CNRS Nantes University UFIP UFIP
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***  pKSI Y57F Y32F  ***

elNémo ID: 1907150033374037

Job options:

ID        	=	 1907150033374037
JOBID     	=	 pKSI Y57F Y32F
USERID    	=	 unknown
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 pKSI Y57F Y32F

HEADER    ISOMERASE                               14-DEC-99   1DMN              
TITLE     CRYSTAL STRUCTURE OF MUTANT ENZYME Y32F/Y57F OF KETOSTEROID ISOMERASE 
TITLE    2 FROM PSEUDOMONAS PUTIDA BIOTYPE B                                    
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: STEROID DELTA-ISOMERASE;                                   
COMPND   3 CHAIN: A;                                                            
COMPND   4 EC: 5.3.3.1;                                                         
COMPND   5 ENGINEERED: YES;                                                     
COMPND   6 MUTATION: YES                                                        
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: PSEUDOMONAS PUTIDA;                             
SOURCE   3 ORGANISM_TAXID: 303;                                                 
SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE   5 EXPRESSION_SYSTEM_TAXID: 562;                                        
SOURCE   6 EXPRESSION_SYSTEM_PLASMID: PKK223-3                                  
KEYWDS    CONESHELL, CLOSED BARREL, CURVED B-SHEET, ISOMERASE                   
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    D.H.KIM,D.S.JANG,G.H.NAM,B.H.OH,K.Y.CHOI                              
REVDAT   3   31-JAN-18 1DMN    1       REMARK                                   
REVDAT   2   24-FEB-09 1DMN    1       VERSN                                    
REVDAT   1   23-MAY-00 1DMN    0                                                
JRNL        AUTH   D.H.KIM,D.S.JANG,G.H.NAM,G.CHOI,J.S.KIM,N.C.HA,M.S.KIM,      
JRNL        AUTH 2 B.H.OH,K.Y.CHOI                                              
JRNL        TITL   CONTRIBUTION OF THE HYDROGEN-BOND NETWORK INVOLVING A        
JRNL        TITL 2 TYROSINE TRIAD IN THE ACTIVE SITE TO THE STRUCTURE AND       
JRNL        TITL 3 FUNCTION OF A HIGHLY PROFICIENT KETOSTEROID ISOMERASE FROM   
JRNL        TITL 4 PSEUDOMONAS PUTIDA BIOTYPE B.                                
JRNL        REF    BIOCHEMISTRY                  V.  39  4581 2000              
JRNL        REFN                   ISSN 0006-2960                               
JRNL        PMID   10769113                                                     
JRNL        DOI    10.1021/BI992119U                                            
REMARK   1                                                                      
REMARK   1 REFERENCE 1                                                          
REMARK   1  AUTH   S.W.KIM,S.S.CHA,H.S.CHO,J.S.KIM,N.C.HA,M.J.CHO,S.JOO,        
REMARK   1  AUTH 2 K.K.KIM,K.Y.CHOI,B.H.OH                                      
REMARK   1  TITL   HIGH-RESOLUTION CRYSTAL STRUCTURES OF DELTA(5)-3-KETOSTEROID 
REMARK   1  TITL 2 ISOMERASE WITH AND WITHOUT A REACTION INTERMEDIATE ANALOGUE  
REMARK   1  REF    BIOCHEMISTRY                  V.  36 14030 1997              
REMARK   1  REFN                   ISSN 0006-2960                               
REMARK   1  DOI    10.1021/BI971546+                                            
REMARK   1 REFERENCE 2                                                          
REMARK   1  AUTH   H.S.CHO,G.CHOI,K.Y.CHOI,B.H.OH                               
REMARK   1  TITL   CRYSTAL STRUCTURE AND ENZYME MECHANISM OF                    
REMARK   1  TITL 2 DELTA(5)-3-KETOSTEROID ISOMERASE FROM PSEUDOMONAS            
REMARK   1  TITL 3 TESTOSTERONI                                                 
REMARK   1  REF    BIOCHEMISTRY                  V.  37  8325 1998              
REMARK   1  REFN                   ISSN 0006-2960                               
REMARK   1  DOI    10.1021/BI9801614                                            
REMARK   1 REFERENCE 3                                                          
REMARK   1  AUTH   H.S.CHO,N.C.HA,G.CHOI,H.J.KIM,D.LEE,K.S.OH,K.S.KIM,W.LEE,    
REMARK   1  AUTH 2 K.Y.CHOI,B.H.OH                                              
REMARK   1  TITL   CRYSTAL STRUCTURE OF DELTA(5)-3-KETOSTEROID ISOMERASE FROM   
REMARK   1  TITL 2 PSEUDOMONAS TESTOSTERONI IN COMPLEX WITH EQUILENIN SETTLES   
REMARK   1  TITL 3 THE CORRECT HYDROGEN BONDING SCHEME FOR TRANSITION STATE     
REMARK   1  TITL 4 STABILIZATION                                                
REMARK   1  REF    BIOCHEMISTRY                  V. 274 32863 1999              
REMARK   1  REFN                   ISSN 0006-2960                               
REMARK   1  DOI    10.1074/JBC.274.46.32863                                     
REMARK   2                                                                      
REMARK   2 RESOLUTION.    2.05 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : X-PLOR 3.843                                         
REMARK   3   AUTHORS     : BRUNGER                                              
REMARK   3                                                                      
REMARK   3  DATA USED IN REFINEMENT.                                            
REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) : 2.05                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 20.00                          
REMARK   3   DATA CUTOFF            (SIGMA(F)) : 0.500                          
REMARK   3   DATA CUTOFF HIGH         (ABS(F)) : NULL                           
REMARK   3   DATA CUTOFF LOW          (ABS(F)) : NULL                           
REMARK   3   COMPLETENESS (WORKING+TEST)   (%) : NULL                           
REMARK   3   NUMBER OF REFLECTIONS             : 8592                           
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   CROSS-VALIDATION METHOD          : NULL                            
REMARK   3   FREE R VALUE TEST SET SELECTION  : 5%                              
REMARK   3   R VALUE            (WORKING SET) : 0.195                           
REMARK   3   FREE R VALUE                     : 0.244                           
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : NULL                            
REMARK   3   FREE R VALUE TEST SET COUNT      : 430                             
REMARK   3   ESTIMATED ERROR OF FREE R VALUE  : NULL                            
REMARK   3                                                                      
REMARK   3  FIT IN THE HIGHEST RESOLUTION BIN.                                  
REMARK   3   TOTAL NUMBER OF BINS USED           : NULL                         
REMARK   3   BIN RESOLUTION RANGE HIGH       (A) : NULL                         
REMARK   3   BIN RESOLUTION RANGE LOW        (A) : NULL                         
REMARK   3   BIN COMPLETENESS (WORKING+TEST) (%) : NULL                         
REMARK   3   REFLECTIONS IN BIN    (WORKING SET) : NULL                         
REMARK   3   BIN R VALUE           (WORKING SET) : NULL                         
REMARK   3   BIN FREE R VALUE                    : NULL                         
REMARK   3   BIN FREE R VALUE TEST SET SIZE  (%) : NULL                         
REMARK   3   BIN FREE R VALUE TEST SET COUNT     : NULL                         
REMARK   3   ESTIMATED ERROR OF BIN FREE R VALUE : NULL                         
REMARK   3                                                                      
REMARK   3  NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.                    
REMARK   3   PROTEIN ATOMS            : 955                                     
REMARK   3   NUCLEIC ACID ATOMS       : 0                                       
REMARK   3   HETEROGEN ATOMS          : 0                                       
REMARK   3   SOLVENT ATOMS            : 48                                      
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : 14.70                          
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : NULL                           
REMARK   3   OVERALL ANISOTROPIC B VALUE.                                       
REMARK   3    B11 (A**2) : NULL                                                 
REMARK   3    B22 (A**2) : NULL                                                 
REMARK   3    B33 (A**2) : NULL                                                 
REMARK   3    B12 (A**2) : NULL                                                 
REMARK   3    B13 (A**2) : NULL                                                 
REMARK   3    B23 (A**2) : NULL                                                 
REMARK   3                                                                      
REMARK   3  ESTIMATED COORDINATE ERROR.                                         
REMARK   3   ESD FROM LUZZATI PLOT        (A) : NULL                            
REMARK   3   ESD FROM SIGMAA              (A) : NULL                            
REMARK   3   LOW RESOLUTION CUTOFF        (A) : NULL                            
REMARK   3                                                                      
REMARK   3  CROSS-VALIDATED ESTIMATED COORDINATE ERROR.                         
REMARK   3   ESD FROM C-V LUZZATI PLOT    (A) : NULL                            
REMARK   3   ESD FROM C-V SIGMAA          (A) : NULL                            
REMARK   3                                                                      
REMARK   3  RMS DEVIATIONS FROM IDEAL VALUES.                                   
REMARK   3   BOND LENGTHS                 (A) : 0.019                           
REMARK   3   BOND ANGLES            (DEGREES) : 2.030                           
REMARK   3   DIHEDRAL ANGLES        (DEGREES) : NULL                            
REMARK   3   IMPROPER ANGLES        (DEGREES) : NULL                            
REMARK   3                                                                      
REMARK   3  ISOTROPIC THERMAL MODEL : NULL                                      
REMARK   3                                                                      
REMARK   3  ISOTROPIC THERMAL FACTOR RESTRAINTS.    RMS    SIGMA                
REMARK   3   MAIN-CHAIN BOND              (A**2) : NULL  ; NULL                 
REMARK   3   MAIN-CHAIN ANGLE             (A**2) : NULL  ; NULL                 
REMARK   3   SIDE-CHAIN BOND              (A**2) : NULL  ; NULL                 
REMARK   3   SIDE-CHAIN ANGLE             (A**2) : NULL  ; NULL                 
REMARK   3                                                                      
REMARK   3  NCS MODEL : NULL                                                    
REMARK   3                                                                      
REMARK   3  NCS RESTRAINTS.                         RMS   SIGMA/WEIGHT          
REMARK   3   GROUP  1  POSITIONAL            (A) : NULL  ; NULL                 
REMARK   3   GROUP  1  B-FACTOR           (A**2) : NULL  ; NULL                 
REMARK   3                                                                      
REMARK   3  PARAMETER FILE  1  : NULL                                           
REMARK   3  TOPOLOGY FILE  1   : NULL                                           
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 1DMN COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 16-DEC-99.                  
REMARK 100 THE DEPOSITION ID IS D_1000010215.                                   
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 20-NOV-99                          
REMARK 200  TEMPERATURE           (KELVIN) : 295                                
REMARK 200  PH                             : 4.6                                
REMARK 200  NUMBER OF CRYSTALS USED        : 1                                  
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : N                                  
REMARK 200  RADIATION SOURCE               : ROTATING ANODE                     
REMARK 200  BEAMLINE                       : NULL                               
REMARK 200  X-RAY GENERATOR MODEL          : MACSCIENCE                         
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 1.5418                             
REMARK 200  MONOCHROMATOR                  : NULL                               
REMARK 200  OPTICS                         : NULL                               
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : IMAGE PLATE                        
REMARK 200  DETECTOR MANUFACTURER          : MACSCIENCE                         
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : DENZO                              
REMARK 200  DATA SCALING SOFTWARE          : SCALEPACK                          
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 8592                               
REMARK 200  RESOLUTION RANGE HIGH      (A) : 2.050                              
REMARK 200  RESOLUTION RANGE LOW       (A) : 20.000                             
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : 0.500                              
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : 93.3                               
REMARK 200  DATA REDUNDANCY                : 5.500                              
REMARK 200  R MERGE                    (I) : 0.06600                            
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200   FOR THE DATA SET  : 14.5000                            
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.05                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : 2.12                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : 89.0                               
REMARK 200  DATA REDUNDANCY IN SHELL       : 2.30                               
REMARK 200  R MERGE FOR SHELL          (I) : 0.22000                            
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200   FOR SHELL         : NULL                               
REMARK 200                                                                      
REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH                              
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL                         
REMARK 200 SOFTWARE USED: X-PLOR                                                
REMARK 200 STARTING MODEL: NULL                                                 
REMARK 200                                                                      
REMARK 200 REMARK: NULL                                                         
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 45.39                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.25                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: SODIUM ACETATE, AMMONIUM ACETATE, PH     
REMARK 280  4.6, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 22K, TEMPERATURE    
REMARK 280  295.0K                                                              
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 2 2 21                         
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290       2555   -X,-Y,Z+1/2                                             
REMARK 290       3555   -X,Y,-Z+1/2                                             
REMARK 290       4555   X,-Y,-Z                                                 
REMARK 290       5555   X+1/2,Y+1/2,Z                                           
REMARK 290       6555   -X+1/2,-Y+1/2,Z+1/2                                     
REMARK 290       7555   -X+1/2,Y+1/2,-Z+1/2                                     
REMARK 290       8555   X+1/2,-Y+1/2,-Z                                         
REMARK 290                                                                      
REMARK 290     WHERE NNN -> OPERATOR NUMBER                                     
REMARK 290           MMM -> TRANSLATION VECTOR                                  
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS                            
REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM             
REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY                
REMARK 290 RELATED MOLECULES.                                                   
REMARK 290   SMTRY1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 290   SMTRY1   2 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   2  0.000000 -1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   2  0.000000  0.000000  1.000000       37.30000            
REMARK 290   SMTRY1   3 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   3  0.000000  1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   3  0.000000  0.000000 -1.000000       37.30000            
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        0.00000            
REMARK 290   SMTRY1   5  1.000000  0.000000  0.000000       18.18000            
REMARK 290   SMTRY2   5  0.000000  1.000000  0.000000       48.24000            
REMARK 290   SMTRY3   5  0.000000  0.000000  1.000000        0.00000            
REMARK 290   SMTRY1   6 -1.000000  0.000000  0.000000       18.18000            
REMARK 290   SMTRY2   6  0.000000 -1.000000  0.000000       48.24000            
REMARK 290   SMTRY3   6  0.000000  0.000000  1.000000       37.30000            
REMARK 290   SMTRY1   7 -1.000000  0.000000  0.000000       18.18000            
REMARK 290   SMTRY2   7  0.000000  1.000000  0.000000       48.24000            
REMARK 290   SMTRY3   7  0.000000  0.000000 -1.000000       37.30000            
REMARK 290   SMTRY1   8  1.000000  0.000000  0.000000       18.18000            
REMARK 290   SMTRY2   8  0.000000 -1.000000  0.000000       48.24000            
REMARK 290   SMTRY3   8  0.000000  0.000000 -1.000000        0.00000            
REMARK 290                                                                      
REMARK 290 REMARK: NULL                                                         
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1                                                       
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM                
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN                  
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON               
REMARK 300 BURIED SURFACE AREA.                                                 
REMARK 350                                                                      
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN           
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE                
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS          
REMARK 350 GIVEN BELOW.  BOTH NON-CRYSTALLOGRAPHIC AND                          
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.                               
