HEADER    HORMONE/GROWTH FACTOR                   30-MAY-02   1LW8              
OBSLTE     10-JUN-03 1LW8      1PC1                                             
TITLE     CRYSTAL STRUCTURE OF ALLO-ILEA2-INSULIN, AN INACTIVE CHIRAL           
TITLE    2 ANALOGUE                                                             
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: INSULIN A CHAIN;                                           
COMPND   3 CHAIN: A, C;                                                         
COMPND   4 ENGINEERED: YES;                                                     
COMPND   5 MOL_ID: 2;                                                           
COMPND   6 MOLECULE: INSULIN B CHAIN;                                           
COMPND   7 CHAIN: B, D;                                                         
COMPND   8 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 SYNTHETIC: YES;                                                      
SOURCE   3 OTHER_DETAILS: THE PROTEIN WAS CHEMICALLY SYNTHESIZED.;              
SOURCE   4 MOL_ID: 2;                                                           
SOURCE   5 SYNTHETIC: YES;                                                      
SOURCE   6 OTHER_DETAILS: THE PROTEIN WAS CHEMICALLY SYNTHESIZED.               
KEYWDS    ALLO-ILEA2-INSULIN, INSULIN RECEPTOR, INACTIVE CHIRAL                 
KEYWDS   2 ANALOGUE                                                             
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    Z.L.WAN,B.XU,Y.C.CHU,P.KATSOYANNIS,M.A.WEISS                          
REVDAT   2   10-JUN-03 1LW8    1       OBSLTE                                   
REVDAT   1   19-JUN-02 1LW8    0                                                
JRNL        AUTH   Z.L.WAN,B.XU,Y.C.CHU,P.KATSOYANNIS,M.A.WEISS                 
JRNL        TITL   CRYSTAL STRUCTURE OF ALLO-ILEA2-INSULIN, AN                  
JRNL        TITL 2 INACTIVE CHIRAL ANALOGUE: IMPLICATIONS FOR THE               
JRNL        TITL 3 MECHANISM OF RECEPTOR BINDING                                
JRNL        REF    TO BE PUBLISHED                                              
JRNL        REFN                                                                
REMARK   1                                                                      
REMARK   1 REFERENCE 1                                                          
REMARK   1  AUTH   B.XU,Q.X.HUA,S.H.NAKAGAWA,W.H.JIA,Y.C.CHU,                   
REMARK   1  AUTH 2 P.G.KATSOYANNIS,M.A.WEISS                                    
REMARK   1  TITL   CHIRAL MUTAGENESIS OF INSULIN'S HIDDEN                       
REMARK   1  TITL 2 RECEPTOR-BINDING SURFACE: STRUCTURE OF AN                    
REMARK   1  TITL 3 ALLO-ISOLEUCINE A2 ANALOGUE                                  
REMARK   1  REF    J.MOL.BIOL.                   V. 316   435 2002              
REMARK   1  REFN   ASTM JMOBAK  UK ISSN 0022-2836                               
REMARK   1 REFERENCE 2                                                          
REMARK   1  AUTH   B.XU,Q.X.HUA,S.H.NAKAGAWA,W.H.JIA,Y.C.CHU,                   
REMARK   1  AUTH 2 P.G.KATSOYANNIS,M.A.WIESS                                    
REMARK   1  TITL   A CAVITY-FORMING MUTATION IN INSULIN INDUCES                 
REMARK   1  TITL 2 SEGMENTAL UNFOLDING OF A SURROUNDING ALPHA-HELIX             
REMARK   1  REF    PROTEIN SCI.                  V.  11   104 2002              
REMARK   1  REFN   ASTM PRCIEI  US ISSN 0961-8368                               
REMARK   1 REFERENCE 3                                                          
REMARK   1  AUTH   M.A.WEISS,Z.L.WAN,M.ZHAO,Y.C.CHU,S.H.NAKAGAWA,               
REMARK   1  AUTH 2 G.T.BURKE,W.H.JIA,R.HELLMICH,P.G.KATSOYANNIS                 
REMARK   1  TITL   NON-STANDARD INSULIN DESIGN: STRUCTURE-ACTIVITY              
REMARK   1  TITL 2 RELATIONSHIPS AT PERIPHERY OF THE INSULIN RECEPTOR           
REMARK   1  REF    J.MOL.BIOL.                   V. 315   103 2002              
REMARK   1  REFN   ASTM JMOBAK  UK ISSN 0022-2836                               
REMARK   1 REFERENCE 4                                                          
REMARK   1  AUTH   R.L.BALDWIN,G.D.ROSE                                         
REMARK   1  TITL   IS PROTEIN FOLDING HIERARCHIC? I. LOCAL STRUCTURE            
REMARK   1  TITL 2 AND PEPTIDE FOLDING                                          
REMARK   1  REF    TRENDS BIOCHEM. SCI.          V.  24    26 1999              
REMARK   1  REFN   ASTM TBSCDB  NE ISSN 0968-0004                               
REMARK   1 REFERENCE 5                                                          
REMARK   1  AUTH   R.L.BALDWIN,G.D.ROSE                                         
REMARK   1  TITL   IS PROTEIN FOLDING HIERARCHIC? II. FOLDING                   
REMARK   1  TITL 2 INTERMEDIATES AND TRANSTITION STATES                         
REMARK   1  REF    TRENDS BIOCHEM. SCI.          V.  24    77 1999              
REMARK   1  REFN   ASTM TBSCDB  NE ISSN 0968-0004                               
REMARK   1 REFERENCE 6                                                          
REMARK   1  AUTH   S.E.SHOELSON,Z.X.LU,L.PARLAUTAN,C.S.LYNCH,M.A.WEISS          
REMARK   1  TITL   MUTATIONS AT THE DIMER, HEXAMER, AND                         
REMARK   1  TITL 2 RECEPTOR-BINDING SURFACES OF INSULIN INDEPENDENTLY           
REMARK   1  TITL 3 AFFECT INSULIN-INSULIN AND INSULIN-RECEPTOR                  
REMARK   1  TITL 4 INTERACTIONS.                                                
REMARK   1  REF    BIOCHEMISTRY                  V.  31  1757 1992              
REMARK   1  REFN   ASTM BICHAW  US ISSN 0006-2960                               
REMARK   2                                                                      
REMARK   2 RESOLUTION. 2.50 ANGSTROMS.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : X-PLOR 3.1                                           
REMARK   3   AUTHORS     : BRUNGER                                              
REMARK   3                                                                      
REMARK   3  DATA USED IN REFINEMENT.                                            
REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) : 2.50                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 8.00                           
REMARK   3   DATA CUTOFF            (SIGMA(F)) : 2.000                          
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             : 3007                           
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   CROSS-VALIDATION METHOD          : NULL                            
REMARK   3   FREE R VALUE TEST SET SELECTION  : RANDOM                          
REMARK   3   R VALUE            (WORKING SET) : 0.221                           
REMARK   3   FREE R VALUE                     : 0.266                           
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : NULL                            
REMARK   3   FREE R VALUE TEST SET COUNT      : 300                             
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            : 805                                     
REMARK   3   NUCLEIC ACID ATOMS       : 0                                       
REMARK   3   HETEROGEN ATOMS          : 2                                       
REMARK   3   SOLVENT ATOMS            : 69                                      
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : NULL                           
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) : NULL                            
REMARK   3   BOND ANGLES            (DEGREES) : NULL                            
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 1LW8 COMPLIES WITH FORMAT V. 2.3, 09-JULY-1998                       
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 07-JUN-2002.                
REMARK 100 THE RCSB ID CODE IS RCSB016338.                                      
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 12-NOV-2001                        
REMARK 200  TEMPERATURE           (KELVIN) : 298.0                              
REMARK 200  PH                             : 6.40                               
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          : RIGAKU RU200                       
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 1.5418                             
REMARK 200  MONOCHROMATOR                  : MIRROR                             
REMARK 200  OPTICS                         : MIRRORS                            
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : IMAGE PLATE                        
REMARK 200  DETECTOR MANUFACTURER          : RIGAKU RAXIS IV                    
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : R-AXIS                             
REMARK 200  DATA SCALING SOFTWARE          : XENGEN                             
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 6026                               
REMARK 200  RESOLUTION RANGE HIGH      (A) : 2.000                              
REMARK 200  RESOLUTION RANGE LOW       (A) : 20.000                             
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : 1.000                              
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : 98.0                               
REMARK 200  DATA REDUNDANCY                : NULL                               
REMARK 200  R MERGE                    (I) : 0.05900                            
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : NULL                               
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.00                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : 2.07                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : 89.3                               
REMARK 200  DATA REDUNDANCY IN SHELL       : NULL                               
REMARK 200  R MERGE FOR SHELL          (I) : 0.05900                            
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR SHELL         : NULL                               
REMARK 200                                                                      
REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH                              
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT        
REMARK 200 SOFTWARE USED: CNS AND X-PLOR                                        
REMARK 200 STARTING MODEL: PDB ENTRY 1TRZ                                       
REMARK 200                                                                      
REMARK 200 REMARK: NULL                                                         
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 39.49                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.03                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: TRIS, SODIUM CITRATE, ACETONE,           
REMARK 280  PHENOL, PH 6.4, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K     
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: H 3                              
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290       2555   -Y,X-Y,Z                                                
REMARK 290       3555   -X+Y,-X,Z                                               
REMARK 290       4555   2/3+X,1/3+Y,1/3+Z                                       
REMARK 290       5555   2/3-Y,1/3+X-Y,1/3+Z                                     
REMARK 290       6555   2/3-X+Y,1/3-X,1/3+Z                                     
REMARK 290       7555   1/3+X,2/3+Y,2/3+Z                                       
REMARK 290       8555   1/3-Y,2/3+X-Y,2/3+Z                                     
REMARK 290       9555   1/3-X+Y,2/3-X,2/3+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 -0.500000 -0.866025  0.000000        0.00000            
REMARK 290   SMTRY2   2  0.866025 -0.500000  0.000000        0.00000            
REMARK 290   SMTRY3   2  0.000000  0.000000  1.000000        0.00000            
REMARK 290   SMTRY1   3 -0.500000  0.866025  0.000000        0.00000            
REMARK 290   SMTRY2   3 -0.866025 -0.500000  0.000000        0.00000            
REMARK 290   SMTRY3   3  0.000000  0.000000  1.000000        0.00000            
REMARK 290   SMTRY1   4  1.000000  0.000000  0.000000       40.24350            
REMARK 290   SMTRY2   4  0.000000  1.000000  0.000000       23.23460            
REMARK 290   SMTRY3   4  0.000000  0.000000  1.000000       12.64633            
REMARK 290   SMTRY1   5 -0.500000 -0.866025  0.000000       40.24350            
REMARK 290   SMTRY2   5  0.866025 -0.500000  0.000000       23.23460            
REMARK 290   SMTRY3   5  0.000000  0.000000  1.000000       12.64633            
REMARK 290   SMTRY1   6 -0.500000  0.866025  0.000000       40.24350            
REMARK 290   SMTRY2   6 -0.866025 -0.500000  0.000000       23.23460            
REMARK 290   SMTRY3   6  0.000000  0.000000  1.000000       12.64633            
REMARK 290   SMTRY1   7  1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   7  0.000000  1.000000  0.000000       46.46919            
REMARK 290   SMTRY3   7  0.000000  0.000000  1.000000       25.29267            
REMARK 290   SMTRY1   8 -0.500000 -0.866025  0.000000        0.00000            
REMARK 290   SMTRY2   8  0.866025 -0.500000  0.000000       46.46919            
REMARK 290   SMTRY3   8  0.000000  0.000000  1.000000       25.29267            
REMARK 290   SMTRY1   9 -0.500000  0.866025  0.000000        0.00000            
REMARK 290   SMTRY2   9 -0.866025 -0.500000  0.000000       46.46919            
REMARK 290   SMTRY3   9  0.000000  0.000000  1.000000       25.29267            
REMARK 290                                                                      
REMARK 290 REMARK: NULL                                                         
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1                                                       
REMARK 300 THIS ENTRY CONTAINS THE CRYSTALLOGRAPHIC ASYMMETRIC UNIT             
REMARK 300 WHICH CONSISTS OF 4 CHAIN(S). SEE REMARK 350 FOR                     
REMARK 300 INFORMATION ON GENERATING THE BIOLOGICAL MOLECULE(S).                
