 1351                                                           
CONECT 1338 1344                                                                
CONECT 1339 1343 1345                                                           
CONECT 1340 1330 1332 1345                                                      
CONECT 1341 1350                                                                
CONECT 1342 1345 1347                                                           
CONECT 1343 1332 1333 1339                                                      
CONECT 1344 1335 1338                                                           
CONECT 1345 1339 1340 1342                                                      
CONECT 1346 1330 1347                                                           
CONECT 1347 1342 1346 1348                                                      
CONECT 1348 1347                                                                
CONECT 1349 1333 1350                                                           
CONECT 1350 1341 1349 1351                                                      
CONECT 1351 1337 1350 1352                                                      
CONECT 1352 1334 1351                                                           
CONECT 1386 1324                                                                
CONECT 1397 1325                                                                
CONECT 1398 1325                                                                
CONECT 1399 1324                                                                
MASTER      320    0    5    5   15    0   16    6 1434    1   70   13          
END                                                                             



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elNémo is maintained by Yves-Henri Sanejouand.
It was developed by Karsten Suhre.
Between 2003 and 2014, it was hosted by IGS (Marseille).
Last modification: October 18th, 2018.