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 1                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC                           
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A                                     
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 350   BIOMT1   2  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   2  0.000000 -1.000000  0.000000       96.48000            
REMARK 350   BIOMT3   2  0.000000  0.000000 -1.000000       74.60000            
REMARK 465                                                                      
REMARK 465 MISSING RESIDUES                                                     
REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE                       
REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.)                
REMARK 465                                                                      
REMARK 465   M RES C SSSEQI                                                     
REMARK 465     MET A     1                                                      
REMARK 465     GLY A    62                                                      
REMARK 465     GLY A    63                                                      
REMARK 465     GLY A    64                                                      
REMARK 465     ARG A   128                                                      
REMARK 465     GLU A   129                                                      
REMARK 465     PRO A   130                                                      
REMARK 465     GLN A   131                                                      
REMARK 470                                                                      
REMARK 470 MISSING ATOM                                                         
REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER;           
REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER;          
REMARK 470 I=INSERTION CODE):                                                   
REMARK 470   M RES CSSEQI  ATOMS                                                
REMARK 470     ASN A   2    CG   OD1  ND2                                       
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: COVALENT BOND ANGLES                                       
REMARK 500                                                                      
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES              
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE               
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                 
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)              
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999                        
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996                     
REMARK 500                                                                      
REMARK 500  M RES CSSEQI ATM1   ATM2   ATM3                                     
REMARK 500    LEU A  61   N   -  CA  -  C   ANGL. DEV. =  17.3 DEGREES          
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: TORSION ANGLES                                             
REMARK 500                                                                      
REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:            
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)                    
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-           
REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400            
REMARK 500                                                                      
REMARK 500  M RES CSSEQI        PSI       PHI                                   
REMARK 500    LYS A  65       15.19    173.73                                   
REMARK 500    GLU A 109        5.49    -59.64                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 8CHO   RELATED DB: PDB                                   
REMARK 900 8CHO CONTAINS THE SAME PROTEIN COMPLEXED WITH POLYETHYLENE 400       
REMARK 900 RELATED ID: 1QJG   RELATED DB: PDB                                   
REMARK 900 1QJG CONTAINS THE SAME PROTEIN COMPLEXED WITH EQUILENIN              
REMARK 900 RELATED ID: 1DMM   RELATED DB: PDB                                   
REMARK 900 SAME PROTEIN, Y57F MUTATION                                          
REMARK 900 RELATED ID: 1DMN   RELATED DB: PDB                                   
REMARK 900 SAME PROTEIN, Y32F/Y57F MUTATION                                     
REMARK 900 RELATED ID: 1DMQ   RELATED DB: PDB                                   
REMARK 900 SAME PROTEIN, Y32F MUTATION                                          
DBREF  1DMN A    1   131  UNP    P07445   SDIS_PSEPU       1    131             
SEQADV 1DMN PHE A   32  UNP  P07445    TYR    32 ENGINEERED                     
SEQADV 1DMN PHE A   57  UNP  P07445    TYR    57 ENGINEERED                     
SEQRES   1 A  131  MET ASN LEU PRO THR ALA GLN GLU VAL GLN GLY LEU MET          
SEQRES   2 A  131  ALA ARG TYR ILE GLU LEU VAL ASP VAL GLY ASP ILE GLU          
SEQRES   3 A  131  ALA ILE VAL GLN MET PHE ALA ASP ASP ALA THR VAL GLU          
SEQRES   4 A  131  ASP PRO PHE GLY GLN PRO PRO ILE HIS GLY ARG GLU GLN          
SEQRES   5 A  131  ILE ALA ALA PHE PHE ARG GLN GLY LEU GLY GLY GLY LYS          
SEQRES   6 A  131  VAL ARG ALA CYS LEU THR GLY PRO VAL ARG ALA SER HIS          
SEQRES   7 A  131  ASN GLY CYS GLY ALA MET PRO PHE ARG VAL GLU MET VAL          
SEQRES   8 A  131  TRP ASN GLY GLN PRO CYS ALA LEU ASP VAL ILE ASP VAL          
SEQRES   9 A  131  MET ARG PHE ASP GLU HIS GLY ARG ILE GLN THR MET GLN          
SEQRES  10 A  131  ALA TYR TRP SER GLU VAL ASN LEU SER VAL ARG GLU PRO          
SEQRES  11 A  131  GLN                                                          
FORMUL   2  HOH   *48(H2 O)                                                     
HELIX    1   1 THR A    5  GLY A   23  1                                  19    
HELIX    2   2 ASP A   24  GLN A   30  1                                   7    
HELIX    3   3 GLY A   49  LEU A   61  1                                  13    
HELIX    4   4 SER A  121  VAL A  123  5                                   3    
SHEET    1   A10 ILE A  47  HIS A  48  0                                        
SHEET    2   A10 PHE A  32  GLU A  39 -1  N  VAL A  38   O  ILE A  47           
SHEET    3   A10 ILE A 113  TYR A 119  1  O  ILE A 113   N  ALA A  33           
SHEET    4   A10 GLN A  95  PHE A 107 -1  O  ILE A 102   N  TYR A 119           
SHEET    5   A10 LEU A 125  SER A 126 -1  N  SER A 126   O  ALA A  98           
SHEET    6   A10 GLN A  95  PHE A 107 -1  O  ALA A  98   N  SER A 126           
SHEET    7   A10 CYS A  81  TRP A  92 -1  O  GLY A  82   N  MET A 105           
SHEET    8   A10 ARG A  75  ALA A  76 -1  N  ARG A  75   O  ALA A  83           
SHEET    9   A10 CYS A  81  TRP A  92 -1  O  ALA A  83   N  ARG A  75           
SHEET   10   A10 ARG A  67  LEU A  70 -1  O  ARG A  67   N  GLU A  89           
CISPEP   1 ASP A   40    PRO A   41          0        -0.52                     
CRYST1   36.360   96.480   74.600  90.00  90.00  90.00 C 2 2 21      8          
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      0.027503  0.000000  0.000000        0.00000                         
SCALE2      0.000000  0.010365  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.013405        0.00000                         
ATOM      1  N   ASN A   2      13.886  62.425  54.498  1.00 56.82           N  
ATOM      2  CA  ASN A   2      14.639  61.106  54.506  1.00 55.85           C  
ATOM      3  C   ASN A   2      14.078  60.117  53.476  1.00 52.05           C  
ATOM      4  O   ASN A   2      13.134  60.456  52.742  1.00 52.16           O  
ATOM      5  CB  ASN A   2      14.622  60.472  55.928  1.00 56.79           C  
ATOM      6  N   LEU A   3      14.678  58.919  53.398  1.00 47.22           N  
ATOM      7  CA  LEU A   3      14.208  57.883  52.467  1.00 41.01           C  
ATOM      8  C   LEU A   3      12.727  57.682  52.797  1.00 36.66           C  
ATOM      9  O   LEU A   3      12.359  57.351  53.939  1.00 38.23           O  
ATOM     10  CB  LEU A   3      14.989  56.576  52.625  1.00 38.14           C  
ATOM     11  CG  LEU A   3      14.954  55.737  51.347  1.00 39.87           C  
ATOM     12  CD1 LEU A   3      15.537  56.530  50.184  1.00 39.44           C  
ATOM     13  CD2 LEU A   3      15.736  54.453  51.551  1.00 41.20           C  
ATOM     14  N   PRO A   4      11.849  58.004  51.835  1.00 31.36           N  
ATOM     15  CA  PRO A   4      10.463  57.797  52.237  1.00 28.22           C  
ATOM     16  C   PRO A   4      10.154  56.326  52.604  1.00 24.11           C  
ATOM     17  O   PRO A   4      10.835  55.408  52.180  1.00 22.09           O  
ATOM     18  CB  PRO A   4       9.675  58.346  51.035  1.00 26.67           C  
ATOM     19  CG  PRO A   4      10.629  58.238  49.908  1.00 28.67           C  
ATOM     20  CD  PRO A   4      11.957  58.547  50.467  1.00 28.53           C  
ATOM     21  N   THR A   5       9.244  56.153  53.536  1.00 23.07           N  
ATOM     22  CA  THR A   5       8.804  54.840  53.951  1.00 22.22           C  
ATOM     23  C   THR A   5       7.814  54.352  52.896  1.00 21.55           C  
ATOM     24  O   THR A   5       7.398  55.133  52.030  1.00 22.26           O  
ATOM     25  CB  THR A   5       8.096  54.918  55.326  1.00 24.06           C  
ATOM     26  OG1 THR A   5       6.985  55.833  55.276  1.00 23.09           O  
ATOM     27  CG2 THR A   5       9.070  55.409  56.417  1.00 25.45           C  
ATOM     28  N   ALA A   6       7.388  53.098  53.011  1.00 18.41           N  
ATOM     29  CA  ALA A   6       6.444  52.517  52.075  1.00 18.36           C  
ATOM     30  C   ALA A   6       5.203  53.391  51.906  1.00 19.48           C  
ATOM     31  O   ALA A   6       4.726  53.595  50.798  1.00 19.76           O  
ATOM     32  CB  ALA A   6       6.068  51.126  52.506  1.00 16.90           C  
ATOM     33  N   GLN A   7       4.687  53.908  53.010  1.00 22.25           N  
ATOM     34  CA  GLN A   7       3.515  54.787  53.001  1.00 25.76           C  
ATOM     35  C   GLN A   7       3.781  56.161  52.392  1.00 24.91           C  
ATOM     36  O   GLN A   7       2.868  56.778  51.827  1.00 25.24           O  
ATOM     37  CB  GLN A   7       2.949  54.965  54.408  1.00 29.72           C  
ATOM     38  CG  GLN A   7       1.993  53.865  54.770  1.00 45.39           C  
ATOM     39  CD  GLN A   7       1.787  53.674  56.272  1.00 53.65           C  
ATOM     40  OE1 GLN A   7       1.426  52.566  56.725  1.00 57.99           O  
ATOM     41  NE2 GLN A   7       1.956  54.765  57.055  1.00 58.38           N  
ATOM     42  N   GLU A   8       5.005  56.664  52.552  1.00 25.40           N  
ATOM     43  CA  GLU A   8       5.361  57.968  51.998  1.00 24.43           C  
ATOM     44  C   GLU A   8       5.492  57.833  50.510  1.00 22.85           C  
ATOM     45  O   GLU A   8       5.051  58.710  49.788  1.00 25.80           O  
ATOM     46  CB  GLU A   8       6.621  58.529  52.630  1.00 24.21           C  
ATOM     47  CG  GLU A   8       6.385  58.728  54.095  1.00 28.88           C  
ATOM     48  CD  GLU A   8       7.545  59.287  54.842  1.00 33.24           C  
ATOM     49  OE1 GLU A   8       7.293  60.292  55.545  1.00 39.34           O  
ATOM     50  OE2 GLU A   8       8.677  58.749  54.775  1.00 32.85           O  
ATOM     51  N   VAL A   9       6.049  56.712  50.054  1.00 18.56           N  
ATOM     52  CA  VAL A   9       6.178  56.460  48.640  1.00 14.26           C  
ATOM     53  C   VAL A   9       4.804  56.449  47.962  1.00 12.93           C  
ATOM     54  O   VAL A   9       4.671  57.065  46.919  1.00 15.05           O  
ATOM     55  CB  VAL A   9       6.981  55.211  48.364  1.00 10.06           C  
ATOM     56  CG1 VAL A   9       6.983  54.898  46.883  1.00  9.10           C  
ATOM     57  CG2 VAL A   9       8.387  55.448  48.818  1.00  9.18           C  
ATOM     58  N   GLN A  10       3.775  55.836  48.561  1.00 13.76           N  
ATOM     59  CA  GLN A  10       2.428  55.842  47.961  1.00 13.56           C  
ATOM     60  C   GLN A  10       1.868  57.251  47.839  1.00 13.86           C  
ATOM     61  O   GLN A  10       1.206  57.568  46.864  1.00 14.92           O  
ATOM     62  CB  GLN A  10       1.411  54.992  48.737  1.00  9.14           C  
ATOM     63  CG  GLN A  10       1.711  53.519  48.720  1.00 15.96           C  
ATOM     64  CD  GLN A  10       0.656  52.706  49.435  1.00 17.95           C  
ATOM     65  OE1 GLN A  10       0.006  51.863  48.827  1.00 20.79           O  