REMARK 350                                                                      
REMARK 350 GENERATING THE BIOMOLECULE                                           
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 APPLY THE FOLLOWING TO CHAINS: A, B, C, D                            
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 -0.500000 -0.866025  0.000000       40.24350            
REMARK 350   BIOMT2   2  0.866025 -0.500000  0.000000       69.70379            
REMARK 350   BIOMT3   2  0.000000  0.000000  1.000000        0.00000            
REMARK 350   BIOMT1   3 -0.500000  0.866025  0.000000      -40.24350            
REMARK 350   BIOMT2   3 -0.866025 -0.500000  0.000000       69.70379            
REMARK 350   BIOMT3   3  0.000000  0.000000  1.000000        0.00000            
REMARK 375                                                                      
REMARK 375 SPECIAL POSITION                                                     
REMARK 375 THE FOLLOWING ATOMS ARE FOUND TO BE WITHIN 0.15 ANGSTROMS            
REMARK 375 OF A SYMMETRY RELATED ATOM AND ARE ASSUMED TO BE ON SPECIAL          
REMARK 375 POSITIONS.                                                           
REMARK 375                                                                      
REMARK 375 ATOM RES CSSEQI                                                      
REMARK 375 ZN    ZN B 101   LIES ON A SPECIAL POSITION.                         
REMARK 375 ZN    ZN D 102   LIES ON A SPECIAL POSITION.                         
REMARK 470                                                                      
REMARK 470 MISSING ATOM                                                         
REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS(M=MODEL NUMBER;            
REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER;          
REMARK 470 I=INSERTION CODE):                                                   
REMARK 470   M RES CSSEQI  ATOMS                                                
REMARK 470     LYS D  29    CB    CG    CD    CE    NZ                          
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT                     
REMARK 500                                                                      
REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT.                            
REMARK 500                                                                      
REMARK 500  ATM1  RES C  SSEQI   ATM2  RES C  SSEQI                             
REMARK 500   CA   TYR A    14     O    HOH      12              1.52            
REMARK 500   CB   TYR A    14     O    HOH      12              2.00            
REMARK 500   O    TYR A    14     O    HOH      12              2.02            
REMARK 500   C    TYR A    14     O    HOH      12              2.05            
REMARK 500   O    HOH      12     O    HOH      63              2.15            
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 1TRZ   RELATED DB: PDB                                   
REMARK 900 1TRZ CONTAINS THE SAME SEQUENCE AND STRUCTURE, BUT                   
REMARK 900 SUBSTITUTION OF ILE-A2 RESIDUE BY ALLO-ILE                           
DBREF  1LW8 A    1    21  UNP    P01308   INS_HUMAN       90    110             
DBREF  1LW8 C    1    21  UNP    P01308   INS_HUMAN       90    110             
DBREF  1LW8 B    1    30  UNP    P01308   INS_HUMAN       25     54             
DBREF  1LW8 D    1    30  UNP    P01308   INS_HUMAN       25     54             
SEQADV 1LW8 IIL A    2  UNP  P01308    ILE    91 MODIFIED RESIDUE               
SEQADV 1LW8 IIL C    2  UNP  P01308    ILE    91 MODIFIED RESIDUE               
SEQRES   1 A   21  GLY IIL VAL GLU GLN CYS CYS THR SER ILE CYS SER LEU          
SEQRES   2 A   21  TYR GLN LEU GLU ASN TYR CYS ASN                              
SEQRES   1 B   30  PHE VAL ASN GLN HIS LEU CYS GLY SER HIS LEU VAL GLU          
SEQRES   2 B   30  ALA LEU TYR LEU VAL CYS GLY GLU ARG GLY PHE PHE TYR          
SEQRES   3 B   30  THR PRO LYS THR                                              
SEQRES   1 C   21  GLY IIL VAL GLU GLN CYS CYS THR SER ILE CYS SER LEU          
SEQRES   2 C   21  TYR GLN LEU GLU ASN TYR CYS ASN                              
SEQRES   1 D   30  PHE VAL ASN GLN HIS LEU CYS GLY SER HIS LEU VAL GLU          
SEQRES   2 D   30  ALA LEU TYR LEU VAL CYS GLY GLU ARG GLY PHE PHE TYR          
SEQRES   3 D   30  THR PRO LYS THR                                              
MODRES 1LW8 IIL A    2  ILE  ISO-ISOLEUCINE                                     
MODRES 1LW8 IIL C    2  ILE  ISO-ISOLEUCINE                                     
HET    IIL  A   2       8                                                       
HET    IIL  C   2       8                                                       
HET     ZN  B 101       1                                                       
HET     ZN  D 102       1                                                       
HETNAM     IIL ISO-ISOLEUCINE                                                   
HETNAM      ZN ZINC ION                                                         
HETSYN     IIL ALLO-ISOLEUCINE                                                  
FORMUL   1  IIL    2(C6 H13 N O2)                                               
FORMUL   5   ZN    2(ZN 2+)                                                     
FORMUL   7  HOH   *69(H2 O1)                                                    
HELIX    1   1 GLY A    1  CYS A    7  1                                   7    
HELIX    2   2 LEU A   16  CYS A   20  5                                   5    
HELIX    3   3 GLY B    8  GLY B   20  1                                  13    
HELIX    4   4 GLY C    1  CYS C    6  1                                   6    
HELIX    5   5 SER C   12  ASN C   18  1                                   7    
HELIX    6   6 ASN D    3  GLY D   20  1                                  18    
SHEET    1   A 2 PHE B  24  TYR B  26  0                                        
SHEET    2   A 2 PHE D  24  TYR D  26 -1  O  TYR D  26   N  PHE B  24           
SSBOND   1 CYS A    6    CYS A   11                                             
SSBOND   2 CYS A    7    CYS B    7                                             
SSBOND   3 CYS A   20    CYS B   19                                             
SSBOND   4 CYS C    6    CYS C   11                                             
SSBOND   5 CYS C    7    CYS D    7                                             
SSBOND   6 CYS C   20    CYS D   19                                             
CRYST1   80.487   80.487   37.939  90.00  90.00 120.00 H 3          18          
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      0.012424  0.007173  0.000000        0.00000                         
SCALE2      0.000000  0.014346  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.026358        0.00000                         
ATOM      1  N   GLY A   1       0.740  26.290  13.550  1.00 22.02           N  
ATOM      2  CA  GLY A   1       0.502  26.476  12.152  1.00 17.82           C  
ATOM      3  C   GLY A   1       0.975  27.817  11.645  1.00 17.68           C  
ATOM      4  O   GLY A   1       1.686  28.531  12.331  1.00 23.05           O  
HETATM    5  N   IIL A   2       0.568  28.131  10.420  1.00 20.00           N  
HETATM    6  CA  IIL A   2       0.829  29.320   9.602  1.00 24.60           C  
HETATM    7  C   IIL A   2       0.799  30.679  10.315  1.00 25.01           C  
HETATM    8  O   IIL A   2       1.550  31.599   9.984  1.00 25.35           O  
HETATM    9  CB  IIL A   2      -0.181  29.381   8.436  1.00 26.32           C  
HETATM   10  CG2 IIL A   2      -1.027  28.117   8.180  1.00 28.86           C  
HETATM   11  CG1 IIL A   2       0.594  29.767   7.172  1.00 30.09           C  
HETATM   12  CD1 IIL A   2      -0.234  29.860   5.871  1.00 30.51           C  
ATOM     13  N   VAL A   3      -0.269  30.880  11.088  1.00 29.14           N  
ATOM     14  CA  VAL A   3      -0.539  32.102  11.818  1.00 28.74           C  
ATOM     15  C   VAL A   3       0.234  32.116  13.126  1.00 30.08           C  
ATOM     16  O   VAL A   3       0.577  33.184  13.626  1.00 31.38           O  
ATOM     17  CB  VAL A   3      -2.080  32.155  11.987  1.00 29.28           C  
ATOM     18  CG1 VAL A   3      -2.552  33.203  12.979  1.00 35.65           C  
ATOM     19  CG2 VAL A   3      -2.663  32.567  10.638  1.00 32.43           C  
ATOM     20  N   GLU A   4       0.539  30.938  13.685  1.00 29.82           N  
ATOM     21  CA  GLU A   4       1.327  30.813  14.901  1.00 30.00           C  
ATOM     22  C   GLU A   4       2.829  30.715  14.718  1.00 27.92           C  
ATOM     23  O   GLU A   4       3.569  31.237  15.551  1.00 30.50           O  
ATOM     24  CB  GLU A   4       0.906  29.602  15.689  1.00 35.47           C  
ATOM     25  CG  GLU A   4      -0.367  29.841  16.468  1.00 40.83           C  
ATOM     26  CD  GLU A   4      -0.616  28.770  17.515  1.00 42.85           C  
ATOM     27  OE1 GLU A   4      -1.766  28.354  17.639  1.00 46.44           O  
ATOM     28  OE2 GLU A   4       0.322  28.361  18.208  1.00 40.17           O  
ATOM     29  N   GLN A   5       3.300  29.997  13.690  1.00 24.10           N  
ATOM     30  CA  GLN A   5       4.722  29.919  13.380  1.00 25.19           C  
ATOM     31  C   GLN A   5       5.080  31.273  12.826  1.00 20.75           C  
ATOM     32  O   GLN A   5       5.978  31.884  13.369  1.00 28.22           O  
ATOM     33  CB  GLN A   5       5.118  28.914  12.274  1.00 29.69           C  
ATOM     34  CG  GLN A   5       4.952  27.407  12.481  1.00 41.46           C  
ATOM     35  CD  GLN A   5       6.041  26.713  13.299  1.00 40.06           C  
ATOM     36  OE1 GLN A   5       7.072  26.290  12.765  1.00 47.23           O  
ATOM     37  NE2 GLN A   5       5.836  26.553  14.610  1.00 43.47           N  
ATOM     38  N   CYS A   6       4.388  31.792  11.805  1.00 23.19           N  
ATOM     39  CA  CYS A   6       4.765  33.038  11.165  1.00 19.95           C  
ATOM     40  C   CYS A   6       4.166  34.368  11.565  1.00 22.72           C  
ATOM     41  O   CYS A   6       4.711  35.387  11.150  1.00 20.84           O  
ATOM     42  CB  CYS A   6       4.576  32.868   9.694  1.00 22.21           C  
ATOM     43  SG  CYS A   6       5.713  31.625   9.057  1.00 26.73           S  
ATOM     44  N   CYS A   7       3.064  34.439  12.316  1.00 29.76           N  
ATOM     45  CA  CYS A   7       2.569  35.730  12.776  1.00 32.26           C  