ATOM     66  NE2 GLN A  10       0.497  52.940  50.747  1.00 13.82           N  
ATOM     67  N   GLY A  11       2.113  58.090  48.840  1.00 15.43           N  
ATOM     68  CA  GLY A  11       1.639  59.465  48.780  1.00 12.83           C  
ATOM     69  C   GLY A  11       2.347  60.338  47.750  1.00 10.68           C  
ATOM     70  O   GLY A  11       1.712  61.126  47.075  1.00 13.34           O  
ATOM     71  N   LEU A  12       3.665  60.206  47.630  1.00 11.31           N  
ATOM     72  CA  LEU A  12       4.425  61.000  46.682  1.00 12.13           C  
ATOM     73  C   LEU A  12       4.056  60.655  45.241  1.00 15.36           C  
ATOM     74  O   LEU A  12       3.959  61.540  44.350  1.00 12.87           O  
ATOM     75  CB  LEU A  12       5.929  60.785  46.897  1.00 13.96           C  
ATOM     76  CG  LEU A  12       6.578  61.358  48.171  1.00 17.21           C  
ATOM     77  CD1 LEU A  12       7.968  60.774  48.383  1.00 20.14           C  
ATOM     78  CD2 LEU A  12       6.670  62.853  48.097  1.00 17.35           C  
ATOM     79  N   MET A  13       3.898  59.350  45.006  1.00 13.32           N  
ATOM     80  CA  MET A  13       3.581  58.864  43.676  1.00 11.94           C  
ATOM     81  C   MET A  13       2.200  59.219  43.253  1.00  9.02           C  
ATOM     82  O   MET A  13       1.971  59.441  42.103  1.00 10.84           O  
ATOM     83  CB  MET A  13       3.863  57.379  43.543  1.00 14.13           C  
ATOM     84  CG  MET A  13       5.328  57.083  43.505  1.00 12.37           C  
ATOM     85  SD  MET A  13       5.704  55.341  43.229  1.00 17.23           S  
ATOM     86  CE  MET A  13       5.654  55.189  41.536  1.00  8.69           C  
ATOM     87  N   ALA A  14       1.270  59.265  44.182  1.00  9.55           N  
ATOM     88  CA  ALA A  14      -0.102  59.697  43.880  1.00 12.13           C  
ATOM     89  C   ALA A  14      -0.148  61.215  43.613  1.00 12.29           C  
ATOM     90  O   ALA A  14      -0.944  61.711  42.815  1.00 12.94           O  
ATOM     91  CB  ALA A  14      -1.004  59.380  45.053  1.00 13.92           C  
ATOM     92  N   ARG A  15       0.734  61.940  44.281  1.00 13.75           N  
ATOM     93  CA  ARG A  15       0.788  63.381  44.103  1.00 15.94           C  
ATOM     94  C   ARG A  15       1.245  63.641  42.703  1.00 15.40           C  
ATOM     95  O   ARG A  15       0.732  64.524  42.019  1.00 15.20           O  
ATOM     96  CB  ARG A  15       1.781  64.039  45.063  1.00 15.93           C  
ATOM     97  CG  ARG A  15       1.984  65.499  44.700  1.00 20.98           C  
ATOM     98  CD  ARG A  15       2.453  66.280  45.904  1.00 24.16           C  
ATOM     99  NE  ARG A  15       2.433  67.732  45.695  1.00 24.80           N  
ATOM    100  CZ  ARG A  15       3.531  68.450  45.485  1.00 25.60           C  
ATOM    101  NH1 ARG A  15       4.705  67.823  45.451  1.00 26.71           N  
ATOM    102  NH2 ARG A  15       3.474  69.780  45.423  1.00 23.63           N  
ATOM    103  N   TYR A  16       2.258  62.881  42.310  1.00 13.68           N  
ATOM    104  CA  TYR A  16       2.837  63.000  40.994  1.00 11.59           C  
ATOM    105  C   TYR A  16       1.796  62.933  39.868  1.00 11.77           C  
ATOM    106  O   TYR A  16       1.790  63.786  38.981  1.00  9.29           O  
ATOM    107  CB  TYR A  16       3.975  61.985  40.867  1.00 11.78           C  
ATOM    108  CG  TYR A  16       4.564  61.919  39.505  1.00  9.67           C  
ATOM    109  CD1 TYR A  16       5.639  62.732  39.133  1.00  9.37           C  
ATOM    110  CD2 TYR A  16       3.989  61.101  38.571  1.00  9.28           C  
ATOM    111  CE1 TYR A  16       6.119  62.695  37.841  1.00  8.81           C  
ATOM    112  CE2 TYR A  16       4.453  61.048  37.304  1.00 10.84           C  
ATOM    113  CZ  TYR A  16       5.499  61.844  36.925  1.00 11.54           C  
ATOM    114  OH  TYR A  16       5.929  61.729  35.624  1.00 13.08           O  
ATOM    115  N   ILE A  17       0.906  61.940  39.916  1.00 12.37           N  
ATOM    116  CA  ILE A  17      -0.173  61.799  38.923  1.00 11.92           C  
ATOM    117  C   ILE A  17      -1.175  62.995  39.001  1.00 10.86           C  
ATOM    118  O   ILE A  17      -1.758  63.392  38.019  1.00 11.57           O  
ATOM    119  CB  ILE A  17      -0.922  60.451  39.162  1.00 10.34           C  
ATOM    120  CG1 ILE A  17      -0.049  59.264  38.724  1.00  8.33           C  
ATOM    121  CG2 ILE A  17      -2.214  60.447  38.427  1.00 13.24           C  
ATOM    122  CD1 ILE A  17       0.364  59.322  37.281  1.00 13.07           C  
ATOM    123  N   GLU A  18      -1.366  63.518  40.198  1.00 16.37           N  
ATOM    124  CA  GLU A  18      -2.219  64.675  40.478  1.00 21.80           C  
ATOM    125  C   GLU A  18      -1.648  65.866  39.690  1.00 19.11           C  
ATOM    126  O   GLU A  18      -2.372  66.608  39.008  1.00 18.19           O  
ATOM    127  CB  GLU A  18      -2.081  65.006  41.967  1.00 29.47           C  
ATOM    128  CG  GLU A  18      -3.301  65.496  42.670  1.00 41.48           C  
ATOM    129  CD  GLU A  18      -3.869  64.431  43.577  1.00 48.48           C  
ATOM    130  OE1 GLU A  18      -3.587  64.501  44.803  1.00 51.07           O  
ATOM    131  OE2 GLU A  18      -4.601  63.548  43.072  1.00 53.00           O  
ATOM    132  N   LEU A  19      -0.343  66.076  39.852  1.00 14.72           N  
ATOM    133  CA  LEU A  19       0.348  67.160  39.180  1.00 15.09           C  
ATOM    134  C   LEU A  19       0.351  67.004  37.678  1.00 15.86           C  
ATOM    135  O   LEU A  19       0.257  67.996  36.965  1.00 18.94           O  
ATOM    136  CB  LEU A  19       1.760  67.280  39.707  1.00 10.06           C  
ATOM    137  CG  LEU A  19       1.763  67.723  41.140  1.00 13.09           C  
ATOM    138  CD1 LEU A  19       3.182  67.857  41.632  1.00 12.09           C  
ATOM    139  CD2 LEU A  19       1.058  69.033  41.157  1.00 10.20           C  
ATOM    140  N   VAL A  20       0.555  65.790  37.174  1.00 13.96           N  
ATOM    141  CA  VAL A  20       0.523  65.586  35.720  1.00 13.84           C  
ATOM    142  C   VAL A  20      -0.877  65.861  35.206  1.00 14.89           C  
ATOM    143  O   VAL A  20      -1.033  66.370  34.125  1.00 17.97           O  
ATOM    144  CB  VAL A  20       0.885  64.128  35.301  1.00 13.65           C  
ATOM    145  CG1 VAL A  20       0.628  63.920  33.812  1.00 12.07           C  
ATOM    146  CG2 VAL A  20       2.367  63.847  35.581  1.00 13.57           C  
ATOM    147  N   ASP A  21      -1.885  65.450  35.957  1.00 14.21           N  
ATOM    148  CA  ASP A  21      -3.259  65.659  35.534  1.00 18.74           C  
ATOM    149  C   ASP A  21      -3.649  67.147  35.365  1.00 19.18           C  
ATOM    150  O   ASP A  21      -4.284  67.489  34.354  1.00 18.85           O  
ATOM    151  CB  ASP A  21      -4.216  64.932  36.496  1.00 21.17           C  
ATOM    152  CG  ASP A  21      -5.690  64.964  36.032  1.00 23.06           C  
ATOM    153  OD1 ASP A  21      -5.983  64.585  34.866  1.00 20.41           O  
ATOM    154  OD2 ASP A  21      -6.550  65.331  36.867  1.00 26.74           O  
ATOM    155  N   VAL A  22      -3.289  67.997  36.351  1.00 19.01           N  
ATOM    156  CA  VAL A  22      -3.565  69.451  36.300  1.00 19.77           C  
ATOM    157  C   VAL A  22      -2.644  70.139  35.316  1.00 18.78           C  
ATOM    158  O   VAL A  22      -3.013  71.131  34.714  1.00 21.07           O  
ATOM    159  CB  VAL A  22      -3.487  70.224  37.683  1.00 16.94           C  
ATOM    160  CG1 VAL A  22      -4.511  69.740  38.614  1.00 21.22           C  
ATOM    161  CG2 VAL A  22      -2.144  70.147  38.318  1.00 18.39           C  
ATOM    162  N   GLY A  23      -1.417  69.640  35.209  1.00 14.79           N  
ATOM    163  CA  GLY A  23      -0.500  70.231  34.273  1.00 14.17           C  
ATOM    164  C   GLY A  23       0.330  71.327  34.881  1.00 12.69           C  
ATOM    165  O   GLY A  23       0.746  72.226  34.178  1.00 13.93           O  
ATOM    166  N   ASP A  24       0.591  71.242  36.176  1.00 11.35           N  
ATOM    167  CA  ASP A  24       1.415  72.214  36.846  1.00 11.43           C  
ATOM    168  C   ASP A  24       2.871  71.776  36.650  1.00 14.83           C  
ATOM    169  O   ASP A  24       3.443  71.013  37.447  1.00 12.95           O  
ATOM    170  CB  ASP A  24       1.054  72.241  38.299  1.00  9.61           C  
ATOM    171  CG  ASP A  24       1.583  73.448  39.012  1.00 13.76           C  
ATOM    172  OD1 ASP A  24       2.554  73.988  38.538  1.00 17.92           O  
ATOM    173  OD2 ASP A  24       1.044  73.810  40.064  1.00 15.89           O  
ATOM    174  N   ILE A  25       3.452  72.215  35.545  1.00 13.98           N  
ATOM    175  CA  ILE A  25       4.826  71.887  35.179  1.00 15.89           C  
ATOM    176  C   ILE A  25       5.946  72.243  36.157  1.00 17.25           C  
ATOM    177  O   ILE A  25       6.877  71.446  36.340  1.00 20.67           O  
ATOM    178  CB  ILE A  25       5.119  72.343  33.704  1.00 18.39           C  
ATOM    179  CG1 ILE A  25       4.157  71.575  32.793  1.00 18.97           C  
ATOM    180  CG2 ILE A  25       6.580  72.075  33.307  1.00 16.97           C  
ATOM    181  CD1 ILE A  25       4.116  72.069  31.445  1.00 24.74           C  
ATOM    182  N   GLU A  26       5.855  73.384  36.828  1.00 16.04           N  
ATOM    183  CA  GLU A  26       6.862  73.814  37.795  1.00 14.33           C  
ATOM    184  C   GLU A  26       6.833  72.943  39.023  1.00 14.36           C  
ATOM    185  O   GLU A  26       7.870  72.551  39.529  1.00 14.72           O  
ATOM    186  CB  GLU A  26       6.695  75.307  38.148  1.00 19.30           C  
ATOM    187  CG  GLU A  26       7.041  76.228  36.932  1.00 27.45           C  
ATOM    188  CD  GLU A  26       6.713  77.722  37.125  1.00 33.67           C  
ATOM    189  OE1 GLU A  26       6.784  78.482  36.121  1.00 36.42           O  
ATOM    190  OE2 GLU A  26       6.413  78.161  38.257  1.00 35.20           O  
ATOM    191  N   ALA A  27       5.641  72.589  39.490  1.00 13.84           N  
ATOM    192  CA  ALA A  27       5.481  71.705  40.642  1.00 11.79           C  
ATOM    193  C   ALA A  27       5.962  70.267  40.277  1.00 10.95           C  
ATOM    194  O   ALA A  27       6.540  69.587  41.095  1.00 12.32           O  
ATOM    195  CB  ALA A  27       4.006  71.708  41.120  1.00  9.47           C  
ATOM    196  N   ILE A  28       5.764  69.811  39.050  1.00 11.67           N  
ATOM    197  CA  ILE A  28       6.233  68.473  38.692  1.00 11.63           C  
ATOM    198  C   ILE A  28       7.748  68.427  38.724  1.00 10.74           C  
ATOM    199  O   ILE A  28       8.369  67.547  39.324  1.00 10.63           O  
ATOM    200  CB  ILE A  28       5.759  68.122  37.279  1.00 12.29           C  
ATOM    201  CG1 ILE A  28       4.257  67.891  37.318  1.00 12.23           C  
ATOM    202  CG2 ILE A  28       6.469  66.865  36.774  1.00 13.46           C  
ATOM    203  CD1 ILE A  28       3.682  67.741  35.952  1.00 12.34           C  
ATOM    204  N   VAL A  29       8.350  69.378  38.042  1.00  9.58           N  
ATOM    205  CA  VAL A  29       9.794  69.455  37.964  1.00 10.80           C  
ATOM    206  C   VAL A  29      10.489  69.432  39.320  1.00 13.46           C  
ATOM    207  O   VAL A  29      11.564  68.836  39.481  1.00 10.84           O  
ATOM    208  CB  VAL A  29      10.227  70.729  37.145  1.00 15.15           C  
ATOM    209  CG1 VAL A  29      11.762  70.826  37.067  1.00 14.82           C  
ATOM    210  CG2 VAL A  29       9.610  70.689  35.708  1.00 11.41           C  
ATOM    211  N   GLN A  30       9.869  70.081  40.291  1.00 11.54           N  
ATOM    212  CA  GLN A  30      10.431  70.178  41.630  1.00 16.49           C  
ATOM    213  C   GLN A  30      10.323  68.863  42.440  1.00 13.97           C  
ATOM    214  O   GLN A  30      10.893  68.739  43.499  1.00 13.82           O  
ATOM    215  CB  GLN A  30       9.840  71.409  42.359  1.00 23.56           C  
ATOM    216  CG  GLN A  30      10.400  71.663  43.781  1.00 41.47           C  
ATOM    217  CD  GLN A  30      11.476  72.757  43.892  1.00 48.69           C  
ATOM    218  OE1 GLN A  30      11.185  73.944  43.680  1.00 57.07           O  
ATOM    219  NE2 GLN A  30      12.660  72.385  44.396  1.00 51.31           N  
ATOM    220  N   MET A  31       9.612  67.872  41.918  1.00 13.75           N  
ATOM    221  CA  MET A  31       9.529  66.597  42.612  1.00 12.81           C  
ATOM    222  C   MET A  31      10.782  65.793  42.348  1.00 12.64           C  
ATOM    223  O   MET A  31      11.063  64.835  43.059  1.00 13.61           O  
ATOM    224  CB  MET A  31       8.296  65.806  42.154  1.00 13.62           C  
ATOM    225  CG  MET A  31       7.028  66.285  42.828  1.00 12.47           C  
ATOM    226  SD  MET A  31       5.669  65.178  42.584  1.00 17.37           S  
ATOM    227  CE  MET A  31       5.964  64.064  43.934  1.00  9.51           C  
ATOM    228  N   PHE A  32      11.490  66.138  41.269  1.00 12.22           N  
ATOM    229  CA  PHE A  32      12.711  65.444  40.890  1.00 10.70           C  
ATOM    230  C   PHE A  32      13.972  66.036  41.529  1.00 14.69           C  
ATOM    231  O   PHE A  32      13.995  67.198  41.941  1.00 12.87           O  
ATOM    232  CB  PHE A  32      12.890  65.470  39.367  1.00 11.52           C  
ATOM    233  CG  PHE A  32      11.860  64.689  38.618  1.00  9.64           C  
ATOM    234  CD1 PHE A  32      10.619  65.244  38.344  1.00 10.37           C  
ATOM    235  CD2 PHE A  32      12.117  63.385  38.234  1.00 10.44           C  
ATOM    236  CE1 PHE A  32       9.627  64.529  37.702  1.00  7.79           C  
ATOM    237  CE2 PHE A  32      11.143  62.641  37.585  1.00 10.49           C  
ATOM    238  CZ  PHE A  32       9.878  63.210  37.316  1.00  9.28           C  
ATOM    239  N   ALA A  33      14.991  65.196  41.685  1.00 11.80           N  
ATOM    240  CA  ALA A  33      16.259  65.651  42.195  1.00  9.48           C  
ATOM    241  C   ALA A  33      16.839  66.502  41.031  1.00 11.24           C  
ATOM    242  O   ALA A  33      16.443  66.356  39.833  1.00  9.95           O  
ATOM    243  CB  ALA A  33      17.137  64.457  42.498  1.00  9.43           C  
ATOM    244  N   ASP A  34      17.746  67.414  41.363  1.00 14.24           N  
ATOM    245  CA  ASP A  34      18.341  68.331  40.391  1.00 14.15           C  
ATOM    246  C   ASP A  34      19.018  67.638  39.237  1.00 14.45           C  
ATOM    247  O   ASP A  34      18.917  68.110  38.110  1.00 12.40           O  
ATOM    248  CB  ASP A  34      19.317  69.327  41.063  1.00 18.02           C  
ATOM    249  CG  ASP A  34      20.551  68.652  41.706  1.00 18.21           C  
ATOM    250  OD1 ASP A  34      20.458  68.261  42.872  1.00 21.95           O  
ATOM    251  OD2 ASP A  34      21.617  68.582  41.088  1.00 21.20           O  
ATOM    252  N   ASP A  35      19.547  66.445  39.517  1.00 14.99           N  
ATOM    253  CA  ASP A  35      20.247  65.624  38.565  1.00 14.39           C  
ATOM    254  C   ASP A  35      19.542  64.287  38.300  1.00 14.88           C  
ATOM    255  O   ASP A  35      20.146  63.335  37.835  1.00 15.90           O  
ATOM    256  CB  ASP A  35      21.634  65.359  39.104  1.00 18.18           C  
ATOM    257  CG  ASP A  35      21.616  64.622  40.419  1.00 20.68           C  
ATOM    258  OD1 ASP A  35      20.611  64.664  41.140  1.00 21.48           O  
ATOM    259  OD2 ASP A  35      22.618  63.932  40.725  1.00 28.36           O  
ATOM    260  N   ALA A  36      18.242  64.222  38.519  1.00 11.52           N  
ATOM    261  CA  ALA A  36      17.470  63.007  38.266  1.00 12.13           C  
ATOM    262  C   ALA A  36      17.563  62.616  36.795  1.00 13.24           C  
ATOM    263  O   ALA A  36      17.863  63.457  35.957  1.00 14.92           O  
ATOM    264  CB  ALA A  36      16.033  63.299  38.580  1.00  8.12           C  
ATOM    265  N   THR A  37      17.327  61.347  36.466  1.00 14.75           N  
ATOM    266  CA  THR A  37      17.302  60.903  35.057  1.00 15.50           C  
ATOM    267  C   THR A  37      15.947  60.231  34.791  1.00 15.04           C  
ATOM    268  O   THR A  37      15.331  59.701  35.714  1.00 17.17           O  
ATOM    269  CB  THR A  37      18.460  59.967  34.645  1.00 17.44           C  
ATOM    270  OG1 THR A  37      17.986  58.648  34.566  1.00 25.02           O  
ATOM    271  CG2 THR A  37      19.633  60.031  35.597  1.00 17.80           C  
ATOM    272  N   VAL A  38      15.392  60.438  33.606  1.00 12.20           N  
ATOM    273  CA  VAL A  38      14.094  59.882  33.273  1.00 11.34           C  
ATOM    274  C   VAL A  38      14.274  59.032  32.037  1.00 13.27           C  
ATOM    275  O   VAL A  38      15.081  59.380  31.197  1.00 10.72           O  
ATOM    276  CB  VAL A  38      13.107  61.034  32.975  1.00 15.78           C  
ATOM    277  CG1 VAL A  38      11.812  60.545  32.355  1.00 16.07           C  
ATOM    278  CG2 VAL A  38      12.800  61.762  34.258  1.00 11.19           C  
ATOM    279  N   GLU A  39      13.613  57.874  31.974  1.00 15.69           N  
ATOM    280  CA  GLU A  39      13.662  56.987  30.777  1.00 15.85           C  
ATOM    281  C   GLU A  39      12.217  56.735  30.463  1.00 17.01           C  
ATOM    282  O   GLU A  39      11.537  55.992  31.165  1.00 15.67           O  
ATOM    283  CB  GLU A  39      14.393  55.683  31.048  1.00 16.90           C  
ATOM    284  CG  GLU A  39      15.799  55.949  31.391  1.00 18.47           C  
ATOM    285  CD  GLU A  39      16.552  54.750  31.783  1.00 21.62           C  
ATOM    286  OE1 GLU A  39      16.660  54.445  32.987  1.00 22.41           O  
ATOM    287  OE2 GLU A  39      17.093  54.093  30.882  1.00 25.20           O  
ATOM    288  N   ASP A  40      11.733  57.432  29.446  1.00 18.66           N  
ATOM    289  CA  ASP A  40      10.332  57.366  29.084  1.00 23.25           C  
ATOM    290  C   ASP A  40      10.178  57.551  27.564  1.00 24.95           C  
ATOM    291  O   ASP A  40      10.489  58.617  27.032  1.00 30.71           O  
ATOM    292  CB  ASP A  40       9.617  58.478  29.886  1.00 21.25           C  
ATOM    293  CG  ASP A  40       8.096  58.363  29.890  1.00 22.97           C  
ATOM    294  OD1 ASP A  40       7.500  57.876  28.905  1.00 24.15           O  
ATOM    295  OD2 ASP A  40       7.485  58.796  30.888  1.00 24.62           O  
ATOM    296  N   PRO A  41       9.822  56.487  26.821  1.00 25.26           N  
ATOM    297  CA  PRO A  41       9.565  55.126  27.301  1.00 25.65           C  
ATOM    298  C   PRO A  41      10.885  54.421  27.637  1.00 26.00           C  
ATOM    299  O   PRO A  41      11.945  54.861  27.198  1.00 25.85           O  
ATOM    300  CB  PRO A  41       8.866  54.454  26.099  1.00 24.89           C  
ATOM    301  CG  PRO A  41       9.444  55.197  24.908  1.00 26.20           C  
ATOM    302  CD  PRO A  41       9.440  56.631  25.398  1.00 21.63           C  
ATOM    303  N   PHE A  42      10.845  53.418  28.504  1.00 26.22           N  
ATOM    304  CA  PHE A  42      12.053  52.674  28.811  1.00 26.74           C  
ATOM    305  C   PHE A  42      12.507  52.024  27.497  1.00 26.47           C  
ATOM    306  O   PHE A  42      11.690  51.628  26.656  1.00 23.10           O  
ATOM    307  CB  PHE A  42      11.763  51.620  29.875  1.00 29.68           C  
ATOM    308  CG  PHE A  42      12.906  50.688  30.126  1.00 34.96           C  
ATOM    309  CD1 PHE A  42      13.864  50.977  31.094  1.00 35.55           C  
ATOM    310  CD2 PHE A  42      13.009  49.496  29.410  1.00 34.40           C  
ATOM    311  CE1 PHE A  42      14.905  50.074  31.340  1.00 37.05           C  
ATOM    312  CE2 PHE A  42      14.034  48.608  29.652  1.00 34.72           C  
ATOM    313  CZ  PHE A  42      14.983  48.891  30.617  1.00 36.04           C  
ATOM    314  N   GLY A  43      13.813  51.925  27.324  1.00 27.25           N  
ATOM    315  CA  GLY A  43      14.349  51.375  26.096  1.00 33.00           C  
ATOM    316  C   GLY A  43      14.913  52.550  25.322  1.00 35.51           C  
ATOM    317  O   GLY A  43      15.706  52.390  24.399  1.00 38.44           O  
ATOM    318  N   GLN A  44      14.456  53.740  25.703  1.00 38.07           N  
ATOM    319  CA  GLN A  44      14.868  55.020  25.127  1.00 38.17           C  
ATOM    320  C   GLN A  44      15.960  55.645  25.989  1.00 36.92           C  
ATOM    321  O   GLN A  44      15.974  55.516  27.209  1.00 37.45           O  
ATOM    322  CB  GLN A  44      13.697  55.996  25.140  1.00 43.04           C  
ATOM    323  CG  GLN A  44      13.694  56.993  24.038  1.00 48.17           C  
ATOM    324  CD  GLN A  44      13.130  56.390  22.785  1.00 54.19           C  
ATOM    325  OE1 GLN A  44      11.937  56.533  22.496  1.00 57.25           O  
ATOM    326  NE2 GLN A  44      13.976  55.681  22.036  1.00 55.34           N  
ATOM    327  N   PRO A  45      16.879  56.372  25.359  1.00 35.00           N  
ATOM    328  CA  PRO A  45      17.953  57.011  26.122  1.00 34.11           C  
ATOM    329  C   PRO A  45      17.406  57.986  27.187  1.00 31.11           C  
ATOM    330  O   PRO A  45      16.447  58.724  26.946  1.00 27.88           O  
ATOM    331  CB  PRO A  45      18.769  57.709  25.031  1.00 36.49           C  
ATOM    332  CG  PRO A  45      17.790  57.843  23.855  1.00 36.41           C  
ATOM    333  CD  PRO A  45      17.075  56.541  23.912  1.00 36.71           C  
ATOM    334  N   PRO A  46      18.050  58.036  28.353  1.00 29.50           N  
ATOM    335  CA  PRO A  46      17.585  58.920  29.429  1.00 29.62           C  
ATOM    336  C   PRO A  46      17.783  60.422  29.271  1.00 29.46           C  
ATOM    337  O   PRO A  46      18.640  60.880  28.490  1.00 28.90           O  
ATOM    338  CB  PRO A  46      18.335  58.398  30.661  1.00 30.77           C  
ATOM    339  CG  PRO A  46      19.604  57.865  30.091  1.00 31.64           C  
ATOM    340  CD  PRO A  46      19.184  57.199  28.782  1.00 32.37           C  
ATOM    341  N   ILE A  47      16.955  61.182  29.984  1.00 26.75           N  
ATOM    342  CA  ILE A  47      17.084  62.610  29.998  1.00 23.45           C  
ATOM    343  C   ILE A  47      17.544  62.843  31.419  1.00 20.93           C  
ATOM    344  O   ILE A  47      17.109  62.164  32.332  1.00 17.70           O  
ATOM    345  CB  ILE A  47      15.797  63.367  29.651  1.00 25.40           C  
ATOM    346  CG1 ILE A  47      14.987  63.587  30.879  1.00 26.69           C  
ATOM    347  CG2 ILE A  47      14.975  62.625  28.593  1.00 27.60           C  
ATOM    348  CD1 ILE A  47      13.851  64.413  30.600  1.00 34.21           C  
ATOM    349  N   HIS A  48      18.530  63.718  31.561  1.00 21.42           N  
ATOM    350  CA  HIS A  48      19.144  64.047  32.833  1.00 20.47           C  
ATOM    351  C   HIS A  48      18.970  65.490  33.247  1.00 17.30           C  
ATOM    352  O   HIS A  48      19.173  66.378  32.448  1.00 16.09           O  
ATOM    353  CB  HIS A  48      20.665  63.768  32.777  1.00 27.88           C  
ATOM    354  CG  HIS A  48      21.362  63.976  34.099  1.00 37.75           C  
ATOM    355  ND1 HIS A  48      21.598  62.962  34.997  1.00 42.35           N  
ATOM    356  CD2 HIS A  48      21.812  65.119  34.701  1.00 43.10           C  
ATOM    357  CE1 HIS A  48      22.156  63.441  36.085  1.00 44.49           C  
ATOM    358  NE2 HIS A  48      22.296  64.754  35.943  1.00 46.84           N  
ATOM    359  N   GLY A  49      18.767  65.677  34.542  1.00 13.75           N  
ATOM    360  CA  GLY A  49      18.647  66.989  35.127  1.00 10.67           C  
ATOM    361  C   GLY A  49      17.361  67.732  34.915  1.00  8.28           C  
ATOM    362  O   GLY A  49      16.666  67.544  33.902  1.00  8.87           O  
ATOM    363  N   ARG A  50      17.038  68.586  35.881  1.00  8.45           N  
ATOM    364  CA  ARG A  50      15.834  69.380  35.830  1.00  9.28           C  
ATOM    365  C   ARG A  50      15.621  70.200  34.567  1.00 12.11           C  
ATOM    366  O   ARG A  50      14.485  70.322  34.116  1.00 14.18           O  
ATOM    367  CB  ARG A  50      15.783  70.274  37.043  1.00  7.25           C  
ATOM    368  CG  ARG A  50      15.144  69.618  38.188  1.00  7.93           C  
ATOM    369  CD  ARG A  50      15.441  70.454  39.366  1.00  8.20           C  
ATOM    370  NE  ARG A  50      14.856  69.902  40.576  1.00 14.91           N  
ATOM    371  CZ  ARG A  50      14.798  70.538  41.744  1.00 14.42           C  
ATOM    372  NH1 ARG A  50      15.297  71.770  41.880  1.00 16.20           N  
ATOM    373  NH2 ARG A  50      14.302  69.903  42.789  1.00 13.80           N  
ATOM    374  N   GLU A  51      16.665  70.807  34.014  1.00 13.01           N  
ATOM    375  CA  GLU A  51      16.467  71.569  32.795  1.00 13.67           C  
ATOM    376  C   GLU A  51      15.841  70.667  31.728  1.00 11.70           C  
ATOM    377  O   GLU A  51      14.803  70.994  31.184  1.00 15.03           O  
ATOM    378  CB  GLU A  51      17.774  72.187  32.249  1.00 16.88           C  