ATOM     46  C   CYS A   7       2.746  35.835  14.280  1.00 36.05           C  
ATOM     47  O   CYS A   7       3.149  36.896  14.751  1.00 35.74           O  
ATOM     48  CB  CYS A   7       1.086  35.910  12.406  1.00 30.20           C  
ATOM     49  SG  CYS A   7       0.264  37.391  13.070  1.00 29.07           S  
ATOM     50  N   THR A   8       2.491  34.771  15.062  1.00 37.23           N  
ATOM     51  CA  THR A   8       2.652  34.839  16.512  1.00 38.13           C  
ATOM     52  C   THR A   8       4.112  34.763  16.916  1.00 39.13           C  
ATOM     53  O   THR A   8       4.537  35.395  17.883  1.00 43.94           O  
ATOM     54  CB  THR A   8       1.877  33.707  17.198  1.00 37.85           C  
ATOM     55  OG1 THR A   8       0.520  33.872  16.805  1.00 38.59           O  
ATOM     56  CG2 THR A   8       1.960  33.740  18.719  1.00 37.00           C  
ATOM     57  N   SER A   9       4.878  33.991  16.147  1.00 40.67           N  
ATOM     58  CA  SER A   9       6.308  33.820  16.357  1.00 39.90           C  
ATOM     59  C   SER A   9       7.046  34.302  15.112  1.00 35.26           C  
ATOM     60  O   SER A   9       6.447  34.500  14.055  1.00 32.06           O  
ATOM     61  CB  SER A   9       6.631  32.329  16.630  1.00 40.33           C  
ATOM     62  OG  SER A   9       6.019  31.807  17.812  1.00 37.57           O  
ATOM     63  N   ILE A  10       8.348  34.558  15.232  1.00 35.19           N  
ATOM     64  CA  ILE A  10       9.139  34.977  14.090  1.00 35.34           C  
ATOM     65  C   ILE A  10       9.673  33.754  13.342  1.00 34.33           C  
ATOM     66  O   ILE A  10      10.396  32.910  13.875  1.00 35.75           O  
ATOM     67  CB  ILE A  10      10.254  35.922  14.634  1.00 36.89           C  
ATOM     68  CG1 ILE A  10       9.591  37.201  15.132  1.00 33.94           C  
ATOM     69  CG2 ILE A  10      11.277  36.266  13.557  1.00 40.18           C  
ATOM     70  CD1 ILE A  10      10.505  38.237  15.800  1.00 37.05           C  
ATOM     71  N   CYS A  11       9.246  33.689  12.077  1.00 32.93           N  
ATOM     72  CA  CYS A  11       9.585  32.634  11.131  1.00 32.71           C  
ATOM     73  C   CYS A  11      10.912  32.875  10.409  1.00 37.19           C  
ATOM     74  O   CYS A  11      11.830  33.539  10.909  1.00 42.85           O  
ATOM     75  CB  CYS A  11       8.455  32.508  10.087  1.00 31.25           C  
ATOM     76  SG  CYS A  11       7.131  31.336  10.466  1.00 35.13           S  
ATOM     77  N   SER A  12      11.016  32.275   9.216  1.00 36.59           N  
ATOM     78  CA  SER A  12      12.122  32.482   8.309  1.00 34.13           C  
ATOM     79  C   SER A  12      11.606  32.254   6.894  1.00 35.91           C  
ATOM     80  O   SER A  12      10.409  32.329   6.605  1.00 36.81           O  
ATOM     81  CB  SER A  12      13.269  31.508   8.643  1.00 32.39           C  
ATOM     82  OG  SER A  12      13.018  30.137   8.362  1.00 30.80           O  
ATOM     83  N   LEU A  13      12.553  32.040   5.988  1.00 40.00           N  
ATOM     84  CA  LEU A  13      12.305  31.753   4.591  1.00 37.74           C  
ATOM     85  C   LEU A  13      11.811  30.341   4.402  1.00 33.84           C  
ATOM     86  O   LEU A  13      10.816  30.137   3.715  1.00 32.32           O  
ATOM     87  CB  LEU A  13      13.603  31.973   3.814  1.00 40.29           C  
ATOM     88  CG  LEU A  13      13.690  31.660   2.328  1.00 39.55           C  
ATOM     89  CD1 LEU A  13      12.661  32.440   1.533  1.00 41.62           C  
ATOM     90  CD2 LEU A  13      15.082  32.011   1.866  1.00 41.24           C  
ATOM     91  N   TYR A  14      12.501  29.384   5.032  1.00 33.38           N  
ATOM     92  CA  TYR A  14      12.179  27.977   4.883  1.00 33.73           C  
ATOM     93  C   TYR A  14      11.052  27.391   5.723  1.00 32.16           C  
ATOM     94  O   TYR A  14      10.612  26.285   5.420  1.00 30.35           O  
ATOM     95  CB  TYR A  14      13.501  27.209   5.070  1.00 36.22           C  
ATOM     96  CG  TYR A  14      14.390  27.451   3.849  1.00 37.55           C  
ATOM     97  CD1 TYR A  14      13.863  27.226   2.574  1.00 37.29           C  
ATOM     98  CD2 TYR A  14      15.688  27.954   3.972  1.00 39.88           C  
ATOM     99  CE1 TYR A  14      14.604  27.510   1.426  1.00 35.30           C  
ATOM    100  CE2 TYR A  14      16.439  28.242   2.819  1.00 39.12           C  
ATOM    101  CZ  TYR A  14      15.890  28.023   1.550  1.00 37.36           C  
ATOM    102  OH  TYR A  14      16.595  28.342   0.399  1.00 28.33           O  
ATOM    103  N   GLN A  15      10.564  28.103   6.754  1.00 32.75           N  
ATOM    104  CA  GLN A  15       9.360  27.732   7.510  1.00 35.13           C  
ATOM    105  C   GLN A  15       8.057  28.205   6.823  1.00 35.25           C  
ATOM    106  O   GLN A  15       6.949  27.771   7.145  1.00 36.55           O  
ATOM    107  CB  GLN A  15       9.403  28.335   8.917  1.00 32.61           C  
ATOM    108  CG  GLN A  15      10.392  27.693   9.861  1.00 30.06           C  
ATOM    109  CD  GLN A  15      10.497  28.425  11.191  1.00 31.33           C  
ATOM    110  OE1 GLN A  15       9.539  28.512  11.959  1.00 37.16           O  
ATOM    111  NE2 GLN A  15      11.668  28.976  11.513  1.00 35.47           N  
ATOM    112  N   LEU A  16       8.215  29.111   5.849  1.00 35.00           N  
ATOM    113  CA  LEU A  16       7.190  29.730   5.007  1.00 29.35           C  
ATOM    114  C   LEU A  16       7.045  28.979   3.672  1.00 28.71           C  
ATOM    115  O   LEU A  16       5.943  28.887   3.117  1.00 19.56           O  
ATOM    116  CB  LEU A  16       7.639  31.172   4.824  1.00 19.75           C  
ATOM    117  CG  LEU A  16       6.833  32.268   4.189  1.00 19.56           C  
ATOM    118  CD1 LEU A  16       5.602  32.616   5.007  1.00 19.50           C  
ATOM    119  CD2 LEU A  16       7.707  33.513   4.181  1.00 16.32           C  
ATOM    120  N   GLU A  17       8.199  28.464   3.164  1.00 29.13           N  
ATOM    121  CA  GLU A  17       8.299  27.622   1.970  1.00 29.70           C  
ATOM    122  C   GLU A  17       7.625  26.273   2.234  1.00 32.02           C  
ATOM    123  O   GLU A  17       7.249  25.563   1.296  1.00 33.76           O  
ATOM    124  CB  GLU A  17       9.760  27.317   1.557  1.00 25.63           C  
ATOM    125  CG  GLU A  17      10.686  28.470   1.189  1.00 29.46           C  
ATOM    126  CD  GLU A  17      11.255  28.590  -0.232  1.00 36.99           C  
ATOM    127  OE1 GLU A  17      10.752  27.978  -1.182  1.00 38.57           O  
ATOM    128  OE2 GLU A  17      12.217  29.350  -0.390  1.00 38.20           O  
ATOM    129  N   ASN A  18       7.508  25.944   3.539  1.00 31.02           N  
ATOM    130  CA  ASN A  18       6.815  24.788   4.105  1.00 25.82           C  
ATOM    131  C   ASN A  18       5.320  24.798   3.785  1.00 20.69           C  
ATOM    132  O   ASN A  18       4.663  23.765   3.672  1.00 21.26           O  
ATOM    133  CB  ASN A  18       6.979  24.761   5.638  1.00 27.42           C  
ATOM    134  CG  ASN A  18       8.328  24.341   6.230  1.00 28.94           C  
ATOM    135  OD1 ASN A  18       8.525  24.380   7.450  1.00 22.19           O  
ATOM    136  ND2 ASN A  18       9.293  23.911   5.413  1.00 30.40           N  
ATOM    137  N   TYR A  19       4.765  25.995   3.633  1.00 19.93           N  
ATOM    138  CA  TYR A  19       3.370  26.169   3.311  1.00 20.02           C  
ATOM    139  C   TYR A  19       3.081  26.279   1.822  1.00 20.26           C  
ATOM    140  O   TYR A  19       1.982  26.641   1.408  1.00 23.74           O  
ATOM    141  CB  TYR A  19       2.904  27.390   4.093  1.00 23.51           C  
ATOM    142  CG  TYR A  19       2.931  27.059   5.577  1.00 22.61           C  
ATOM    143  CD1 TYR A  19       2.028  26.108   6.070  1.00 24.67           C  
ATOM    144  CD2 TYR A  19       3.885  27.635   6.421  1.00 22.08           C  
ATOM    145  CE1 TYR A  19       2.082  25.719   7.401  1.00 21.20           C  
ATOM    146  CE2 TYR A  19       3.940  27.243   7.763  1.00 22.37           C  
ATOM    147  CZ  TYR A  19       3.039  26.285   8.237  1.00 23.59           C  
ATOM    148  OH  TYR A  19       3.106  25.856   9.546  1.00 21.10           O  
ATOM    149  N   CYS A  20       4.058  25.927   0.983  1.00 24.64           N  
ATOM    150  CA  CYS A  20       3.901  25.935  -0.465  1.00 27.73           C  
ATOM    151  C   CYS A  20       3.252  24.647  -0.968  1.00 31.50           C  
ATOM    152  O   CYS A  20       2.541  23.957  -0.228  1.00 37.44           O  
ATOM    153  CB  CYS A  20       5.255  26.092  -1.147  1.00 24.69           C  
ATOM    154  SG  CYS A  20       6.113  27.608  -0.695  1.00 25.12           S  
ATOM    155  N   ASN A  21       3.459  24.366  -2.264  1.00 30.47           N  
ATOM    156  CA  ASN A  21       3.000  23.166  -2.945  1.00 27.54           C  
ATOM    157  C   ASN A  21       4.200  22.442  -3.608  1.00 28.89           C  
ATOM    158  O   ASN A  21       4.094  22.017  -4.762  1.00 32.39           O  
ATOM    159  CB  ASN A  21       1.935  23.599  -3.965  1.00 20.65           C  
ATOM    160  CG  ASN A  21       0.648  24.147  -3.366  1.00 23.92           C  
ATOM    161  OD1 ASN A  21       0.376  24.019  -2.173  1.00 24.99           O  
ATOM    162  ND2 ASN A  21      -0.193  24.766  -4.185  1.00 19.93           N  
ATOM    163  OXT ASN A  21       5.253  22.296  -2.966  1.00 22.20           O  
TER     164      ASN A  21                                                      
ATOM    165  N   PHE B   1      16.407  37.743   4.369  1.00 33.65           N  
ATOM    166  CA  PHE B   1      14.983  37.539   4.520  1.00 29.26           C  
ATOM    167  C   PHE B   1      14.486  38.315   5.713  1.00 28.39           C  
ATOM    168  O   PHE B   1      15.266  38.786   6.538  1.00 29.99           O  
ATOM    169  CB  PHE B   1      14.687  36.073   4.742  1.00 31.24           C  
ATOM    170  CG  PHE B   1      13.274  35.712   4.329  1.00 25.30           C  
ATOM    171  CD1 PHE B   1      12.905  35.838   2.992  1.00 25.07           C  
ATOM    172  CD2 PHE B   1      12.353  35.305   5.287  1.00 31.07           C  
ATOM    173  CE1 PHE B   1      11.605  35.558   2.610  1.00 23.47           C  
ATOM    174  CE2 PHE B   1      11.047  35.025   4.895  1.00 31.48           C  
ATOM    175  CZ  PHE B   1      10.676  35.150   3.557  1.00 31.97           C  
ATOM    176  N   VAL B   2      13.165  38.437   5.804  1.00 30.49           N  
ATOM    177  CA  VAL B   2      12.535  39.074   6.939  1.00 27.59           C  
ATOM    178  C   VAL B   2      12.748  38.287   8.224  1.00 27.22           C  
ATOM    179  O   VAL B   2      12.854  37.059   8.283  1.00 28.16           O  
ATOM    180  CB  VAL B   2      10.975  39.274   6.756  1.00 25.80           C  
ATOM    181  CG1 VAL B   2      10.771  40.585   6.026  1.00 25.10           C  
ATOM    182  CG2 VAL B   2      10.293  38.151   5.991  1.00 16.45           C  
ATOM    183  N   ASN B   3      12.845  39.123   9.243  1.00 25.97           N  
ATOM    184  CA  ASN B   3      12.979  38.713  10.615  1.00 25.07           C  
ATOM    185  C   ASN B   3      11.889  39.600  11.219  1.00 21.12           C  
ATOM    186  O   ASN B   3      12.030  40.788  11.510  1.00 14.36           O  
ATOM    187  CB  ASN B   3      14.437  39.043  10.981  1.00 37.54           C  
ATOM    188  CG  ASN B   3      15.005  38.684  12.357  1.00 44.59           C  
ATOM    189  OD1 ASN B   3      14.329  38.177  13.257  1.00 49.34           O  
ATOM    190  ND2 ASN B   3      16.301  38.976  12.543  1.00 46.43           N  
ATOM    191  N   GLN B   4      10.712  38.974  11.261  1.00 26.99           N  
ATOM    192  CA  GLN B   4       9.490  39.595  11.748  1.00 32.36           C  
ATOM    193  C   GLN B   4       8.291  38.648  11.753  1.00 31.93           C  
ATOM    194  O   GLN B   4       8.293  37.549  11.186  1.00 30.60           O  
ATOM    195  CB  GLN B   4       9.103  40.825  10.886  1.00 41.88           C  
ATOM    196  CG  GLN B   4       8.740  40.556   9.415  1.00 46.30           C  
ATOM    197  CD  GLN B   4       7.999  41.711   8.751  1.00 41.80           C  
ATOM    198  OE1 GLN B   4       6.771  41.703   8.614  1.00 41.68           O  
ATOM    199  NE2 GLN B   4       8.731  42.737   8.319  1.00 40.85           N  
ATOM    200  N   HIS B   5       7.245  39.165  12.400  1.00 30.07           N  
ATOM    201  CA  HIS B   5       5.946  38.529  12.463  1.00 35.82           C  
ATOM    202  C   HIS B   5       5.101  38.975  11.261  1.00 35.99           C  
ATOM    203  O   HIS B   5       4.714  40.142  11.136  1.00 39.66           O  
ATOM    204  CB  HIS B   5       5.232  38.923  13.750  1.00 41.80           C  
ATOM    205  CG  HIS B   5       5.868  38.478  15.067  1.00 47.15           C  
ATOM    206  ND1 HIS B   5       6.022  37.250  15.550  1.00 47.89           N  
ATOM    207  CD2 HIS B   5       6.357  39.359  16.001  1.00 48.23           C  
ATOM    208  CE1 HIS B   5       6.577  37.379  16.733  1.00 47.43           C  
ATOM    209  NE2 HIS B   5       6.782  38.640  17.003  1.00 47.95           N  
ATOM    210  N   LEU B   6       4.813  38.051  10.338  1.00 33.99           N  
ATOM    211  CA  LEU B   6       4.031  38.321   9.142  1.00 25.58           C  
ATOM    212  C   LEU B   6       2.564  38.117   9.428  1.00 23.68           C  
ATOM    213  O   LEU B   6       2.143  37.016   9.756  1.00 18.65           O  
ATOM    214  CB  LEU B   6       4.438  37.388   8.033  1.00 25.21           C  
ATOM    215  CG  LEU B   6       5.865  37.393   7.543  1.00 27.98           C  
ATOM    216  CD1 LEU B   6       6.014  36.172   6.659  1.00 32.25           C  
ATOM    217  CD2 LEU B   6       6.218  38.708   6.842  1.00 27.89           C  
ATOM    218  N   CYS B   7       1.768  39.173   9.277  1.00 27.51           N  
ATOM    219  CA  CYS B   7       0.358  39.119   9.611  1.00 29.05           C  
ATOM    220  C   CYS B   7      -0.565  39.809   8.599  1.00 30.08           C  
ATOM    221  O   CYS B   7      -0.383  40.973   8.198  1.00 28.47           O  
ATOM    222  CB  CYS B   7       0.168  39.733  10.994  1.00 28.97           C  
ATOM    223  SG  CYS B   7       1.216  39.009  12.292  1.00 31.62           S  
ATOM    224  N   GLY B   8      -1.567  38.988   8.214  1.00 23.66           N  
ATOM    225  CA  GLY B   8      -2.629  39.330   7.280  1.00 12.83           C  
ATOM    226  C   GLY B   8      -2.243  39.224   5.815  1.00  8.60           C  
ATOM    227  O   GLY B   8      -1.709  38.228   5.345  1.00  5.72           O  
ATOM    228  N   SER B   9      -2.543  40.271   5.062  1.00  5.32           N  
ATOM    229  CA  SER B   9      -2.198  40.361   3.656  1.00 11.20           C  
ATOM    230  C   SER B   9      -0.680  40.361   3.395  1.00 13.03           C  
ATOM    231  O   SER B   9      -0.219  40.055   2.295  1.00 10.42           O  
ATOM    232  CB  SER B   9      -2.845  41.627   3.113  1.00 10.19           C  
ATOM    233  OG  SER B   9      -2.460  42.788   3.841  1.00  9.71           O  
ATOM    234  N   HIS B  10       0.107  40.722   4.422  1.00 15.10           N  
ATOM    235  CA  HIS B  10       1.568  40.724   4.406  1.00 14.41           C  
ATOM    236  C   HIS B  10       2.107  39.315   4.393  1.00 14.62           C  
ATOM    237  O   HIS B  10       3.004  38.953   3.628  1.00 18.64           O  
ATOM    238  CB  HIS B  10       2.086  41.463   5.632  1.00 10.53           C  
ATOM    239  CG  HIS B  10       1.828  42.949   5.481  1.00 10.42           C  
ATOM    240  ND1 HIS B  10       1.791  43.641   4.348  1.00 15.27           N  
ATOM    241  CD2 HIS B  10       1.598  43.808   6.510  1.00 11.59           C  
ATOM    242  CE1 HIS B  10       1.551  44.883   4.659  1.00 13.82           C  
ATOM    243  NE2 HIS B  10       1.437  44.976   5.958  1.00 14.42           N  
ATOM    244  N   LEU B  11       1.446  38.562   5.267  1.00 19.11           N  
ATOM    245  CA  LEU B  11       1.590  37.142   5.441  1.00 19.37           C  
ATOM    246  C   LEU B  11       1.162  36.424   4.167  1.00 23.43           C  
ATOM    247  O   LEU B  11       1.797  35.430   3.819  1.00 34.97           O  
ATOM    248  CB  LEU B  11       0.743  36.780   6.651  1.00 18.58           C  
ATOM    249  CG  LEU B  11       0.377  35.378   7.094  1.00 29.41           C  
ATOM    250  CD1 LEU B  11       1.598  34.465   7.198  1.00 24.08           C  
ATOM    251  CD2 LEU B  11      -0.341  35.524   8.435  1.00 28.79           C  
ATOM    252  N   VAL B  12       0.155  36.883   3.411  1.00 21.69           N  
ATOM    253  CA  VAL B  12      -0.247  36.230   2.170  1.00 14.88           C  
ATOM    254  C   VAL B  12       0.713  36.648   1.055  1.00 14.32           C  
ATOM    255  O   VAL B  12       1.029  35.845   0.167  1.00 16.81           O  
ATOM    256  CB  VAL B  12      -1.736  36.620   1.852  1.00 18.36           C  
ATOM    257  CG1 VAL B  12      -2.228  35.969   0.580  1.00 15.44           C  
ATOM    258  CG2 VAL B  12      -2.647  36.098   2.942  1.00 13.61           C  
ATOM    259  N   GLU B  13       1.204  37.894   1.085  1.00  8.04           N  
ATOM    260  CA  GLU B  13       2.173  38.377   0.110  1.00 12.71           C  
ATOM    261  C   GLU B  13       3.545  37.690   0.111  1.00 10.83           C  
ATOM    262  O   GLU B  13       4.109  37.336  -0.925  1.00  4.40           O  
ATOM    263  CB  GLU B  13       2.353  39.883   0.317  1.00 20.82           C  
ATOM    264  CG  GLU B  13       1.341  40.696  -0.464  1.00 22.49           C  
ATOM    265  CD  GLU B  13       1.455  40.464  -1.969  1.00 30.52           C  
ATOM    266  OE1 GLU B  13       2.410  40.978  -2.557  1.00 28.92           O  
ATOM    267  OE2 GLU B  13       0.614  39.759  -2.545  1.00 26.14           O  
ATOM    268  N   ALA B  14       4.076  37.480   1.314  1.00 10.49           N  
ATOM    269  CA  ALA B  14       5.318  36.759   1.542  1.00 12.19           C  
ATOM    270  C   ALA B  14       5.210  35.382   0.905  1.00 12.65           C  
ATOM    271  O   ALA B  14       6.058  34.982   0.109  1.00 11.01           O  
ATOM    272  CB  ALA B  14       5.542  36.623   3.038  1.00  9.89           C  
ATOM    273  N   LEU B  15       4.057  34.753   1.207  1.00 18.06           N  
ATOM    274  CA  LEU B  15       3.630  33.475   0.656  1.00 19.32           C  
ATOM    275  C   LEU B  15       3.463  33.495  -0.857  1.00 19.03           C  
ATOM    276  O   LEU B  15       3.702  32.490  -1.536  1.00 19.04           O  
ATOM    277  CB  LEU B  15       2.313  33.064   1.302  1.00 21.72           C  
ATOM    278  CG  LEU B  15       2.356  32.508   2.723  1.00 27.30           C  
ATOM    279  CD1 LEU B  15       0.928  32.434   3.258  1.00 23.67           C  
ATOM    280  CD2 LEU B  15       3.073  31.143   2.727  1.00 30.77           C  
ATOM    281  N   TYR B  16       3.069  34.648  -1.410  1.00 18.47           N  
ATOM    282  CA  TYR B  16       2.999  34.766  -2.856  1.00 15.33           C  
ATOM    283  C   TYR B  16       4.388  34.864  -3.498  1.00 16.41           C  
ATOM    284  O   TYR B  16       4.591  34.263  -4.555  1.00 15.45           O  
ATOM    285  CB  TYR B  16       2.149  35.992  -3.222  1.00 12.19           C  
ATOM    286  CG  TYR B  16       1.959  36.112  -4.726  1.00 11.34           C  
ATOM    287  CD1 TYR B  16       1.280  35.127  -5.449  1.00  4.35           C  
ATOM    288  CD2 TYR B  16       2.501  37.214  -5.395  1.00 13.85           C  
ATOM    289  CE1 TYR B  16       1.154  35.249  -6.836  1.00 10.46           C  
ATOM    290  CE2 TYR B  16       2.363  37.338  -6.784  1.00 10.44           C  
ATOM    291  CZ  TYR B  16       1.691  36.357  -7.491  1.00  5.63           C  
ATOM    292  OH  TYR B  16       1.526  36.511  -8.846  1.00  6.38           O  
ATOM    293  N   LEU B  17       5.360  35.576  -2.897  1.00 18.38           N  
ATOM    294  CA  LEU B  17       6.709  35.732  -3.458  1.00 21.24           C  
ATOM    295  C   LEU B  17       7.593  34.492  -3.368  1.00 22.27           C  
ATOM    296  O   LEU B  17       8.211  34.079  -4.351  1.00 24.52           O  
ATOM    297  CB  LEU B  17       7.463  36.878  -2.762  1.00 18.65           C  
ATOM    298  CG  LEU B  17       8.941  37.157  -3.113  1.00 25.78           C  
ATOM    299  CD1 LEU B  17       9.034  37.722  -4.517  1.00 31.95           C  
ATOM    300  CD2 LEU B  17       9.536  38.182  -2.168  1.00 23.04           C  
ATOM    301  N   VAL B  18       7.649  33.923  -2.161  1.00 23.60           N  
ATOM    302  CA  VAL B  18       8.509  32.795  -1.809  1.00 22.72           C  
ATOM    303  C   VAL B  18       8.168  31.472  -2.483  1.00 21.64           C  
ATOM    304  O   VAL B  18       9.071  30.678  -2.739  1.00 24.30           O  
ATOM    305  CB  VAL B  18       8.479  32.679  -0.256  1.00 21.46           C  
ATOM    306  CG1 VAL B  18       9.286  31.513   0.261  1.00 15.88           C  