ATOM    379  CG  GLU A  51      17.539  73.122  30.998  1.00 23.23           C  
ATOM    380  CD  GLU A  51      18.788  73.484  30.169  1.00 26.56           C  
ATOM    381  OE1 GLU A  51      19.915  73.089  30.488  1.00 28.10           O  
ATOM    382  OE2 GLU A  51      18.614  74.215  29.170  1.00 32.30           O  
ATOM    383  N   GLN A  52      16.455  69.533  31.433  1.00 13.81           N  
ATOM    384  CA  GLN A  52      15.942  68.612  30.414  1.00 13.09           C  
ATOM    385  C   GLN A  52      14.587  67.989  30.750  1.00 13.19           C  
ATOM    386  O   GLN A  52      13.767  67.755  29.880  1.00 13.32           O  
ATOM    387  CB  GLN A  52      16.980  67.524  30.151  1.00 19.38           C  
ATOM    388  CG  GLN A  52      18.242  68.069  29.439  1.00 28.87           C  
ATOM    389  CD  GLN A  52      19.331  67.009  29.145  1.00 35.97           C  
ATOM    390  OE1 GLN A  52      19.044  65.828  28.829  1.00 36.57           O  
ATOM    391  NE2 GLN A  52      20.597  67.446  29.216  1.00 38.10           N  
ATOM    392  N   ILE A  53      14.314  67.805  32.029  1.00 13.12           N  
ATOM    393  CA  ILE A  53      13.054  67.215  32.449  1.00 11.28           C  
ATOM    394  C   ILE A  53      11.933  68.240  32.292  1.00 14.67           C  
ATOM    395  O   ILE A  53      10.826  67.899  31.851  1.00 12.61           O  
ATOM    396  CB  ILE A  53      13.202  66.697  33.907  1.00 13.32           C  
ATOM    397  CG1 ILE A  53      14.187  65.525  33.914  1.00  8.48           C  
ATOM    398  CG2 ILE A  53      11.878  66.379  34.544  1.00 10.26           C  
ATOM    399  CD1 ILE A  53      14.569  65.053  35.300  1.00 10.67           C  
ATOM    400  N   ALA A  54      12.222  69.502  32.620  1.00 13.07           N  
ATOM    401  CA  ALA A  54      11.217  70.521  32.505  1.00 12.57           C  
ATOM    402  C   ALA A  54      10.871  70.629  31.038  1.00 13.24           C  
ATOM    403  O   ALA A  54       9.696  70.697  30.676  1.00 16.41           O  
ATOM    404  CB  ALA A  54      11.752  71.832  33.045  1.00 14.37           C  
ATOM    405  N   ALA A  55      11.884  70.571  30.174  1.00 12.68           N  
ATOM    406  CA  ALA A  55      11.639  70.670  28.750  1.00 14.11           C  
ATOM    407  C   ALA A  55      10.787  69.488  28.226  1.00 19.45           C  
ATOM    408  O   ALA A  55       9.868  69.685  27.421  1.00 20.45           O  
ATOM    409  CB  ALA A  55      12.955  70.776  28.017  1.00 15.95           C  
ATOM    410  N   PHE A  56      11.091  68.270  28.685  1.00 19.21           N  
ATOM    411  CA  PHE A  56      10.365  67.058  28.314  1.00 17.20           C  
ATOM    412  C   PHE A  56       8.875  67.181  28.662  1.00 18.39           C  
ATOM    413  O   PHE A  56       8.007  66.820  27.838  1.00 19.78           O  
ATOM    414  CB  PHE A  56      11.010  65.852  29.047  1.00 19.60           C  
ATOM    415  CG  PHE A  56      10.133  64.623  29.137  1.00 19.68           C  
ATOM    416  CD1 PHE A  56       9.891  63.839  28.017  1.00 20.74           C  
ATOM    417  CD2 PHE A  56       9.551  64.252  30.350  1.00 20.28           C  
ATOM    418  CE1 PHE A  56       9.078  62.700  28.101  1.00 20.43           C  
ATOM    419  CE2 PHE A  56       8.739  63.117  30.448  1.00 21.95           C  
ATOM    420  CZ  PHE A  56       8.505  62.342  29.318  1.00 21.38           C  
ATOM    421  N   PHE A  57       8.583  67.650  29.886  1.00 17.95           N  
ATOM    422  CA  PHE A  57       7.208  67.846  30.400  1.00 20.61           C  
ATOM    423  C   PHE A  57       6.450  68.966  29.754  1.00 22.77           C  
ATOM    424  O   PHE A  57       5.231  68.847  29.602  1.00 23.48           O  
ATOM    425  CB  PHE A  57       7.166  68.057  31.929  1.00 17.27           C  
ATOM    426  CG  PHE A  57       7.239  66.780  32.686  1.00 18.15           C  
ATOM    427  CD1 PHE A  57       8.400  66.431  33.390  1.00 18.60           C  
ATOM    428  CD2 PHE A  57       6.159  65.893  32.655  1.00 15.31           C  
ATOM    429  CE1 PHE A  57       8.490  65.206  34.054  1.00 13.89           C  
ATOM    430  CE2 PHE A  57       6.225  64.659  33.319  1.00 12.01           C  
ATOM    431  CZ  PHE A  57       7.393  64.317  34.017  1.00  9.61           C  
ATOM    432  N   ARG A  58       7.132  70.064  29.423  1.00 25.39           N  
ATOM    433  CA  ARG A  58       6.483  71.204  28.767  1.00 30.67           C  
ATOM    434  C   ARG A  58       5.998  70.786  27.386  1.00 31.49           C  
ATOM    435  O   ARG A  58       4.928  71.164  26.944  1.00 31.70           O  
ATOM    436  CB  ARG A  58       7.469  72.366  28.666  1.00 32.33           C  
ATOM    437  CG  ARG A  58       6.821  73.718  28.551  1.00 38.88           C  
ATOM    438  CD  ARG A  58       7.739  74.815  29.096  1.00 42.22           C  
ATOM    439  NE  ARG A  58       7.719  75.041  30.557  1.00 47.00           N  
ATOM    440  CZ  ARG A  58       6.637  75.292  31.309  1.00 50.39           C  
ATOM    441  NH1 ARG A  58       5.418  75.309  30.769  1.00 50.82           N  
ATOM    442  NH2 ARG A  58       6.812  75.671  32.576  1.00 50.93           N  
ATOM    443  N   GLN A  59       6.829  69.960  26.759  1.00 34.87           N  
ATOM    444  CA  GLN A  59       6.628  69.357  25.440  1.00 36.93           C  
ATOM    445  C   GLN A  59       5.376  68.512  25.383  1.00 36.89           C  
ATOM    446  O   GLN A  59       4.659  68.552  24.388  1.00 36.78           O  
ATOM    447  CB  GLN A  59       7.815  68.441  25.130  1.00 43.00           C  
ATOM    448  CG  GLN A  59       7.866  67.875  23.745  1.00 51.12           C  
ATOM    449  CD  GLN A  59       8.721  68.727  22.816  1.00 58.58           C  
ATOM    450  OE1 GLN A  59       8.223  69.332  21.842  1.00 60.92           O  
ATOM    451  NE2 GLN A  59      10.026  68.777  23.107  1.00 60.79           N  
ATOM    452  N   GLY A  60       5.133  67.715  26.429  1.00 35.99           N  
ATOM    453  CA  GLY A  60       3.958  66.852  26.456  1.00 37.41           C  
ATOM    454  C   GLY A  60       2.598  67.169  27.109  1.00 40.45           C  
ATOM    455  O   GLY A  60       1.617  66.512  26.723  1.00 40.98           O  
ATOM    456  N   LEU A  61       2.470  68.205  27.960  1.00 42.82           N  
ATOM    457  CA  LEU A  61       1.209  68.479  28.696  1.00 46.96           C  
ATOM    458  C   LEU A  61       0.013  69.400  28.267  1.00 52.72           C  
ATOM    459  O   LEU A  61       0.224  70.593  27.975  1.00 54.91           O  
ATOM    460  CB  LEU A  61       1.547  68.745  30.172  1.00 41.33           C  
ATOM    461  CG  LEU A  61       1.888  67.571  31.095  1.00 34.79           C  
ATOM    462  CD1 LEU A  61       3.076  66.887  30.628  1.00 36.56           C  
ATOM    463  CD2 LEU A  61       2.159  68.066  32.482  1.00 37.64           C  
ATOM    464  N   LYS A  65      -1.219  68.800  28.375  1.00 57.86           N  
ATOM    465  CA  LYS A  65      -2.691  69.236  28.133  1.00 59.37           C  
ATOM    466  C   LYS A  65      -3.638  67.942  28.308  1.00 57.43           C  
ATOM    467  O   LYS A  65      -4.826  67.854  27.947  1.00 56.80           O  
ATOM    468  CB  LYS A  65      -2.924  69.841  26.724  1.00 62.26           C  
ATOM    469  CG  LYS A  65      -4.417  70.069  26.372  1.00 67.68           C  
ATOM    470  CD  LYS A  65      -4.962  68.964  25.455  1.00 72.30           C  
ATOM    471  CE  LYS A  65      -6.416  68.582  25.751  1.00 76.07           C  
ATOM    472  NZ  LYS A  65      -6.527  67.101  25.898  1.00 79.03           N  
ATOM    473  N   VAL A  66      -3.033  66.942  28.905  1.00 51.98           N  
ATOM    474  CA  VAL A  66      -3.599  65.649  29.137  1.00 45.20           C  
ATOM    475  C   VAL A  66      -4.498  65.506  30.382  1.00 41.05           C  
ATOM    476  O   VAL A  66      -4.819  66.481  31.078  1.00 40.62           O  
ATOM    477  CB  VAL A  66      -2.357  64.750  29.144  1.00 44.17           C  
ATOM    478  CG1 VAL A  66      -2.461  63.602  30.062  1.00 48.11           C  
ATOM    479  CG2 VAL A  66      -1.998  64.367  27.706  1.00 46.28           C  
ATOM    480  N   ARG A  67      -5.030  64.291  30.524  1.00 37.18           N  
ATOM    481  CA  ARG A  67      -5.852  63.825  31.672  1.00 31.85           C  
ATOM    482  C   ARG A  67      -5.104  62.525  32.100  1.00 25.28           C  
ATOM    483  O   ARG A  67      -4.727  61.693  31.271  1.00 23.00           O  
ATOM    484  CB  ARG A  67      -7.277  63.518  31.220  1.00 36.78           C  
ATOM    485  CG  ARG A  67      -8.239  63.023  32.314  1.00 46.12           C  
ATOM    486  CD  ARG A  67      -9.742  63.163  31.898  1.00 51.43           C  
ATOM    487  NE  ARG A  67     -10.621  62.081  32.369  1.00 54.10           N  
ATOM    488  CZ  ARG A  67     -10.883  61.793  33.645  1.00 57.73           C  
ATOM    489  NH1 ARG A  67     -10.347  62.508  34.628  1.00 59.04           N  
ATOM    490  NH2 ARG A  67     -11.729  60.804  33.947  1.00 61.34           N  
ATOM    491  N   ALA A  68      -4.796  62.399  33.370  1.00 20.93           N  
ATOM    492  CA  ALA A  68      -4.059  61.241  33.846  1.00 19.62           C  
ATOM    493  C   ALA A  68      -4.664  60.749  35.140  1.00 19.52           C  
ATOM    494  O   ALA A  68      -4.974  61.537  36.007  1.00 20.23           O  
ATOM    495  CB  ALA A  68      -2.599  61.596  34.051  1.00 17.34           C  
ATOM    496  N   CYS A  69      -4.866  59.449  35.274  1.00 19.35           N  
ATOM    497  CA  CYS A  69      -5.425  58.943  36.515  1.00 19.78           C  
ATOM    498  C   CYS A  69      -4.774  57.634  36.930  1.00 18.55           C  
ATOM    499  O   CYS A  69      -4.226  56.947  36.070  1.00 19.22           O  
ATOM    500  CB  CYS A  69      -6.930  58.772  36.422  1.00 23.70           C  
ATOM    501  SG  CYS A  69      -7.504  58.007  34.969  1.00 37.80           S  
ATOM    502  N   LEU A  70      -4.687  57.375  38.244  1.00 15.02           N  
ATOM    503  CA  LEU A  70      -4.146  56.113  38.749  1.00 15.92           C  
ATOM    504  C   LEU A  70      -5.211  55.040  38.484  1.00 16.87           C  
ATOM    505  O   LEU A  70      -6.363  55.251  38.817  1.00 22.78           O  
ATOM    506  CB  LEU A  70      -3.957  56.166  40.242  1.00 14.95           C  
ATOM    507  CG  LEU A  70      -2.661  56.623  40.915  1.00 17.13           C  
ATOM    508  CD1 LEU A  70      -2.861  56.300  42.367  1.00 16.50           C  
ATOM    509  CD2 LEU A  70      -1.431  55.924  40.403  1.00 15.19           C  
ATOM    510  N   THR A  71      -4.857  53.892  37.903  1.00 17.34           N  
ATOM    511  CA  THR A  71      -5.834  52.839  37.619  1.00 12.23           C  
ATOM    512  C   THR A  71      -5.717  51.634  38.592  1.00 16.67           C  
ATOM    513  O   THR A  71      -6.375  50.609  38.429  1.00 18.68           O  
ATOM    514  CB  THR A  71      -5.746  52.400  36.149  1.00 11.74           C  
ATOM    515  OG1 THR A  71      -4.407  52.060  35.831  1.00 17.55           O  
ATOM    516  CG2 THR A  71      -6.119  53.515  35.221  1.00 13.41           C  
ATOM    517  N   GLY A  72      -4.922  51.793  39.640  1.00 11.84           N  
ATOM    518  CA  GLY A  72      -4.743  50.751  40.597  1.00  7.98           C  
ATOM    519  C   GLY A  72      -3.853  51.321  41.660  1.00 11.69           C  
ATOM    520  O   GLY A  72      -3.293  52.410  41.497  1.00 11.77           O  
ATOM    521  N   PRO A  73      -3.696  50.627  42.774  1.00 11.95           N  
ATOM    522  CA  PRO A  73      -2.845  51.143  43.844  1.00 12.63           C  
ATOM    523  C   PRO A  73      -1.343  51.211  43.565  1.00 12.59           C  
ATOM    524  O   PRO A  73      -0.832  50.599  42.617  1.00 11.79           O  
ATOM    525  CB  PRO A  73      -3.193  50.241  45.036  1.00 13.60           C  
ATOM    526  CG  PRO A  73      -3.662  49.008  44.425  1.00 10.61           C  
ATOM    527  CD  PRO A  73      -4.408  49.416  43.173  1.00 11.98           C  
ATOM    528  N   VAL A  74      -0.671  52.092  44.308  1.00 12.44           N  
ATOM    529  CA  VAL A  74       0.768  52.273  44.203  1.00  9.60           C  
ATOM    530  C   VAL A  74       1.394  51.133  44.987  1.00 13.01           C  
ATOM    531  O   VAL A  74       1.036  50.889  46.160  1.00 15.75           O  
ATOM    532  CB  VAL A  74       1.230  53.610  44.817  1.00  7.32           C  
ATOM    533  CG1 VAL A  74       2.733  53.725  44.680  1.00  7.16           C  
ATOM    534  CG2 VAL A  74       0.575  54.780  44.074  1.00  6.62           C  
ATOM    535  N   ARG A  75       2.309  50.410  44.342  1.00 12.56           N  