ATOM    307  CG2 VAL B  18       9.101  33.933   0.323  1.00 15.80           C  
ATOM    308  N   CYS B  19       6.889  31.214  -2.777  1.00 22.39           N  
ATOM    309  CA  CYS B  19       6.489  29.957  -3.392  1.00 22.22           C  
ATOM    310  C   CYS B  19       6.447  29.996  -4.904  1.00 23.23           C  
ATOM    311  O   CYS B  19       6.735  28.984  -5.534  1.00 24.10           O  
ATOM    312  CB  CYS B  19       5.111  29.519  -2.953  1.00 25.72           C  
ATOM    313  SG  CYS B  19       4.820  29.090  -1.215  1.00 31.86           S  
ATOM    314  N   GLY B  20       6.036  31.131  -5.493  1.00 28.65           N  
ATOM    315  CA  GLY B  20       5.960  31.328  -6.938  1.00 32.81           C  
ATOM    316  C   GLY B  20       5.087  30.324  -7.698  1.00 35.35           C  
ATOM    317  O   GLY B  20       3.874  30.228  -7.486  1.00 36.61           O  
ATOM    318  N   GLU B  21       5.750  29.556  -8.582  1.00 35.41           N  
ATOM    319  CA  GLU B  21       5.119  28.554  -9.446  1.00 35.08           C  
ATOM    320  C   GLU B  21       4.414  27.388  -8.745  1.00 33.64           C  
ATOM    321  O   GLU B  21       3.551  26.716  -9.316  1.00 28.45           O  
ATOM    322  CB  GLU B  21       6.185  28.009 -10.400  1.00 33.55           C  
ATOM    323  CG  GLU B  21       5.700  28.028 -11.842  1.00 31.34           C  
ATOM    324  CD  GLU B  21       6.546  27.234 -12.829  1.00 35.58           C  
ATOM    325  OE1 GLU B  21       6.763  27.731 -13.938  1.00 35.64           O  
ATOM    326  OE2 GLU B  21       6.960  26.115 -12.506  1.00 33.76           O  
ATOM    327  N   ARG B  22       4.799  27.159  -7.488  1.00 31.72           N  
ATOM    328  CA  ARG B  22       4.224  26.134  -6.647  1.00 29.95           C  
ATOM    329  C   ARG B  22       2.898  26.636  -6.127  1.00 33.35           C  
ATOM    330  O   ARG B  22       1.906  25.899  -6.180  1.00 41.95           O  
ATOM    331  CB  ARG B  22       5.099  25.834  -5.456  1.00 26.07           C  
ATOM    332  CG  ARG B  22       6.323  24.987  -5.753  1.00 33.68           C  
ATOM    333  CD  ARG B  22       7.451  25.763  -6.427  1.00 42.25           C  
ATOM    334  NE  ARG B  22       8.713  25.032  -6.390  1.00 45.32           N  
ATOM    335  CZ  ARG B  22       9.505  25.022  -5.305  1.00 42.02           C  
ATOM    336  NH1 ARG B  22       9.178  25.698  -4.189  1.00 41.87           N  
ATOM    337  NH2 ARG B  22      10.624  24.293  -5.332  1.00 37.23           N  
ATOM    338  N   GLY B  23       2.865  27.909  -5.682  1.00 31.37           N  
ATOM    339  CA  GLY B  23       1.668  28.506  -5.111  1.00 20.49           C  
ATOM    340  C   GLY B  23       1.601  28.200  -3.625  1.00 23.09           C  
ATOM    341  O   GLY B  23       2.611  27.869  -3.004  1.00 23.78           O  
ATOM    342  N   PHE B  24       0.416  28.244  -3.018  1.00 20.22           N  
ATOM    343  CA  PHE B  24       0.311  28.062  -1.582  1.00 17.04           C  
ATOM    344  C   PHE B  24      -1.119  27.821  -1.188  1.00 21.97           C  
ATOM    345  O   PHE B  24      -2.043  28.063  -1.952  1.00 22.86           O  
ATOM    346  CB  PHE B  24       0.807  29.315  -0.826  1.00 15.91           C  
ATOM    347  CG  PHE B  24       0.072  30.602  -1.221  1.00 14.47           C  
ATOM    348  CD1 PHE B  24      -1.079  31.010  -0.534  1.00 16.62           C  
ATOM    349  CD2 PHE B  24       0.541  31.382  -2.284  1.00 17.41           C  
ATOM    350  CE1 PHE B  24      -1.741  32.178  -0.912  1.00 12.11           C  
ATOM    351  CE2 PHE B  24      -0.132  32.549  -2.653  1.00 12.18           C  
ATOM    352  CZ  PHE B  24      -1.271  32.947  -1.968  1.00  8.72           C  
ATOM    353  N   PHE B  25      -1.278  27.368   0.050  1.00 30.90           N  
ATOM    354  CA  PHE B  25      -2.570  27.299   0.720  1.00 30.39           C  
ATOM    355  C   PHE B  25      -2.485  28.253   1.910  1.00 30.17           C  
ATOM    356  O   PHE B  25      -1.522  28.291   2.699  1.00 29.34           O  
ATOM    357  CB  PHE B  25      -2.901  25.899   1.257  1.00 24.05           C  
ATOM    358  CG  PHE B  25      -1.847  25.214   2.129  1.00 28.01           C  
ATOM    359  CD1 PHE B  25      -1.966  25.242   3.526  1.00 24.61           C  
ATOM    360  CD2 PHE B  25      -0.773  24.536   1.529  1.00 25.12           C  
ATOM    361  CE1 PHE B  25      -1.022  24.595   4.320  1.00 20.38           C  
ATOM    362  CE2 PHE B  25       0.168  23.889   2.336  1.00 22.71           C  
ATOM    363  CZ  PHE B  25       0.041  23.918   3.727  1.00 22.11           C  
ATOM    364  N   TYR B  26      -3.485  29.116   1.968  1.00 27.82           N  
ATOM    365  CA  TYR B  26      -3.568  29.969   3.115  1.00 28.33           C  
ATOM    366  C   TYR B  26      -4.799  29.522   3.871  1.00 25.13           C  
ATOM    367  O   TYR B  26      -5.929  29.507   3.387  1.00 19.49           O  
ATOM    368  CB  TYR B  26      -3.666  31.431   2.687  1.00 30.44           C  
ATOM    369  CG  TYR B  26      -3.567  32.340   3.905  1.00 33.68           C  
ATOM    370  CD1 TYR B  26      -2.337  32.517   4.543  1.00 34.18           C  
ATOM    371  CD2 TYR B  26      -4.712  32.959   4.399  1.00 31.01           C  
ATOM    372  CE1 TYR B  26      -2.251  33.305   5.684  1.00 28.86           C  
ATOM    373  CE2 TYR B  26      -4.627  33.749   5.539  1.00 31.17           C  
ATOM    374  CZ  TYR B  26      -3.401  33.911   6.171  1.00 27.40           C  
ATOM    375  OH  TYR B  26      -3.342  34.674   7.316  1.00 38.61           O  
ATOM    376  N   THR B  27      -4.446  29.087   5.074  1.00 26.05           N  
ATOM    377  CA  THR B  27      -5.370  28.593   6.065  1.00 30.49           C  
ATOM    378  C   THR B  27      -5.098  29.302   7.387  1.00 31.42           C  
ATOM    379  O   THR B  27      -4.199  28.914   8.144  1.00 36.12           O  
ATOM    380  CB  THR B  27      -5.217  27.072   6.245  1.00 33.56           C  
ATOM    381  OG1 THR B  27      -3.833  26.810   6.447  1.00 43.10           O  
ATOM    382  CG2 THR B  27      -5.784  26.299   5.066  1.00 39.46           C  
ATOM    383  N   PRO B  28      -5.878  30.354   7.692  1.00 29.35           N  
ATOM    384  CA  PRO B  28      -5.684  31.238   8.834  1.00 27.56           C  
ATOM    385  C   PRO B  28      -6.154  30.778  10.202  1.00 29.04           C  
ATOM    386  O   PRO B  28      -6.383  31.585  11.106  1.00 30.01           O  
ATOM    387  CB  PRO B  28      -6.345  32.493   8.394  1.00 31.11           C  
ATOM    388  CG  PRO B  28      -7.539  31.963   7.657  1.00 31.57           C  
ATOM    389  CD  PRO B  28      -6.969  30.821   6.851  1.00 28.60           C  
ATOM    390  N   LYS B  29      -6.296  29.462  10.359  1.00 30.38           N  
ATOM    391  CA  LYS B  29      -6.684  28.910  11.628  1.00 33.40           C  
ATOM    392  C   LYS B  29      -5.656  29.169  12.704  1.00 41.17           C  
ATOM    393  O   LYS B  29      -4.425  29.113  12.591  1.00 42.87           O  
ATOM    394  CB  LYS B  29      -6.933  27.405  11.527  1.00 34.52           C  
ATOM    395  CG  LYS B  29      -6.076  26.526  10.634  1.00 32.97           C  
ATOM    396  CD  LYS B  29      -7.110  25.949   9.684  1.00 37.56           C  
ATOM    397  CE  LYS B  29      -6.553  24.896   8.759  1.00 38.42           C  
ATOM    398  NZ  LYS B  29      -7.533  24.573   7.735  1.00 31.37           N  
ATOM    399  N   THR B  30      -6.366  29.545  13.754  1.00 46.75           N  
ATOM    400  CA  THR B  30      -5.824  29.965  15.024  1.00 49.38           C  
ATOM    401  C   THR B  30      -5.042  28.857  15.737  1.00 48.60           C  
ATOM    402  O   THR B  30      -5.649  27.944  16.299  1.00 48.75           O  
ATOM    403  CB  THR B  30      -7.091  30.519  15.739  1.00 40.88           C  
ATOM    404  OG1 THR B  30      -7.498  31.620  14.918  1.00 48.74           O  
ATOM    405  CG2 THR B  30      -6.895  30.981  17.171  1.00 42.26           C  
ATOM    406  OXT THR B  30      -3.813  28.904  15.674  1.00 45.06           O  
TER     407      THR B  30                                                      
ATOM    408  N   GLY C   1      -9.470  29.240 -14.830  1.00 33.77           N  
ATOM    409  CA  GLY C   1      -8.967  29.447 -13.505  1.00 39.60           C  
ATOM    410  C   GLY C   1      -9.213  30.928 -13.243  1.00 43.00           C  
ATOM    411  O   GLY C   1      -9.740  31.649 -14.093  1.00 43.39           O  
HETATM  412  N   IIL C   2      -8.830  31.369 -12.033  1.00 44.74           N  
HETATM  413  CA  IIL C   2      -8.951  32.754 -11.565  1.00 41.02           C  
HETATM  414  C   IIL C   2      -7.835  33.699 -12.035  1.00 37.77           C  
HETATM  415  O   IIL C   2      -7.992  34.919 -12.109  1.00 35.52           O  
HETATM  416  CB  IIL C   2      -9.068  32.682 -10.003  1.00 41.00           C  
HETATM  417  CG2 IIL C   2      -9.286  34.032  -9.331  1.00 36.82           C  
HETATM  418  CG1 IIL C   2      -7.818  32.054  -9.353  1.00 38.84           C  
HETATM  419  CD1 IIL C   2      -7.914  31.778  -7.832  1.00 34.44           C  
ATOM    420  N   VAL C   3      -6.687  33.062 -12.289  1.00 35.62           N  
ATOM    421  CA  VAL C   3      -5.485  33.694 -12.781  1.00 33.51           C  
ATOM    422  C   VAL C   3      -5.865  34.395 -14.086  1.00 36.35           C  
ATOM    423  O   VAL C   3      -5.495  35.553 -14.275  1.00 38.11           O  
ATOM    424  CB  VAL C   3      -4.382  32.601 -12.995  1.00 28.81           C  
ATOM    425  CG1 VAL C   3      -3.013  33.280 -13.093  1.00 31.09           C  
ATOM    426  CG2 VAL C   3      -4.343  31.617 -11.844  1.00 18.97           C  
ATOM    427  N   GLU C   4      -6.645  33.766 -14.984  1.00 38.13           N  
ATOM    428  CA  GLU C   4      -7.053  34.464 -16.196  1.00 38.25           C  
ATOM    429  C   GLU C   4      -8.526  34.858 -16.323  1.00 38.44           C  
ATOM    430  O   GLU C   4      -8.869  35.520 -17.312  1.00 39.19           O  
ATOM    431  CB  GLU C   4      -6.669  33.654 -17.429  1.00 35.77           C  
ATOM    432  CG  GLU C   4      -5.926  34.656 -18.302  1.00 40.94           C  
ATOM    433  CD  GLU C   4      -6.163  34.522 -19.794  1.00 41.69           C  
ATOM    434  OE1 GLU C   4      -7.242  34.896 -20.256  1.00 40.01           O  
ATOM    435  OE2 GLU C   4      -5.259  34.060 -20.491  1.00 45.70           O  
ATOM    436  N   GLN C   5      -9.438  34.493 -15.395  1.00 35.80           N  
ATOM    437  CA  GLN C   5     -10.794  35.021 -15.495  1.00 35.00           C  