ATOM    536  CA  ARG A  75       3.003  49.294  45.002  1.00 12.24           C  
ATOM    537  C   ARG A  75       4.281  49.897  45.555  1.00 13.97           C  
ATOM    538  O   ARG A  75       5.023  50.512  44.816  1.00 16.75           O  
ATOM    539  CB  ARG A  75       3.306  48.160  43.989  1.00  7.33           C  
ATOM    540  CG  ARG A  75       2.170  47.187  43.764  1.00  6.14           C  
ATOM    541  CD  ARG A  75       0.936  47.777  43.111  1.00  6.00           C  
ATOM    542  NE  ARG A  75       0.091  46.729  42.564  1.00 11.48           N  
ATOM    543  CZ  ARG A  75      -0.974  46.918  41.806  1.00 11.14           C  
ATOM    544  NH1 ARG A  75      -1.362  48.129  41.486  1.00 10.55           N  
ATOM    545  NH2 ARG A  75      -1.564  45.888  41.261  1.00 10.69           N  
ATOM    546  N   ALA A  76       4.566  49.735  46.834  1.00 13.95           N  
ATOM    547  CA  ALA A  76       5.779  50.336  47.357  1.00 16.47           C  
ATOM    548  C   ALA A  76       6.612  49.389  48.228  1.00 16.44           C  
ATOM    549  O   ALA A  76       6.057  48.515  48.871  1.00 18.99           O  
ATOM    550  CB  ALA A  76       5.406  51.641  48.138  1.00 16.38           C  
ATOM    551  N   SER A  77       7.936  49.499  48.156  1.00 17.01           N  
ATOM    552  CA  SER A  77       8.805  48.677  48.987  1.00 21.24           C  
ATOM    553  C   SER A  77       9.357  49.527  50.100  1.00 22.04           C  
ATOM    554  O   SER A  77       8.952  50.684  50.290  1.00 21.54           O  
ATOM    555  CB  SER A  77       9.949  48.023  48.215  1.00 22.95           C  
ATOM    556  OG  SER A  77      10.831  49.006  47.716  1.00 27.82           O  
ATOM    557  N   HIS A  78      10.259  48.937  50.873  1.00 24.29           N  
ATOM    558  CA  HIS A  78      10.832  49.614  52.031  1.00 26.06           C  
ATOM    559  C   HIS A  78      12.148  50.303  51.712  1.00 25.71           C  
ATOM    560  O   HIS A  78      12.773  50.883  52.603  1.00 27.36           O  
ATOM    561  CB  HIS A  78      10.987  48.606  53.196  1.00 25.90           C  
ATOM    562  CG  HIS A  78       9.696  47.957  53.609  1.00 26.75           C  
ATOM    563  ND1 HIS A  78       8.657  48.665  54.181  1.00 28.44           N  
ATOM    564  CD2 HIS A  78       9.237  46.692  53.438  1.00 25.47           C  
ATOM    565  CE1 HIS A  78       7.613  47.877  54.329  1.00 26.89           C  
ATOM    566  NE2 HIS A  78       7.937  46.672  53.886  1.00 27.23           N  
ATOM    567  N   ASN A  79      12.614  50.151  50.472  1.00 23.66           N  
ATOM    568  CA  ASN A  79      13.857  50.776  50.067  1.00 25.08           C  
ATOM    569  C   ASN A  79      13.782  52.014  49.142  1.00 22.91           C  
ATOM    570  O   ASN A  79      14.723  52.317  48.435  1.00 24.51           O  
ATOM    571  CB  ASN A  79      14.885  49.718  49.594  1.00 27.29           C  
ATOM    572  CG  ASN A  79      14.603  49.152  48.229  1.00 29.57           C  
ATOM    573  OD1 ASN A  79      15.516  48.645  47.561  1.00 34.59           O  
ATOM    574  ND2 ASN A  79      13.370  49.211  47.805  1.00 29.35           N  
ATOM    575  N   GLY A  80      12.691  52.763  49.223  1.00 20.07           N  
ATOM    576  CA  GLY A  80      12.560  53.966  48.436  1.00 18.32           C  
ATOM    577  C   GLY A  80      12.109  53.761  47.012  1.00 18.58           C  
ATOM    578  O   GLY A  80      12.182  54.677  46.218  1.00 15.07           O  
ATOM    579  N   CYS A  81      11.622  52.572  46.695  1.00 15.59           N  
ATOM    580  CA  CYS A  81      11.137  52.295  45.362  1.00 14.88           C  
ATOM    581  C   CYS A  81       9.591  52.177  45.320  1.00 15.23           C  
ATOM    582  O   CYS A  81       8.943  51.931  46.344  1.00 15.82           O  
ATOM    583  CB  CYS A  81      11.819  51.047  44.809  1.00 17.31           C  
ATOM    584  SG  CYS A  81      13.514  51.314  44.265  1.00 29.91           S  
ATOM    585  N   GLY A  82       8.996  52.442  44.162  1.00 12.05           N  
ATOM    586  CA  GLY A  82       7.554  52.352  44.011  1.00 10.92           C  
ATOM    587  C   GLY A  82       7.224  52.085  42.567  1.00  9.24           C  
ATOM    588  O   GLY A  82       8.028  52.377  41.703  1.00  8.62           O  
ATOM    589  N   ALA A  83       6.045  51.537  42.308  1.00  9.32           N  
ATOM    590  CA  ALA A  83       5.627  51.241  40.948  1.00  8.04           C  
ATOM    591  C   ALA A  83       4.126  51.472  40.968  1.00  7.60           C  
ATOM    592  O   ALA A  83       3.446  51.127  41.940  1.00  8.89           O  
ATOM    593  CB  ALA A  83       5.964  49.787  40.597  1.00  8.48           C  
ATOM    594  N   MET A  84       3.582  52.027  39.901  1.00  8.05           N  
ATOM    595  CA  MET A  84       2.158  52.311  39.873  1.00  8.24           C  
ATOM    596  C   MET A  84       1.571  52.216  38.496  1.00  8.81           C  
ATOM    597  O   MET A  84       2.218  52.520  37.529  1.00  6.25           O  
ATOM    598  CB  MET A  84       1.899  53.737  40.375  1.00 10.40           C  
ATOM    599  CG  MET A  84       2.376  54.864  39.431  1.00 13.18           C  
ATOM    600  SD  MET A  84       2.167  56.528  40.166  1.00 16.30           S  
ATOM    601  CE  MET A  84       3.509  57.466  39.274  1.00  8.81           C  
ATOM    602  N   PRO A  85       0.323  51.753  38.405  1.00  6.84           N  
ATOM    603  CA  PRO A  85      -0.252  51.681  37.064  1.00  8.03           C  
ATOM    604  C   PRO A  85      -1.121  52.916  36.788  1.00  7.30           C  
ATOM    605  O   PRO A  85      -1.793  53.403  37.687  1.00 10.23           O  
ATOM    606  CB  PRO A  85      -1.108  50.412  37.143  1.00  7.91           C  
ATOM    607  CG  PRO A  85      -1.596  50.376  38.601  1.00  6.00           C  
ATOM    608  CD  PRO A  85      -0.527  51.106  39.422  1.00  7.08           C  
ATOM    609  N   PHE A  86      -1.086  53.458  35.584  1.00  7.41           N  
ATOM    610  CA  PHE A  86      -1.955  54.608  35.292  1.00  9.51           C  
ATOM    611  C   PHE A  86      -2.288  54.730  33.812  1.00  8.83           C  
ATOM    612  O   PHE A  86      -1.726  54.041  32.978  1.00  9.65           O  
ATOM    613  CB  PHE A  86      -1.403  55.929  35.871  1.00  7.27           C  
ATOM    614  CG  PHE A  86      -0.157  56.445  35.194  1.00  8.56           C  
ATOM    615  CD1 PHE A  86      -0.242  57.426  34.211  1.00  9.79           C  
ATOM    616  CD2 PHE A  86       1.093  55.944  35.527  1.00  7.00           C  
ATOM    617  CE1 PHE A  86       0.882  57.898  33.578  1.00  9.93           C  
ATOM    618  CE2 PHE A  86       2.219  56.410  34.902  1.00  6.00           C  
ATOM    619  CZ  PHE A  86       2.114  57.393  33.919  1.00  7.49           C  
ATOM    620  N   ARG A  87      -3.282  55.544  33.524  1.00 11.48           N  
ATOM    621  CA  ARG A  87      -3.724  55.801  32.173  1.00 14.83           C  
ATOM    622  C   ARG A  87      -3.679  57.302  31.866  1.00 16.93           C  
ATOM    623  O   ARG A  87      -3.965  58.160  32.705  1.00 13.72           O  
ATOM    624  CB  ARG A  87      -5.164  55.305  31.953  1.00 21.26           C  
ATOM    625  CG  ARG A  87      -5.869  55.958  30.754  1.00 24.11           C  
ATOM    626  CD  ARG A  87      -7.066  55.178  30.367  1.00 27.57           C  
ATOM    627  NE  ARG A  87      -6.629  53.832  30.028  1.00 37.82           N  
ATOM    628  CZ  ARG A  87      -7.042  53.148  28.968  1.00 41.38           C  
ATOM    629  NH1 ARG A  87      -7.932  53.696  28.143  1.00 44.96           N  
ATOM    630  NH2 ARG A  87      -6.591  51.942  28.734  1.00 44.24           N  
ATOM    631  N   VAL A  88      -3.303  57.594  30.637  1.00 18.16           N  
ATOM    632  CA  VAL A  88      -3.224  58.957  30.184  1.00 21.24           C  
ATOM    633  C   VAL A  88      -4.167  59.066  29.015  1.00 22.26           C  
ATOM    634  O   VAL A  88      -4.156  58.221  28.126  1.00 22.04           O  
ATOM    635  CB  VAL A  88      -1.818  59.298  29.698  1.00 21.45           C  
ATOM    636  CG1 VAL A  88      -1.838  60.670  29.035  1.00 22.77           C  
ATOM    637  CG2 VAL A  88      -0.825  59.307  30.854  1.00 23.75           C  
ATOM    638  N   GLU A  89      -5.017  60.075  29.046  1.00 24.94           N  
ATOM    639  CA  GLU A  89      -5.934  60.308  27.951  1.00 28.58           C  
ATOM    640  C   GLU A  89      -5.578  61.616  27.252  1.00 31.25           C  
ATOM    641  O   GLU A  89      -5.401  62.655  27.889  1.00 28.56           O  
ATOM    642  CB  GLU A  89      -7.347  60.362  28.453  1.00 30.03           C  
ATOM    643  CG  GLU A  89      -7.782  59.076  29.048  1.00 35.86           C  
ATOM    644  CD  GLU A  89      -9.265  59.027  29.254  1.00 40.95           C  
ATOM    645  OE1 GLU A  89      -9.933  60.077  29.113  1.00 40.76           O  
ATOM    646  OE2 GLU A  89      -9.782  57.919  29.504  1.00 47.02           O  
ATOM    647  N   MET A  90      -5.389  61.543  25.945  1.00 35.57           N  
ATOM    648  CA  MET A  90      -5.057  62.731  25.200  1.00 41.16           C  
ATOM    649  C   MET A  90      -5.864  62.720  23.913  1.00 45.92           C  
ATOM    650  O   MET A  90      -6.789  61.920  23.749  1.00 44.77           O  
ATOM    651  CB  MET A  90      -3.559  62.765  24.895  1.00 37.53           C  
ATOM    652  CG  MET A  90      -3.136  61.709  23.903  1.00 39.16           C  
ATOM    653  SD  MET A  90      -2.703  60.203  24.700  1.00 41.19           S  
ATOM    654  CE  MET A  90      -0.995  60.657  25.117  1.00 38.39           C  
ATOM    655  N   VAL A  91      -5.566  63.687  23.054  1.00 53.50           N  
ATOM    656  CA  VAL A  91      -6.200  63.817  21.746  1.00 60.92           C  
ATOM    657  C   VAL A  91      -5.062  64.204  20.828  1.00 67.01           C  
ATOM    658  O   VAL A  91      -4.598  65.346  20.849  1.00 68.59           O  
ATOM    659  CB  VAL A  91      -7.263  64.920  21.705  1.00 59.58           C  
ATOM    660  CG1 VAL A  91      -7.812  65.038  20.304  1.00 58.51           C  
ATOM    661  CG2 VAL A  91      -8.385  64.607  22.677  1.00 60.33           C  
ATOM    662  N   TRP A  92      -4.556  63.206  20.113  1.00 74.08           N  
ATOM    663  CA  TRP A  92      -3.446  63.350  19.175  1.00 80.70           C  
ATOM    664  C   TRP A  92      -3.907  63.662  17.744  1.00 83.08           C  
ATOM    665  O   TRP A  92      -4.563  62.826  17.085  1.00 83.65           O  
ATOM    666  CB  TRP A  92      -2.629  62.062  19.199  1.00 84.83           C  
ATOM    667  CG  TRP A  92      -1.609  61.897  18.106  1.00 89.78           C  
ATOM    668  CD1 TRP A  92      -0.887  62.882  17.474  1.00 90.59           C  
ATOM    669  CD2 TRP A  92      -1.149  60.654  17.567  1.00 92.07           C  
ATOM    670  NE1 TRP A  92       0.000  62.320  16.586  1.00 91.88           N  
ATOM    671  CE2 TRP A  92      -0.141  60.954  16.622  1.00 93.21           C  
ATOM    672  CE3 TRP A  92      -1.491  59.309  17.800  1.00 94.32           C  
ATOM    673  CZ2 TRP A  92       0.537  59.955  15.904  1.00 94.81           C  
ATOM    674  CZ3 TRP A  92      -0.823  58.317  17.091  1.00 95.40           C  
ATOM    675  CH2 TRP A  92       0.184  58.646  16.151  1.00 95.92           C  
ATOM    676  N   ASN A  93      -3.518  64.853  17.272  1.00 84.40           N  
ATOM    677  CA  ASN A  93      -3.840  65.351  15.931  1.00 85.66           C  
ATOM    678  C   ASN A  93      -5.329  65.184  15.609  1.00 85.33           C  
ATOM    679  O   ASN A  93      -5.708  64.645  14.553  1.00 86.39           O  
ATOM    680  CB  ASN A  93      -2.959  64.673  14.857  1.00 88.76           C  
ATOM    681  CG  ASN A  93      -1.469  65.077  14.946  1.00 91.64           C  
ATOM    682  OD1 ASN A  93      -0.648  64.673  14.105  1.00 92.83           O  
ATOM    683  ND2 ASN A  93      -1.120  65.869  15.962  1.00 93.48           N  
ATOM    684  N   GLY A  94      -6.166  65.661  16.528  1.00 84.18           N  
ATOM    685  CA  GLY A  94      -7.605  65.574  16.347  1.00 82.22           C  
ATOM    686  C   GLY A  94      -8.247  64.293  16.841  1.00 80.39           C  
ATOM    687  O   GLY A  94      -9.447  64.291  17.144  1.00 80.19           O  
ATOM    688  N   GLN A  95      -7.473  63.207  16.922  1.00 77.67           N  
ATOM    689  CA  GLN A  95      -8.005  61.928  17.389  1.00 73.85           C  
ATOM    690  C   GLN A  95      -7.658  61.685  18.863  1.00 68.59           C  
ATOM    691  O   GLN A  95      -6.523  61.902  19.278  1.00 66.60           O  
ATOM    692  CB  GLN A  95      -7.505  60.785  16.507  1.00 76.37           C  
ATOM    693  CG  GLN A  95      -8.513  59.647  16.402  1.00 80.78           C  
ATOM    694  CD  GLN A  95      -8.710  59.159  14.983  1.00 83.30           C  
ATOM    695  OE1 GLN A  95      -9.274  59.857  14.127  1.00 84.96           O  
ATOM    696  NE2 GLN A  95      -8.250  57.949  14.724  1.00 86.15           N  
ATOM    697  N   PRO A  96      -8.652  61.264  19.674  1.00 63.21           N  
ATOM    698  CA  PRO A  96      -8.470  60.995  21.103  1.00 60.45           C  
ATOM    699  C   PRO A  96      -7.833  59.637  21.378  1.00 56.95           C  
ATOM    700  O   PRO A  96      -8.297  58.619  20.862  1.00 59.66           O  
ATOM    701  CB  PRO A  96      -9.902  61.021  21.625  1.00 60.60           C  
ATOM    702  CG  PRO A  96     -10.638  60.370  20.523  1.00 60.29           C  
ATOM    703  CD  PRO A  96     -10.053  61.026  19.287  1.00 60.99           C  
ATOM    704  N   CYS A  97      -6.783  59.614  22.188  1.00 50.31           N  
ATOM    705  CA  CYS A  97      -6.138  58.356  22.512  1.00 43.04           C  
ATOM    706  C   CYS A  97      -6.090  58.159  23.997  1.00 37.01           C  
ATOM    707  O   CYS A  97      -6.456  59.037  24.778  1.00 34.92           O  
ATOM    708  CB  CYS A  97      -4.716  58.316  22.006  1.00 45.24           C  
ATOM    709  SG  CYS A  97      -4.518  59.069  20.465  1.00 54.04           S  
ATOM    710  N   ALA A  98      -5.589  56.989  24.355  1.00 30.79           N  
ATOM    711  CA  ALA A  98      -5.410  56.544  25.717  1.00 25.41           C  
ATOM    712  C   ALA A  98      -4.142  55.716  25.694  1.00 22.74           C  
ATOM    713  O   ALA A  98      -3.823  55.059  24.700  1.00 22.33           O  
ATOM    714  CB  ALA A  98      -6.566  55.710  26.153  1.00 26.55           C  
ATOM    715  N   LEU A  99      -3.382  55.831  26.766  1.00 19.97           N  
ATOM    716  CA  LEU A  99      -2.123  55.142  26.894  1.00 15.70           C  
ATOM    717  C   LEU A  99      -2.017  54.604  28.302  1.00 16.70           C  
ATOM    718  O   LEU A  99      -2.182  55.365  29.272  1.00 14.25           O  
ATOM    719  CB  LEU A  99      -1.003  56.123  26.616  1.00 13.15           C  
ATOM    720  CG  LEU A  99       0.401  55.553  26.589  1.00 15.83           C  
ATOM    721  CD1 LEU A  99       0.553  54.559  25.440  1.00 14.75           C  
ATOM    722  CD2 LEU A  99       1.336  56.716  26.419  1.00 12.54           C  
ATOM    723  N   ASP A 100      -1.769  53.296  28.404  1.00 13.01           N  
ATOM    724  CA  ASP A 100      -1.648  52.635  29.693  1.00 10.73           C  
ATOM    725  C   ASP A 100      -0.166  52.564  29.971  1.00  9.88           C  
ATOM    726  O   ASP A 100       0.629  52.107  29.164  1.00 13.46           O  
ATOM    727  CB  ASP A 100      -2.266  51.257  29.610  1.00  9.19           C  
ATOM    728  CG  ASP A 100      -3.751  51.317  29.366  1.00 13.93           C  
ATOM    729  OD1 ASP A 100      -4.439  51.986  30.174  1.00 12.83           O  
ATOM    730  OD2 ASP A 100      -4.193  50.729  28.376  1.00 14.79           O  
ATOM    731  N   VAL A 101       0.242  53.017  31.129  1.00 10.45           N  
ATOM    732  CA  VAL A 101       1.654  53.074  31.429  1.00  8.58           C  
ATOM    733  C   VAL A 101       1.909  52.581  32.823  1.00  7.52           C  
ATOM    734  O   VAL A 101       1.042  52.652  33.663  1.00  9.79           O  
ATOM    735  CB  VAL A 101       2.096  54.587  31.436  1.00  7.52           C  
ATOM    736  CG1 VAL A 101       3.572  54.714  31.732  1.00  9.42           C  
ATOM    737  CG2 VAL A 101       1.765  55.244  30.108  1.00  6.00           C  
ATOM    738  N   ILE A 102       3.106  52.082  33.078  1.00  7.60           N  
ATOM    739  CA  ILE A 102       3.466  51.722  34.448  1.00  8.82           C  
ATOM    740  C   ILE A 102       4.777  52.489  34.744  1.00  7.79           C  
ATOM    741  O   ILE A 102       5.762  52.376  33.983  1.00  9.87           O  
ATOM    742  CB  ILE A 102       3.651  50.189  34.658  1.00  6.08           C  
ATOM    743  CG1 ILE A 102       2.310  49.529  34.958  1.00  6.00           C  
ATOM    744  CG2 ILE A 102       4.586  49.936  35.860  1.00  6.00           C  
ATOM    745  CD1 ILE A 102       2.383  47.998  34.906  1.00  9.68           C  
ATOM    746  N   ASP A 103       4.787  53.301  35.806  1.00  8.69           N  
ATOM    747  CA  ASP A 103       6.005  54.066  36.158  1.00  9.59           C  
ATOM    748  C   ASP A 103       6.679  53.389  37.334  1.00 10.28           C  
ATOM    749  O   ASP A 103       5.985  52.939  38.240  1.00 12.92           O  
ATOM    750  CB  ASP A 103       5.620  55.492  36.612  1.00 14.61           C  
ATOM    751  CG  ASP A 103       5.712  56.534  35.513  1.00 14.04           C  
ATOM    752  OD1 ASP A 103       5.954  56.200  34.359  1.00 11.99           O  
ATOM    753  OD2 ASP A 103       5.531  57.715  35.844  1.00 12.01           O  
ATOM    754  N   VAL A 104       8.011  53.310  37.331  1.00  9.85           N  
ATOM    755  CA  VAL A 104       8.763  52.750  38.451  1.00  9.78           C  
ATOM    756  C   VAL A 104       9.693  53.884  38.902  1.00 11.38           C  
ATOM    757  O   VAL A 104      10.404  54.456  38.106  1.00 10.28           O  
ATOM    758  CB  VAL A 104       9.558  51.462  38.081  1.00 10.04           C  
ATOM    759  CG1 VAL A 104      10.434  51.039  39.239  1.00  7.86           C  
ATOM    760  CG2 VAL A 104       8.577  50.316  37.749  1.00  9.77           C  
ATOM    761  N   MET A 105       9.678  54.232  40.177  1.00 12.26           N  
ATOM    762  CA  MET A 105      10.503  55.341  40.629  1.00 13.79           C  
ATOM    763  C   MET A 105      11.340  55.003  41.801  1.00 13.76           C  
ATOM    764  O   MET A 105      10.934  54.251  42.649  1.00 13.06           O  
ATOM    765  CB  MET A 105       9.635  56.546  41.022  1.00 10.91           C  
ATOM    766  CG  MET A 105       8.854  57.182  39.878  1.00 15.98           C  
ATOM    767  SD  MET A 105       7.713  58.400  40.528  1.00 18.85           S  
ATOM    768  CE  MET A 105       7.197  59.071  39.099  1.00 14.99           C  
ATOM    769  N   ARG A 106      12.490  55.638  41.886  1.00 16.79           N  
ATOM    770  CA  ARG A 106      13.357  55.482  43.041  1.00 19.99           C  
ATOM    771  C   ARG A 106      13.510  56.884  43.628  1.00 18.92           C  
ATOM    772  O   ARG A 106      13.812  57.828  42.910  1.00 19.50           O  
ATOM    773  CB  ARG A 106      14.727  54.944  42.660  1.00 23.43           C  
ATOM    774  CG  ARG A 106      15.577  54.527  43.865  1.00 31.69           C  
ATOM    775  CD  ARG A 106      16.940  53.984  43.397  1.00 44.01           C  
ATOM    776  NE  ARG A 106      17.489  52.900  44.225  1.00 53.70           N  
ATOM    777  CZ  ARG A 106      18.262  51.901  43.769  1.00 58.99           C  
ATOM    778  NH1 ARG A 106      18.597  51.816  42.473  1.00 62.20           N  
ATOM    779  NH2 ARG A 106      18.776  51.012  44.622  1.00 62.27           N  
ATOM    780  N   PHE A 107      13.284  56.996  44.930  1.00 16.98           N  
ATOM    781  CA  PHE A 107      13.383  58.238  45.657  1.00 17.83           C  
ATOM    782  C   PHE A 107      14.725  58.351  46.386  1.00 19.86           C  
ATOM    783  O   PHE A 107      15.360  57.341  46.694  1.00 19.93           O  
ATOM    784  CB  PHE A 107      12.229  58.327  46.654  1.00 14.68           C  
ATOM    785  CG  PHE A 107      10.893  58.480  46.016  1.00 16.26           C  
ATOM    786  CD1 PHE A 107      10.177  57.368  45.603  1.00 13.60           C  
ATOM    787  CD2 PHE A 107      10.353  59.753  45.817  1.00 13.61           C  
ATOM    788  CE1 PHE A 107       8.946  57.509  44.999  1.00 13.59           C  
ATOM    789  CE2 PHE A 107       9.121  59.916  45.217  1.00 14.51           C  
ATOM    790  CZ  PHE A 107       8.408  58.786  44.799  1.00 16.81           C  
ATOM    791  N   ASP A 108      15.172  59.580  46.621  1.00 21.39           N  
ATOM    792  CA  ASP A 108      16.406  59.777  47.357  1.00 20.57           C  
ATOM    793  C   ASP A 108      16.142  60.083  48.828  1.00 23.86           C  
ATOM    794  O   ASP A 108      14.978  60.148  49.301  1.00 20.87           O  
ATOM    795  CB  ASP A 108      17.315  60.832  46.732  1.00 17.99           C  
ATOM    796  CG  ASP A 108      16.756  62.215  46.796  1.00 13.86           C  
ATOM    797  OD1 ASP A 108      17.210  63.049  46.034  1.00 18.91           O  
ATOM    798  OD2 ASP A 108      15.851  62.501  47.588  1.00 15.27           O  
ATOM    799  N   GLU A 109      17.249  60.219  49.550  1.00 29.27           N  
ATOM    800  CA  GLU A 109      17.275  60.472  50.975  1.00 32.45           C  
ATOM    801  C   GLU A 109      16.585  61.730  51.333  1.00 32.21           C  
ATOM    802  O   GLU A 109      16.646  62.117  52.479  1.00 36.18           O  
ATOM    803  CB  GLU A 109      18.718  60.502  51.517  1.00 35.37           C  
ATOM    804  CG  GLU A 109      19.751  61.247  50.651  1.00 43.07           C  
ATOM    805  CD  GLU A 109      20.120  60.527  49.307  1.00 50.56           C  
ATOM    806  OE1 GLU A 109      19.940  59.282  49.190  1.00 55.95           O  
ATOM    807  OE2 GLU A 109      20.645  61.205  48.391  1.00 53.97           O  
ATOM    808  N   HIS A 110      15.954  62.384  50.362  1.00 32.60           N  
ATOM    809  CA  HIS A 110      15.227  63.629  50.567  1.00 30.23           C  
ATOM    810  C   HIS A 110      13.813  63.546  50.111  1.00 27.83           C  
ATOM    811  O   HIS A 110      13.106  64.554  50.170  1.00 27.07           O  
ATOM    812  CB  HIS A 110      15.806  64.776  49.767  1.00 37.60           C  
ATOM    813  CG  HIS A 110      17.249  65.022  50.033  1.00 46.50           C  
ATOM    814  ND1 HIS A 110      18.223  64.791  49.089  1.00 51.64           N  
ATOM    815  CD2 HIS A 110      17.889  65.457  51.144  1.00 50.22           C  
ATOM    816  CE1 HIS A 110      19.408  65.072  49.603  1.00 52.94           C  
ATOM    817  NE2 HIS A 110      19.234  65.479  50.848  1.00 53.93           N  
ATOM    818  N   GLY A 111      13.388  62.400  49.602  1.00 24.74           N  
ATOM    819  CA  GLY A 111      12.018  62.323  49.136  1.00 21.77           C  
ATOM    820  C   GLY A 111      11.823  62.889  47.730  1.00 20.76           C  
ATOM    821  O   GLY A 111      10.701  63.224  47.330  1.00 19.91           O  
ATOM    822  N   ARG A 112      12.902  63.016  46.972  1.00 17.01           N  
ATOM    823  CA  ARG A 112      12.780  63.508  45.625  1.00 15.64           C  
ATOM    824  C   ARG A 112      13.036  62.345  44.692  1.00 13.25           C  
ATOM    825  O   ARG A 112      13.667  61.373  45.067  1.00 11.45           O  
ATOM    826  CB  ARG A 112      13.747  64.668  45.385  1.00 20.66           C  
ATOM    827  CG  ARG A 112      13.296  65.930  46.099  1.00 29.10           C  
ATOM    828  CD  ARG A 112      13.993  67.156  45.579  1.00 41.42           C  
ATOM    829  NE  ARG A 112      14.953  67.681  46.540  1.00 53.09           N  
ATOM    830  CZ  ARG A 112      14.642  68.364  47.645  1.00 58.86           C  
ATOM    831  NH1 ARG A 112      13.368  68.617  47.953  1.00 62.93           N  
ATOM    832  NH2 ARG A 112      15.601  68.796  48.469  1.00 60.78           N  
ATOM    833  N   ILE A 113      12.462  62.407  43.498  1.00 14.21           N  
ATOM    834  CA  ILE A 113      12.620  61.353  42.505  1.00 11.76           C  
ATOM    835  C   ILE A 113      14.025  61.412  41.946  1.00 14.67           C  
ATOM    836  O   ILE A 113      14.398  62.376  41.331  1.00 16.20           O  
ATOM    837  CB  ILE A 113      11.612  61.519  41.370  1.00 11.23           C  
ATOM    838  CG1 ILE A 113      10.194  61.559  41.949  1.00 10.57           C  
ATOM    839  CG2 ILE A 113      11.795  60.405  40.359  1.00 14.83           C  
ATOM    840  CD1 ILE A 113       9.147  61.925  40.948  1.00  8.86           C  
ATOM    841  N   GLN A 114      14.771  60.336  42.118  1.00 14.76           N  
ATOM    842  CA  GLN A 114      16.140  60.235  41.666  1.00 15.03           C  
ATOM    843  C   GLN A 114      16.169  59.581  40.289  1.00 15.67           C  
ATOM    844  O   GLN A 114      16.937  59.959  39.415  1.00 14.98           O  
ATOM    845  CB  GLN A 114      16.872  59.380  42.682  1.00 16.37           C  
ATOM    846  CG  GLN A 114      18.351  59.285  42.593  1.00 27.89           C  
ATOM    847  CD  GLN A 114      18.884  58.450  43.765  1.00 37.94           C  
ATOM    848  OE1 GLN A 114      18.695  57.231  43.789  1.00 45.07           O  
ATOM    849  NE2 GLN A 114      19.523  59.094  44.749  1.00 42.13           N  