ATOM    438  C   GLN C   5     -10.833  36.361 -14.769  1.00 34.11           C  
ATOM    439  O   GLN C   5     -11.599  37.249 -15.149  1.00 33.37           O  
ATOM    440  CB  GLN C   5     -11.870  34.069 -14.877  1.00 34.53           C  
ATOM    441  CG  GLN C   5     -12.160  33.961 -13.358  1.00 39.02           C  
ATOM    442  CD  GLN C   5     -13.649  33.948 -12.961  1.00 35.75           C  
ATOM    443  OE1 GLN C   5     -14.541  34.290 -13.740  1.00 37.28           O  
ATOM    444  NE2 GLN C   5     -13.992  33.584 -11.728  1.00 22.81           N  
ATOM    445  N   CYS C   6      -9.977  36.523 -13.748  1.00 32.41           N  
ATOM    446  CA  CYS C   6      -9.926  37.739 -12.955  1.00 32.34           C  
ATOM    447  C   CYS C   6      -8.774  38.688 -13.282  1.00 32.28           C  
ATOM    448  O   CYS C   6      -8.770  39.822 -12.795  1.00 30.27           O  
ATOM    449  CB  CYS C   6      -9.843  37.410 -11.456  1.00 33.97           C  
ATOM    450  SG  CYS C   6     -11.164  36.408 -10.726  1.00 23.92           S  
ATOM    451  N   CYS C   7      -7.768  38.292 -14.073  1.00 34.68           N  
ATOM    452  CA  CYS C   7      -6.716  39.235 -14.439  1.00 37.14           C  
ATOM    453  C   CYS C   7      -6.927  39.955 -15.764  1.00 34.57           C  
ATOM    454  O   CYS C   7      -6.420  41.063 -15.961  1.00 36.61           O  
ATOM    455  CB  CYS C   7      -5.359  38.535 -14.479  1.00 37.96           C  
ATOM    456  SG  CYS C   7      -4.765  38.221 -12.797  1.00 34.72           S  
ATOM    457  N   THR C   8      -7.704  39.365 -16.674  1.00 35.23           N  
ATOM    458  CA  THR C   8      -7.978  39.985 -17.967  1.00 39.55           C  
ATOM    459  C   THR C   8      -9.000  41.120 -17.772  1.00 41.95           C  
ATOM    460  O   THR C   8      -8.766  42.268 -18.177  1.00 40.26           O  
ATOM    461  CB  THR C   8      -8.544  38.949 -18.956  1.00 40.29           C  
ATOM    462  OG1 THR C   8      -7.951  37.680 -18.720  1.00 36.32           O  
ATOM    463  CG2 THR C   8      -8.277  39.319 -20.416  1.00 42.71           C  
ATOM    464  N   SER C   9     -10.099  40.706 -17.179  1.00 44.35           N  
ATOM    465  CA  SER C   9     -11.188  41.569 -16.683  1.00 41.24           C  
ATOM    466  C   SER C   9     -11.223  41.149 -15.215  1.00 37.42           C  
ATOM    467  O   SER C   9     -10.887  40.035 -14.867  1.00 38.08           O  
ATOM    468  CB  SER C   9     -12.464  41.343 -17.501  1.00 47.94           C  
ATOM    469  OG  SER C   9     -12.516  40.017 -17.987  1.00 45.98           O  
ATOM    470  N   ILE C  10     -11.494  42.003 -14.266  1.00 32.95           N  
ATOM    471  CA  ILE C  10     -11.398  41.538 -12.847  1.00 33.43           C  
ATOM    472  C   ILE C  10     -12.700  40.850 -12.382  1.00 34.54           C  
ATOM    473  O   ILE C  10     -13.714  40.864 -13.088  1.00 39.20           O  
ATOM    474  CB  ILE C  10     -11.120  42.716 -11.941  1.00 30.22           C  
ATOM    475  CG1 ILE C  10     -11.980  43.926 -12.294  1.00 31.58           C  
ATOM    476  CG2 ILE C  10      -9.669  43.187 -12.009  1.00 31.39           C  
ATOM    477  CD1 ILE C  10     -13.311  43.951 -11.541  1.00 23.31           C  
ATOM    478  N   CYS C  11     -12.635  40.269 -11.174  1.00 29.55           N  
ATOM    479  CA  CYS C  11     -13.782  39.544 -10.552  1.00 27.39           C  
ATOM    480  C   CYS C  11     -14.354  40.313  -9.377  1.00 30.06           C  
ATOM    481  O   CYS C  11     -13.623  41.004  -8.653  1.00 31.46           O  
ATOM    482  CB  CYS C  11     -13.332  38.169 -10.057  1.00 26.29           C  
ATOM    483  SG  CYS C  11     -12.846  37.026 -11.441  1.00 27.69           S  
ATOM    484  N   SER C  12     -15.676  40.161  -9.178  1.00 25.37           N  
ATOM    485  CA  SER C  12     -16.377  40.771  -8.044  1.00 24.64           C  
ATOM    486  C   SER C  12     -16.085  40.023  -6.751  1.00 23.83           C  
ATOM    487  O   SER C  12     -15.321  39.060  -6.781  1.00 25.43           O  
ATOM    488  CB  SER C  12     -17.895  40.775  -8.294  1.00 24.95           C  
ATOM    489  OG  SER C  12     -18.502  39.514  -8.557  1.00 27.86           O  
ATOM    490  N   LEU C  13     -16.632  40.422  -5.591  1.00 24.20           N  
ATOM    491  CA  LEU C  13     -16.495  39.643  -4.357  1.00 21.32           C  
ATOM    492  C   LEU C  13     -17.034  38.233  -4.605  1.00 21.06           C  
ATOM    493  O   LEU C  13     -16.452  37.242  -4.177  1.00 13.69           O  
ATOM    494  CB  LEU C  13     -17.302  40.275  -3.223  1.00 26.64           C  
ATOM    495  CG  LEU C  13     -17.438  39.501  -1.906  1.00 28.73           C  
ATOM    496  CD1 LEU C  13     -16.433  40.013  -0.900  1.00 25.68           C  
ATOM    497  CD2 LEU C  13     -18.834  39.671  -1.351  1.00 20.79           C  
ATOM    498  N   TYR C  14     -18.129  38.220  -5.388  1.00 23.81           N  
ATOM    499  CA  TYR C  14     -18.910  37.070  -5.807  1.00 20.97           C  
ATOM    500  C   TYR C  14     -18.217  36.056  -6.702  1.00 21.24           C  
ATOM    501  O   TYR C  14     -18.220  34.875  -6.362  1.00 23.97           O  
ATOM    502  CB  TYR C  14     -20.174  37.619  -6.465  1.00 21.59           C  
ATOM    503  CG  TYR C  14     -20.991  38.440  -5.475  1.00 24.79           C  
ATOM    504  CD1 TYR C  14     -21.372  37.887  -4.252  1.00 27.90           C  
ATOM    505  CD2 TYR C  14     -21.330  39.762  -5.768  1.00 31.32           C  
ATOM    506  CE1 TYR C  14     -22.087  38.644  -3.325  1.00 29.08           C  
ATOM    507  CE2 TYR C  14     -22.045  40.526  -4.841  1.00 30.41           C  
ATOM    508  CZ  TYR C  14     -22.420  39.959  -3.624  1.00 30.28           C  
ATOM    509  OH  TYR C  14     -23.119  40.709  -2.696  1.00 32.63           O  
ATOM    510  N   GLN C  15     -17.637  36.424  -7.848  1.00 20.55           N  
ATOM    511  CA  GLN C  15     -16.842  35.487  -8.639  1.00 23.03           C  
ATOM    512  C   GLN C  15     -15.632  34.956  -7.854  1.00 25.55           C  
ATOM    513  O   GLN C  15     -15.342  33.764  -7.958  1.00 28.90           O  
ATOM    514  CB  GLN C  15     -16.348  36.159  -9.921  1.00 25.34           C  
ATOM    515  CG  GLN C  15     -17.419  36.319 -10.991  1.00 27.45           C  
ATOM    516  CD  GLN C  15     -17.349  37.617 -11.782  1.00 28.96           C  
ATOM    517  OE1 GLN C  15     -16.780  38.604 -11.329  1.00 30.90           O  
ATOM    518  NE2 GLN C  15     -17.946  37.685 -12.969  1.00 22.81           N  
ATOM    519  N   LEU C  16     -14.956  35.796  -7.033  1.00 23.58           N  
ATOM    520  CA  LEU C  16     -13.823  35.423  -6.178  1.00 21.58           C  
ATOM    521  C   LEU C  16     -14.164  34.392  -5.096  1.00 19.57           C  
ATOM    522  O   LEU C  16     -13.350  33.537  -4.765  1.00 17.73           O  
ATOM    523  CB  LEU C  16     -13.240  36.665  -5.468  1.00 17.14           C  
ATOM    524  CG  LEU C  16     -12.511  37.813  -6.191  1.00 20.69           C  
ATOM    525  CD1 LEU C  16     -12.471  39.009  -5.266  1.00 22.05           C  
ATOM    526  CD2 LEU C  16     -11.089  37.444  -6.560  1.00 14.49           C  
ATOM    527  N   GLU C  17     -15.393  34.460  -4.568  1.00 23.67           N  
ATOM    528  CA  GLU C  17     -15.956  33.657  -3.474  1.00 23.13           C  
ATOM    529  C   GLU C  17     -16.015  32.163  -3.743  1.00 26.67           C  
ATOM    530  O   GLU C  17     -16.017  31.338  -2.830  1.00 29.94           O  
ATOM    531  CB  GLU C  17     -17.360  34.186  -3.182  1.00 26.18           C  
ATOM    532  CG  GLU C  17     -18.001  33.769  -1.853  1.00 36.00           C  
ATOM    533  CD  GLU C  17     -19.470  34.158  -1.595  1.00 37.33           C  
ATOM    534  OE1 GLU C  17     -20.149  34.696  -2.482  1.00 36.40           O  
ATOM    535  OE2 GLU C  17     -19.937  33.902  -0.479  1.00 34.14           O  
ATOM    536  N   ASN C  18     -16.067  31.825  -5.033  1.00 31.03           N  
ATOM    537  CA  ASN C  18     -16.084  30.459  -5.531  1.00 27.10           C  
ATOM    538  C   ASN C  18     -14.745  29.772  -5.336  1.00 24.43           C  
ATOM    539  O   ASN C  18     -14.632  28.551  -5.305  1.00 25.53           O  
ATOM    540  CB  ASN C  18     -16.442  30.445  -7.029  1.00 29.98           C  
ATOM    541  CG  ASN C  18     -17.749  31.154  -7.419  1.00 27.62           C  
ATOM    542  OD1 ASN C  18     -18.699  31.232  -6.639  1.00 18.82           O  
ATOM    543  ND2 ASN C  18     -17.830  31.695  -8.639  1.00 21.81           N  
ATOM    544  N   TYR C  19     -13.723  30.603  -5.165  1.00 25.93           N  
ATOM    545  CA  TYR C  19     -12.350  30.176  -4.973  1.00 29.04           C  
ATOM    546  C   TYR C  19     -11.903  30.125  -3.505  1.00 28.33           C  
ATOM    547  O   TYR C  19     -10.704  30.055  -3.187  1.00 26.29           O  
ATOM    548  CB  TYR C  19     -11.478  31.125  -5.789  1.00 36.56           C  
ATOM    549  CG  TYR C  19     -11.855  31.094  -7.263  1.00 41.09           C  
ATOM    550  CD1 TYR C  19     -11.394  30.056  -8.089  1.00 40.84           C  
ATOM    551  CD2 TYR C  19     -12.701  32.081  -7.775  1.00 41.31           C  
ATOM    552  CE1 TYR C  19     -11.780  30.003  -9.431  1.00 43.05           C  
ATOM    553  CE2 TYR C  19     -13.093  32.029  -9.114  1.00 46.97           C  
ATOM    554  CZ  TYR C  19     -12.631  30.994  -9.934  1.00 46.38           C  
ATOM    555  OH  TYR C  19     -13.029  30.947 -11.253  1.00 43.53           O  
ATOM    556  N   CYS C  20     -12.879  30.164  -2.584  1.00 23.79           N  
ATOM    557  CA  CYS C  20     -12.610  30.042  -1.160  1.00 25.51           C  
ATOM    558  C   CYS C  20     -12.874  28.618  -0.705  1.00 21.13           C  
ATOM    559  O   CYS C  20     -13.773  27.981  -1.233  1.00 24.88           O  
ATOM    560  CB  CYS C  20     -13.489  31.027  -0.416  1.00 23.50           C  
ATOM    561  SG  CYS C  20     -13.024  32.729  -0.840  1.00 29.52           S  
ATOM    562  N   ASN C  21     -12.135  28.056   0.251  1.00 24.20           N  
ATOM    563  CA  ASN C  21     -12.312  26.662   0.660  1.00 26.27           C  
ATOM    564  C   ASN C  21     -13.557  26.430   1.528  1.00 22.48           C  
ATOM    565  O   ASN C  21     -14.627  26.412   0.949  1.00 25.33           O  
ATOM    566  CB  ASN C  21     -11.020  26.184   1.391  1.00 27.40           C  
ATOM    567  CG  ASN C  21      -9.699  26.342   0.648  1.00 27.24           C  
ATOM    568  OD1 ASN C  21      -8.650  26.415   1.283  1.00 30.50           O  
ATOM    569  ND2 ASN C  21      -9.660  26.405  -0.678  1.00 27.10           N  
ATOM    570  OXT ASN C  21     -13.502  26.276   2.745  1.00 23.19           O  
TER     571      ASN C  21                                                      
ATOM    572  N   PHE D   1       2.431  41.248 -22.033  1.00 39.99           N  
ATOM    573  CA  PHE D   1       1.164  40.569 -21.827  1.00 39.71           C  
ATOM    574  C   PHE D   1       0.443  41.127 -20.606  1.00 39.17           C  
ATOM    575  O   PHE D   1       0.962  42.054 -19.972  1.00 38.43           O  
ATOM    576  CB  PHE D   1       1.439  39.064 -21.667  1.00 39.05           C  
ATOM    577  CG  PHE D   1       2.170  38.622 -20.399  1.00 40.22           C  
ATOM    578  CD1 PHE D   1       3.481  39.020 -20.146  1.00 41.59           C  
ATOM    579  CD2 PHE D   1       1.509  37.815 -19.470  1.00 38.03           C  
ATOM    580  CE1 PHE D   1       4.122  38.615 -18.972  1.00 39.50           C  
ATOM    581  CE2 PHE D   1       2.155  37.416 -18.302  1.00 32.10           C  
ATOM    582  CZ  PHE D   1       3.462  37.814 -18.048  1.00 31.74           C  
ATOM    583  N   VAL D   2      -0.749  40.589 -20.251  1.00 38.14           N  
ATOM    584  CA  VAL D   2      -1.476  41.011 -19.047  1.00 35.65           C  
ATOM    585  C   VAL D   2      -0.604  40.473 -17.925  1.00 34.35           C  
ATOM    586  O   VAL D   2      -0.672  39.280 -17.629  1.00 37.28           O  
ATOM    587  CB  VAL D   2      -2.900  40.373 -18.897  1.00 36.89           C  
ATOM    588  CG1 VAL D   2      -3.560  41.009 -17.671  1.00 27.40           C  
ATOM    589  CG2 VAL D   2      -3.781  40.591 -20.118  1.00 32.09           C  
ATOM    590  N   ASN D   3       0.241  41.348 -17.349  1.00 29.60           N  
ATOM    591  CA  ASN D   3       1.221  40.950 -16.352  1.00 26.30           C  
ATOM    592  C   ASN D   3       0.592  40.304 -15.133  1.00 26.91           C  
ATOM    593  O   ASN D   3       0.179  40.914 -14.142  1.00 24.13           O  
ATOM    594  CB  ASN D   3       2.043  42.164 -15.954  1.00 24.46           C  
ATOM    595  CG  ASN D   3       3.337  41.806 -15.236  1.00 26.33           C  
ATOM    596  OD1 ASN D   3       3.418  40.843 -14.477  1.00 30.40           O  
ATOM    597  ND2 ASN D   3       4.397  42.583 -15.443  1.00 30.16           N  
ATOM    598  N   GLN D   4       0.601  38.977 -15.295  1.00 26.57           N  
ATOM    599  CA  GLN D   4      -0.011  38.087 -14.345  1.00 32.63           C  
ATOM    600  C   GLN D   4       0.671  38.007 -12.989  1.00 34.95           C  
ATOM    601  O   GLN D   4      -0.063  37.786 -12.014  1.00 38.30           O  
ATOM    602  CB  GLN D   4      -0.122  36.696 -14.977  1.00 33.96           C  
ATOM    603  CG  GLN D   4      -1.326  36.649 -15.933  1.00 38.73           C  
ATOM    604  CD  GLN D   4      -1.700  35.289 -16.517  1.00 40.79           C  
ATOM    605  OE1 GLN D   4      -1.226  34.247 -16.069  1.00 45.96           O  
ATOM    606  NE2 GLN D   4      -2.568  35.240 -17.528  1.00 34.00           N  
ATOM    607  N   HIS D   5       2.006  38.212 -12.853  1.00 29.80           N  
ATOM    608  CA  HIS D   5       2.613  38.182 -11.524  1.00 26.06           C  
ATOM    609  C   HIS D   5       2.089  39.371 -10.710  1.00 23.05           C  
ATOM    610  O   HIS D   5       1.542  39.152  -9.630  1.00 24.07           O  
ATOM    611  CB  HIS D   5       4.163  38.217 -11.632  1.00 18.83           C  
ATOM    612  CG  HIS D   5       4.824  37.348 -10.541  1.00 19.64           C  
ATOM    613  ND1 HIS D   5       4.990  36.021 -10.536  1.00 10.06           N  
ATOM    614  CD2 HIS D   5       5.324  37.828  -9.347  1.00 17.16           C  
ATOM    615  CE1 HIS D   5       5.549  35.707  -9.391  1.00 10.48           C  
ATOM    616  NE2 HIS D   5       5.755  36.787  -8.675  1.00 16.04           N  
ATOM    617  N   LEU D   6       2.141  40.611 -11.229  1.00 23.66           N  
ATOM    618  CA  LEU D   6       1.611  41.813 -10.563  1.00 20.66           C  
ATOM    619  C   LEU D   6       0.094  41.803 -10.414  1.00 21.87           C  
ATOM    620  O   LEU D   6      -0.446  42.442  -9.507  1.00 21.71           O  
ATOM    621  CB  LEU D   6       1.950  43.086 -11.312  1.00 10.14           C  
ATOM    622  CG  LEU D   6       3.398  43.411 -11.603  1.00 13.21           C  
ATOM    623  CD1 LEU D   6       3.434  44.794 -12.242  1.00 10.77           C  
ATOM    624  CD2 LEU D   6       4.239  43.351 -10.342  1.00 10.55           C  
ATOM    625  N   CYS D   7      -0.600  41.082 -11.303  1.00 20.15           N  
ATOM    626  CA  CYS D   7      -2.019  40.877 -11.119  1.00 19.81           C  
ATOM    627  C   CYS D   7      -2.221  39.892  -9.989  1.00 17.78           C  
ATOM    628  O   CYS D   7      -3.124  40.097  -9.183  1.00 19.46           O  
ATOM    629  CB  CYS D   7      -2.664  40.316 -12.365  1.00 25.25           C  
ATOM    630  SG  CYS D   7      -4.449  40.114 -12.139  1.00 31.53           S  
ATOM    631  N   GLY D   8      -1.364  38.862  -9.881  1.00 17.71           N  
ATOM    632  CA  GLY D   8      -1.433  37.811  -8.860  1.00 17.94           C  
ATOM    633  C   GLY D   8      -1.327  38.311  -7.430  1.00 17.06           C  
ATOM    634  O   GLY D   8      -2.050  37.892  -6.526  1.00 15.79           O  
ATOM    635  N   SER D   9      -0.377  39.225  -7.260  1.00 18.48           N  
ATOM    636  CA  SER D   9      -0.166  39.959  -6.021  1.00 19.11           C  
ATOM    637  C   SER D   9      -1.492  40.570  -5.543  1.00 12.55           C  
ATOM    638  O   SER D   9      -1.910  40.348  -4.410  1.00 14.16           O  
ATOM    639  CB  SER D   9       0.900  41.072  -6.269  1.00 17.45           C  
ATOM    640  OG  SER D   9       2.148  40.615  -6.805  1.00 16.27           O  
ATOM    641  N   HIS D  10      -2.202  41.301  -6.404  1.00 10.98           N  
ATOM    642  CA  HIS D  10      -3.472  41.904  -6.022  1.00 12.19           C  
ATOM    643  C   HIS D  10      -4.578  40.884  -5.840  1.00 17.39           C  
ATOM    644  O   HIS D  10      -5.343  41.050  -4.893  1.00 23.32           O  
ATOM    645  CB  HIS D  10      -3.882  42.944  -7.065  1.00  6.94           C  
ATOM    646  CG  HIS D  10      -3.034  44.200  -6.906  1.00  6.72           C  
ATOM    647  ND1 HIS D  10      -3.008  45.025  -5.865  1.00 10.34           N  
ATOM    648  CD2 HIS D  10      -2.124  44.642  -7.818  1.00  5.34           C  
ATOM    649  CE1 HIS D  10      -2.116  45.938  -6.114  1.00  5.68           C  
ATOM    650  NE2 HIS D  10      -1.586  45.704  -7.289  1.00 11.34           N  
ATOM    651  N   LEU D  11      -4.655  39.823  -6.672  1.00 17.50           N  
ATOM    652  CA  LEU D  11      -5.599  38.720  -6.496  1.00 16.04           C  
ATOM    653  C   LEU D  11      -5.550  38.087  -5.101  1.00 14.86           C  
ATOM    654  O   LEU D  11      -6.589  37.998  -4.452  1.00 14.77           O  
ATOM    655  CB  LEU D  11      -5.333  37.619  -7.530  1.00 16.79           C  
ATOM    656  CG  LEU D  11      -5.478  37.904  -9.028  1.00 23.40           C  
ATOM    657  CD1 LEU D  11      -4.932  36.756  -9.843  1.00 19.65           C  
ATOM    658  CD2 LEU D  11      -6.934  38.081  -9.374  1.00 23.52           C  
ATOM    659  N   VAL D  12      -4.379  37.676  -4.584  1.00 13.32           N  
ATOM    660  CA  VAL D  12      -4.242  37.050  -3.262  1.00 12.44           C  
ATOM    661  C   VAL D  12      -4.445  37.966  -2.057  1.00 10.55           C  
ATOM    662  O   VAL D  12      -4.683  37.491  -0.944  1.00  7.73           O  
ATOM    663  CB  VAL D  12      -2.843  36.352  -3.112  1.00 12.08           C  
ATOM    664  CG1 VAL D  12      -2.628  35.443  -4.320  1.00  7.60           C  
ATOM    665  CG2 VAL D  12      -1.719  37.372  -2.941  1.00 19.89           C  
ATOM    666  N   GLU D  13      -4.276  39.280  -2.263  1.00  9.66           N  
ATOM    667  CA  GLU D  13      -4.622  40.260  -1.252  1.00 12.59           C  
ATOM    668  C   GLU D  13      -6.155  40.371  -1.270  1.00 14.30           C  
ATOM    669  O   GLU D  13      -6.775  40.581  -0.232  1.00 17.07           O  
ATOM    670  CB  GLU D  13      -3.981  41.622  -1.567  1.00 12.13           C  
ATOM    671  CG  GLU D  13      -2.486  41.754  -1.225  1.00 15.40           C  
ATOM    672  CD  GLU D  13      -1.902  43.156  -1.424  1.00 22.33           C  
ATOM    673  OE1 GLU D  13      -1.554  43.495  -2.558  1.00 21.16           O  
ATOM    674  OE2 GLU D  13      -1.790  43.907  -0.449  1.00 17.79           O  
ATOM    675  N   ALA D  14      -6.827  40.175  -2.413  1.00 13.11           N  
ATOM    676  CA  ALA D  14      -8.287  40.172  -2.466  1.00 17.02           C  
ATOM    677  C   ALA D  14      -8.896  38.869  -1.907  1.00 15.13           C  
ATOM    678  O   ALA D  14      -9.844  38.926  -1.119  1.00 13.73           O  
ATOM    679  CB  ALA D  14      -8.735  40.380  -3.919  1.00 20.47           C  
ATOM    680  N   LEU D  15      -8.334  37.695  -2.267  1.00 12.65           N  
ATOM    681  CA  LEU D  15      -8.686  36.366  -1.739  1.00  8.74           C  
ATOM    682  C   LEU D  15      -8.531  36.265  -0.218  1.00  9.47           C  
ATOM    683  O   LEU D  15      -9.108  35.383   0.416  1.00  6.34           O  
ATOM    684  CB  LEU D  15      -7.802  35.289  -2.392  1.00 10.42           C  
ATOM    685  CG  LEU D  15      -7.990  34.845  -3.852  1.00 11.26           C  
ATOM    686  CD1 LEU D  15      -6.673  34.737  -4.578  1.00 10.45           C  
ATOM    687  CD2 LEU D  15      -8.629  33.467  -3.866  1.00 18.91           C  
ATOM    688  N   TYR D  16      -7.726  37.149   0.399  1.00 12.80           N  
ATOM    689  CA  TYR D  16      -7.614  37.242   1.850  1.00 15.34           C  
ATOM    690  C   TYR D  16      -8.839  37.929   2.460  1.00 13.82           C  
ATOM    691  O   TYR D  16      -9.389  37.439   3.454  1.00 15.73           O  
ATOM    692  CB  TYR D  16      -6.364  38.039   2.266  1.00 15.79           C  
ATOM    693  CG  TYR D  16      -6.211  38.133   3.787  1.00 19.75           C  
ATOM    694  CD1 TYR D  16      -5.870  36.998   4.524  1.00 15.17           C  
ATOM    695  CD2 TYR D  16      -6.476  39.333   4.453  1.00 16.89           C  
ATOM    696  CE1 TYR D  16      -5.806  37.062   5.913  1.00 12.61           C  
ATOM    697  CE2 TYR D  16      -6.415  39.391   5.846  1.00 12.56           C  
ATOM    698  CZ  TYR D  16      -6.081  38.251   6.561  1.00 11.27           C  