ATOM    850  N   THR A 115      15.311  58.596  40.078  1.00 15.33           N  
ATOM    851  CA  THR A 115      15.293  57.932  38.813  1.00 14.74           C  
ATOM    852  C   THR A 115      13.859  57.516  38.469  1.00 12.79           C  
ATOM    853  O   THR A 115      13.051  57.248  39.342  1.00 11.37           O  
ATOM    854  CB  THR A 115      16.289  56.762  38.832  1.00 16.81           C  
ATOM    855  OG1 THR A 115      16.490  56.278  37.514  1.00 30.39           O  
ATOM    856  CG2 THR A 115      15.758  55.632  39.568  1.00 17.49           C  
ATOM    857  N   MET A 116      13.496  57.606  37.201  1.00 15.34           N  
ATOM    858  CA  MET A 116      12.160  57.233  36.794  1.00 17.22           C  
ATOM    859  C   MET A 116      12.206  56.455  35.489  1.00 17.39           C  
ATOM    860  O   MET A 116      12.925  56.803  34.576  1.00 18.53           O  
ATOM    861  CB  MET A 116      11.285  58.474  36.632  1.00 18.62           C  
ATOM    862  CG  MET A 116       9.785  58.199  36.492  1.00 22.29           C  
ATOM    863  SD  MET A 116       9.174  58.537  34.864  1.00 35.02           S  
ATOM    864  CE  MET A 116       8.421  59.953  35.115  1.00 26.27           C  
ATOM    865  N   GLN A 117      11.393  55.414  35.405  1.00 13.61           N  
ATOM    866  CA  GLN A 117      11.307  54.618  34.202  1.00 13.41           C  
ATOM    867  C   GLN A 117       9.853  54.364  33.875  1.00 10.06           C  
ATOM    868  O   GLN A 117       9.081  54.007  34.756  1.00 10.29           O  
ATOM    869  CB  GLN A 117      12.032  53.305  34.419  1.00 20.03           C  
ATOM    870  CG  GLN A 117      13.456  53.521  34.763  1.00 27.36           C  
ATOM    871  CD  GLN A 117      14.063  52.354  35.466  1.00 34.24           C  
ATOM    872  OE1 GLN A 117      14.011  52.269  36.707  1.00 39.45           O  
ATOM    873  NE2 GLN A 117      14.659  51.439  34.695  1.00 32.58           N  
ATOM    874  N   ALA A 118       9.472  54.571  32.626  1.00  9.10           N  
ATOM    875  CA  ALA A 118       8.091  54.340  32.235  1.00  9.25           C  
ATOM    876  C   ALA A 118       8.000  53.205  31.252  1.00  8.84           C  
ATOM    877  O   ALA A 118       8.689  53.176  30.254  1.00 14.64           O  
ATOM    878  CB  ALA A 118       7.492  55.580  31.638  1.00  9.31           C  
ATOM    879  N   TYR A 119       7.129  52.270  31.534  1.00  9.23           N  
ATOM    880  CA  TYR A 119       6.984  51.128  30.674  1.00  7.96           C  
ATOM    881  C   TYR A 119       5.721  51.238  29.875  1.00  8.59           C  
ATOM    882  O   TYR A 119       4.643  51.340  30.444  1.00  7.99           O  
ATOM    883  CB  TYR A 119       6.934  49.836  31.527  1.00 10.05           C  
ATOM    884  CG  TYR A 119       8.237  49.490  32.229  1.00 11.84           C  
ATOM    885  CD1 TYR A 119       8.555  50.013  33.477  1.00 10.54           C  
ATOM    886  CD2 TYR A 119       9.183  48.704  31.608  1.00 13.37           C  
ATOM    887  CE1 TYR A 119       9.785  49.770  34.063  1.00  6.46           C  
ATOM    888  CE2 TYR A 119      10.414  48.451  32.202  1.00 11.27           C  
ATOM    889  CZ  TYR A 119      10.690  48.985  33.409  1.00 13.77           C  
ATOM    890  OH  TYR A 119      11.893  48.733  33.960  1.00 16.74           O  
ATOM    891  N   TRP A 120       5.856  51.259  28.550  1.00 12.37           N  
ATOM    892  CA  TRP A 120       4.725  51.284  27.627  1.00 11.24           C  
ATOM    893  C   TRP A 120       5.321  51.283  26.232  1.00 13.69           C  
ATOM    894  O   TRP A 120       6.492  51.545  26.055  1.00 14.50           O  
ATOM    895  CB  TRP A 120       3.872  52.547  27.819  1.00 13.62           C  
ATOM    896  CG  TRP A 120       4.600  53.863  27.537  1.00 17.24           C  
ATOM    897  CD1 TRP A 120       5.317  54.642  28.437  1.00 17.47           C  
ATOM    898  CD2 TRP A 120       4.719  54.524  26.267  1.00 18.89           C  
ATOM    899  NE1 TRP A 120       5.872  55.722  27.792  1.00 18.18           N  
ATOM    900  CE2 TRP A 120       5.532  55.671  26.466  1.00 18.80           C  
ATOM    901  CE3 TRP A 120       4.236  54.244  24.977  1.00 19.70           C  
ATOM    902  CZ2 TRP A 120       5.860  56.541  25.411  1.00 16.84           C  
ATOM    903  CZ3 TRP A 120       4.566  55.112  23.938  1.00 16.87           C  
ATOM    904  CH2 TRP A 120       5.375  56.237  24.164  1.00 18.40           C  
ATOM    905  N   SER A 121       4.505  50.975  25.242  1.00 14.41           N  
ATOM    906  CA  SER A 121       4.938  51.033  23.851  1.00 13.82           C  
ATOM    907  C   SER A 121       3.641  51.139  23.085  1.00 14.22           C  
ATOM    908  O   SER A 121       2.597  51.307  23.690  1.00 14.30           O  
ATOM    909  CB  SER A 121       5.720  49.799  23.434  1.00 13.85           C  
ATOM    910  OG  SER A 121       4.860  48.679  23.345  1.00 16.13           O  
ATOM    911  N   GLU A 122       3.677  51.049  21.764  1.00 15.31           N  
ATOM    912  CA  GLU A 122       2.457  51.159  20.964  1.00 16.04           C  
ATOM    913  C   GLU A 122       1.369  50.124  21.273  1.00 16.67           C  
ATOM    914  O   GLU A 122       0.205  50.323  20.928  1.00 16.30           O  
ATOM    915  CB  GLU A 122       2.781  51.071  19.474  1.00 20.34           C  
ATOM    916  CG  GLU A 122       3.927  51.922  19.047  1.00 25.27           C  
ATOM    917  CD  GLU A 122       5.254  51.206  19.223  1.00 31.95           C  
ATOM    918  OE1 GLU A 122       5.262  50.074  19.753  1.00 34.34           O  
ATOM    919  OE2 GLU A 122       6.292  51.763  18.798  1.00 34.59           O  
ATOM    920  N   VAL A 123       1.750  48.981  21.839  1.00 17.12           N  
ATOM    921  CA  VAL A 123       0.798  47.933  22.197  1.00 15.03           C  
ATOM    922  C   VAL A 123      -0.107  48.391  23.351  1.00 16.25           C  
ATOM    923  O   VAL A 123      -1.168  47.808  23.566  1.00 16.33           O  
ATOM    924  CB  VAL A 123       1.524  46.556  22.519  1.00 17.43           C  
ATOM    925  CG1 VAL A 123       2.418  46.146  21.358  1.00 15.28           C  
ATOM    926  CG2 VAL A 123       2.397  46.641  23.787  1.00 13.23           C  
ATOM    927  N   ASN A 124       0.281  49.476  24.036  1.00 16.71           N  
ATOM    928  CA  ASN A 124      -0.522  50.041  25.156  1.00 16.66           C  
ATOM    929  C   ASN A 124      -1.322  51.317  24.774  1.00 17.95           C  
ATOM    930  O   ASN A 124      -1.797  52.037  25.642  1.00 15.45           O  
ATOM    931  CB  ASN A 124       0.401  50.350  26.329  1.00 12.38           C  
ATOM    932  CG  ASN A 124       1.166  49.143  26.779  1.00 12.02           C  
ATOM    933  OD1 ASN A 124       2.395  49.072  26.654  1.00 12.10           O  
ATOM    934  ND2 ASN A 124       0.442  48.164  27.289  1.00 11.12           N  
ATOM    935  N   LEU A 125      -1.349  51.629  23.472  1.00 17.78           N  
ATOM    936  CA  LEU A 125      -2.035  52.796  22.925  1.00 22.40           C  
ATOM    937  C   LEU A 125      -3.367  52.396  22.317  1.00 23.67           C  
ATOM    938  O   LEU A 125      -3.447  51.391  21.627  1.00 23.76           O  
ATOM    939  CB  LEU A 125      -1.134  53.464  21.864  1.00 25.27           C  
ATOM    940  CG  LEU A 125      -1.260  54.885  21.297  1.00 31.84           C  
ATOM    941  CD1 LEU A 125      -0.046  55.143  20.415  1.00 35.84           C  
ATOM    942  CD2 LEU A 125      -2.499  55.070  20.462  1.00 34.62           C  
ATOM    943  N   SER A 126      -4.407  53.161  22.617  1.00 28.38           N  
ATOM    944  CA  SER A 126      -5.748  52.935  22.094  1.00 33.46           C  
ATOM    945  C   SER A 126      -6.090  54.197  21.345  1.00 38.99           C  
ATOM    946  O   SER A 126      -6.586  55.136  21.971  1.00 41.03           O  
ATOM    947  CB  SER A 126      -6.760  52.849  23.219  1.00 33.05           C  
ATOM    948  OG  SER A 126      -6.710  51.638  23.905  1.00 39.36           O  
ATOM    949  N   VAL A 127      -5.802  54.278  20.044  1.00 44.69           N  
ATOM    950  CA  VAL A 127      -6.125  55.488  19.290  1.00 47.35           C  
ATOM    951  C   VAL A 127      -7.360  55.310  18.397  1.00 47.12           C  
ATOM    952  O   VAL A 127      -8.350  54.715  18.903  1.00 45.65           O  
ATOM    953  CB  VAL A 127      -4.886  56.018  18.497  1.00 48.89           C  
ATOM    954  CG1 VAL A 127      -4.671  55.244  17.210  1.00 51.12           C  
ATOM    955  CG2 VAL A 127      -5.035  57.477  18.228  1.00 49.41           C  
TER     956      VAL A 127                                                      
HETATM  957  O   HOH A 501      -3.932  47.475  39.881  1.00 10.36           O  
HETATM  958  O   HOH A 502      -2.313  68.168  31.870  1.00 23.52           O  
HETATM  959  O   HOH A 503       6.265  69.877  44.017  1.00 23.03           O  
HETATM  960  O   HOH A 504       5.269  59.403  33.305  1.00 21.35           O  
HETATM  961  O   HOH A 505      19.290  69.135  32.525  1.00 10.97           O  
HETATM  962  O   HOH A 506      13.919  50.899  41.862  1.00 22.54           O  
HETATM  963  O   HOH A 507       3.711  76.552  39.402  1.00 34.60           O  
HETATM  964  O   HOH A 508       8.258  51.785  23.522  1.00 50.06           O  
HETATM  965  O   HOH A 509      -5.640  59.303  40.162  1.00 35.38           O  
HETATM  966  O   HOH A 510      13.460  73.942  29.708  1.00 41.89           O  
HETATM  967  O   HOH A 511       3.985  75.468  36.037  1.00 29.63           O  
HETATM  968  O   HOH A 512      13.656  58.536  27.883  1.00 31.82           O  
HETATM  969  O   HOH A 513      12.269  52.805  54.909  1.00 39.05           O  
HETATM  970  O   HOH A 514      -2.495  53.622  45.985  1.00 19.96           O  
HETATM  971  O   HOH A 515      -2.810  48.825  27.168  1.00 18.97           O  
HETATM  972  O   HOH A 516      13.683  66.710  26.889  1.00 36.24           O  
HETATM  973  O   HOH A 517      -0.741  62.496  47.989  1.00 32.20           O  
HETATM  974  O   HOH A 518      -4.711  52.210  25.826  1.00 28.81           O  
HETATM  975  O   HOH A 519       8.710  51.155  27.603  1.00 39.05           O  
HETATM  976  O   HOH A 520       9.248  64.331  45.590  1.00 36.50           O  
HETATM  977  O   HOH A 521      10.553  52.929  50.749  1.00 19.71           O  
HETATM  978  O   HOH A 522       4.751  52.202  55.779  1.00 34.68           O  
HETATM  979  O   HOH A 523      -7.304  49.612  27.836  1.00 51.73           O  
HETATM  980  O   HOH A 524      11.254  50.403  24.210  1.00 32.09           O  
HETATM  981  O   HOH A 525       8.979  51.233  54.921  1.00 40.89           O  
HETATM  982  O   HOH A 526       4.012  61.451  52.116  1.00 35.30           O  
HETATM  983  O   HOH A 527       7.266  77.761  41.155  1.00 65.37           O  
HETATM  984  O   HOH A 528      -3.859  60.795  42.314  1.00 38.70           O  
HETATM  985  O   HOH A 529      -1.739  56.617  47.324  1.00 33.26           O  
HETATM  986  O   HOH A 530      12.457  49.598  36.409  1.00 34.70           O  
HETATM  987  O   HOH A 531      21.045  70.713  30.535  1.00 26.83           O  
HETATM  988  O   HOH A 532      15.926  56.418  34.689  1.00 35.83           O  
HETATM  989  O   HOH A 533      16.068  53.396  28.562  1.00 23.31           O  
HETATM  990  O   HOH A 534      19.204  61.966  42.618  1.00 43.00           O  
HETATM  991  O   HOH A 535      -6.712  67.782  32.998  1.00 47.59           O  
HETATM  992  O   HOH A 536      17.702  54.765  47.273  1.00 56.67           O  
HETATM  993  O   HOH A 537      12.408  73.232  40.928  1.00 40.41           O  
HETATM  994  O   HOH A 538      10.512  74.407  38.618  1.00 35.09           O  
HETATM  995  O   HOH A 539      -8.088  63.751  38.812  1.00 73.04           O  
HETATM  996  O   HOH A 540      -3.947  48.482  23.416  1.00 44.34           O  
HETATM  997  O   HOH A 541      17.547  65.540  25.597  1.00 64.46           O  
HETATM  998  O   HOH A 542      10.116  72.698  25.312  1.00 48.72           O  
HETATM  999  O   HOH A 543      -8.104  59.235  33.100  1.00 25.46           O  
HETATM 1000  O   HOH A 544      -5.292  51.075  32.527  1.00 50.75           O  
HETATM 1001  O   HOH A 545      23.080  66.442  43.536  1.00 55.69           O  
HETATM 1002  O   HOH A 546      17.500  66.041  46.590  1.00 37.82           O  
HETATM 1003  O   HOH A 547      17.456  68.313  44.797  1.00 57.03           O  
HETATM 1004  O   HOH A 548      19.812  62.615  45.305  1.00 57.15           O  
MASTER      318    0    0    4   10    0    0    6 1003    1    0   11          
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.