ATOM    699  OH  TYR D  16      -6.030  38.294   7.943  1.00 19.54           O  
ATOM    700  N   LEU D  17      -9.245  39.083   1.900  1.00 13.88           N  
ATOM    701  CA  LEU D  17     -10.387  39.842   2.407  1.00 14.96           C  
ATOM    702  C   LEU D  17     -11.655  39.037   2.200  1.00 16.94           C  
ATOM    703  O   LEU D  17     -12.492  38.964   3.095  1.00 21.19           O  
ATOM    704  CB  LEU D  17     -10.559  41.184   1.687  1.00  7.97           C  
ATOM    705  CG  LEU D  17      -9.493  42.271   1.735  1.00 12.22           C  
ATOM    706  CD1 LEU D  17      -9.800  43.333   0.686  1.00 13.82           C  
ATOM    707  CD2 LEU D  17      -9.445  42.891   3.105  1.00 14.45           C  
ATOM    708  N   VAL D  18     -11.764  38.385   1.034  1.00 15.90           N  
ATOM    709  CA  VAL D  18     -12.931  37.589   0.694  1.00 21.09           C  
ATOM    710  C   VAL D  18     -13.061  36.285   1.456  1.00 17.56           C  
ATOM    711  O   VAL D  18     -14.073  36.129   2.124  1.00 20.52           O  
ATOM    712  CB  VAL D  18     -12.968  37.268  -0.824  1.00 19.15           C  
ATOM    713  CG1 VAL D  18     -14.288  36.551  -1.150  1.00 21.03           C  
ATOM    714  CG2 VAL D  18     -12.926  38.554  -1.653  1.00 12.84           C  
ATOM    715  N   CYS D  19     -12.105  35.355   1.416  1.00 18.78           N  
ATOM    716  CA  CYS D  19     -12.254  34.044   2.047  1.00 23.06           C  
ATOM    717  C   CYS D  19     -12.238  34.034   3.570  1.00 27.08           C  
ATOM    718  O   CYS D  19     -12.694  33.077   4.210  1.00 25.75           O  
ATOM    719  CB  CYS D  19     -11.152  33.096   1.550  1.00 21.87           C  
ATOM    720  SG  CYS D  19     -11.085  32.875  -0.248  1.00 23.47           S  
ATOM    721  N   GLY D  20     -11.685  35.116   4.137  1.00 26.03           N  
ATOM    722  CA  GLY D  20     -11.549  35.310   5.573  1.00 32.39           C  
ATOM    723  C   GLY D  20     -10.884  34.143   6.300  1.00 32.35           C  
ATOM    724  O   GLY D  20      -9.669  33.938   6.250  1.00 32.93           O  
ATOM    725  N   GLU D  21     -11.732  33.384   6.993  1.00 32.74           N  
ATOM    726  CA  GLU D  21     -11.274  32.227   7.730  1.00 34.58           C  
ATOM    727  C   GLU D  21     -11.402  30.977   6.881  1.00 32.93           C  
ATOM    728  O   GLU D  21     -10.626  30.038   7.075  1.00 31.80           O  
ATOM    729  CB  GLU D  21     -12.080  32.047   9.016  1.00 39.23           C  
ATOM    730  CG  GLU D  21     -11.878  33.090  10.134  1.00 40.80           C  
ATOM    731  CD  GLU D  21     -10.586  33.045  10.949  1.00 40.03           C  
ATOM    732  OE1 GLU D  21     -10.127  31.957  11.297  1.00 39.97           O  
ATOM    733  OE2 GLU D  21     -10.051  34.110  11.263  1.00 35.86           O  
ATOM    734  N   ARG D  22     -12.340  30.980   5.916  1.00 30.85           N  
ATOM    735  CA  ARG D  22     -12.583  29.846   5.026  1.00 32.38           C  
ATOM    736  C   ARG D  22     -11.331  29.405   4.274  1.00 33.89           C  
ATOM    737  O   ARG D  22     -11.182  28.241   3.886  1.00 33.33           O  
ATOM    738  CB  ARG D  22     -13.668  30.191   4.004  1.00 31.86           C  
ATOM    739  CG  ARG D  22     -15.076  30.434   4.561  1.00 35.75           C  
ATOM    740  CD  ARG D  22     -16.112  30.798   3.476  1.00 32.07           C  
ATOM    741  NE  ARG D  22     -15.929  32.138   2.924  1.00 24.59           N  
ATOM    742  CZ  ARG D  22     -16.434  32.503   1.744  1.00 17.45           C  
ATOM    743  NH1 ARG D  22     -17.152  31.663   0.996  1.00 20.83           N  
ATOM    744  NH2 ARG D  22     -16.152  33.709   1.265  1.00 13.41           N  
ATOM    745  N   GLY D  23     -10.391  30.338   4.103  1.00 33.90           N  
ATOM    746  CA  GLY D  23      -9.111  30.055   3.471  1.00 34.07           C  
ATOM    747  C   GLY D  23      -9.206  29.812   1.977  1.00 32.92           C  
ATOM    748  O   GLY D  23     -10.294  29.746   1.397  1.00 30.13           O  
ATOM    749  N   PHE D  24      -8.020  29.717   1.370  1.00 30.44           N  
ATOM    750  CA  PHE D  24      -7.916  29.453  -0.049  1.00 26.71           C  
ATOM    751  C   PHE D  24      -6.652  28.690  -0.340  1.00 26.60           C  
ATOM    752  O   PHE D  24      -5.812  28.506   0.527  1.00 26.93           O  
ATOM    753  CB  PHE D  24      -7.939  30.775  -0.875  1.00 25.37           C  
ATOM    754  CG  PHE D  24      -6.807  31.792  -0.742  1.00 20.05           C  
ATOM    755  CD1 PHE D  24      -6.708  32.630   0.380  1.00 25.64           C  
ATOM    756  CD2 PHE D  24      -5.903  31.950  -1.794  1.00 20.51           C  
ATOM    757  CE1 PHE D  24      -5.720  33.621   0.445  1.00 18.23           C  
ATOM    758  CE2 PHE D  24      -4.922  32.941  -1.718  1.00 22.29           C  
ATOM    759  CZ  PHE D  24      -4.828  33.776  -0.604  1.00 13.37           C  
ATOM    760  N   PHE D  25      -6.606  28.198  -1.577  1.00 31.00           N  
ATOM    761  CA  PHE D  25      -5.490  27.479  -2.181  1.00 34.46           C  
ATOM    762  C   PHE D  25      -5.111  28.203  -3.472  1.00 34.45           C  
ATOM    763  O   PHE D  25      -5.965  28.498  -4.315  1.00 32.03           O  
ATOM    764  CB  PHE D  25      -5.865  26.025  -2.550  1.00 39.39           C  
ATOM    765  CG  PHE D  25      -5.443  24.917  -1.583  1.00 44.17           C  
ATOM    766  CD1 PHE D  25      -6.261  24.555  -0.503  1.00 46.78           C  
ATOM    767  CD2 PHE D  25      -4.243  24.227  -1.803  1.00 42.50           C  
ATOM    768  CE1 PHE D  25      -5.877  23.505   0.346  1.00 41.53           C  
ATOM    769  CE2 PHE D  25      -3.874  23.183  -0.950  1.00 41.55           C  
ATOM    770  CZ  PHE D  25      -4.688  22.820   0.124  1.00 37.26           C  
ATOM    771  N   TYR D  26      -3.817  28.481  -3.656  1.00 33.05           N  
ATOM    772  CA  TYR D  26      -3.335  29.187  -4.835  1.00 34.05           C  
ATOM    773  C   TYR D  26      -2.614  28.250  -5.792  1.00 32.52           C  
ATOM    774  O   TYR D  26      -1.773  27.451  -5.388  1.00 33.83           O  
ATOM    775  CB  TYR D  26      -2.407  30.346  -4.388  1.00 33.21           C  
ATOM    776  CG  TYR D  26      -1.944  31.208  -5.546  1.00 24.59           C  
ATOM    777  CD1 TYR D  26      -2.878  31.923  -6.290  1.00 29.63           C  
ATOM    778  CD2 TYR D  26      -0.602  31.225  -5.908  1.00 26.57           C  
ATOM    779  CE1 TYR D  26      -2.471  32.647  -7.409  1.00 33.53           C  
ATOM    780  CE2 TYR D  26      -0.195  31.945  -7.031  1.00 30.77           C  
ATOM    781  CZ  TYR D  26      -1.134  32.648  -7.775  1.00 29.88           C  
ATOM    782  OH  TYR D  26      -0.748  33.333  -8.905  1.00 34.48           O  
ATOM    783  N   THR D  27      -2.996  28.378  -7.076  1.00 36.92           N  
ATOM    784  CA  THR D  27      -2.493  27.589  -8.207  1.00 38.09           C  
ATOM    785  C   THR D  27      -2.202  28.489  -9.424  1.00 40.38           C  
ATOM    786  O   THR D  27      -3.043  29.332  -9.742  1.00 38.68           O  
ATOM    787  CB  THR D  27      -3.538  26.488  -8.618  1.00 37.10           C  
ATOM    788  OG1 THR D  27      -4.708  27.169  -9.051  1.00 37.50           O  
ATOM    789  CG2 THR D  27      -3.901  25.526  -7.486  1.00 34.46           C  
ATOM    790  N   PRO D  28      -1.033  28.447 -10.089  1.00 42.71           N  
ATOM    791  CA  PRO D  28      -0.840  28.919 -11.465  1.00 43.56           C  
ATOM    792  C   PRO D  28      -0.061  28.018 -12.448  1.00 44.63           C  
ATOM    793  O   PRO D  28       0.693  28.519 -13.294  1.00 47.09           O  
ATOM    794  CB  PRO D  28      -0.195  30.265 -11.212  1.00 43.77           C  
ATOM    795  CG  PRO D  28       0.832  29.925 -10.143  1.00 41.02           C  
ATOM    796  CD  PRO D  28       0.231  28.717  -9.403  1.00 44.81           C  
ATOM    797  N   LYS D  29      -0.227  26.689 -12.380  1.00 43.16           N  
ATOM    798  CA  LYS D  29       0.532  25.735 -13.195  1.00 44.23           C  
ATOM    799  C   LYS D  29       0.061  25.415 -14.616  1.00 44.18           C  
ATOM    800  O   LYS D  29      -0.957  25.928 -15.086  1.00 44.06           O  
ATOM    801  N   THR D  30       0.845  24.535 -15.273  1.00 41.37           N  
ATOM    802  CA  THR D  30       0.662  24.063 -16.651  1.00 37.17           C  
ATOM    803  C   THR D  30       1.037  22.564 -16.769  1.00 40.50           C  
ATOM    804  O   THR D  30       2.220  22.219 -16.658  1.00 40.60           O  
ATOM    805  CB  THR D  30       1.553  24.902 -17.627  1.00 35.41           C  
ATOM    806  OG1 THR D  30       1.331  26.282 -17.358  1.00 39.37           O  
ATOM    807  CG2 THR D  30       1.227  24.633 -19.094  1.00 33.63           C  
ATOM    808  OXT THR D  30       0.140  21.735 -16.961  1.00 37.50           O  
TER     809      THR D  30                                                      
HETATM  810 ZN    ZN B 101       0.000  46.602   6.527  0.50 10.00          ZN  
HETATM  811 ZN    ZN D 102       0.000  46.586  -8.857  0.50 18.24          ZN  
HETATM  812  O   HOH     1       9.007  34.995  22.099  1.00 12.98           O  
HETATM  813  O   HOH     2      -4.941  43.193   0.954  1.00 26.89           O  
HETATM  814  O   HOH     3      17.971  39.757  10.116  1.00 18.50           O  
HETATM  815  O   HOH     4       1.884  43.974  10.321  1.00 13.51           O  
HETATM  816  O   HOH     5       4.600  44.864   7.156  1.00 25.16           O  
HETATM  817  O   HOH     6     -13.474  23.487  -2.655  1.00 56.78           O  
HETATM  818  O   HOH     7      12.914  31.448  -2.427  1.00 27.99           O  
HETATM  819  O   HOH     8      16.565  39.430  16.973  1.00 20.13           O  
HETATM  820  O   HOH     9       6.867  24.872 -15.171  1.00 32.83           O  
HETATM  821  O   HOH    10       9.687  20.574   6.893  1.00 35.27           O  
HETATM  822  O   HOH    11     -20.959  41.832  -9.896  1.00 31.05           O  
HETATM  823  O   HOH    12      11.893  26.817   3.947  1.00 20.80           O  
HETATM  824  O   HOH    14      -9.623  27.555  -3.736  1.00 19.98           O  
HETATM  825  O   HOH    15      -7.445  23.755  -4.238  1.00 46.24           O  
HETATM  826  O   HOH    16     -17.467  43.390 -10.411  1.00 20.88           O  
HETATM  827  O   HOH    17       5.365  18.377  -5.763  1.00 32.58           O  
HETATM  828  O   HOH    18       4.436  23.385  14.752  1.00 22.22           O  
HETATM  829  O   HOH    19      -1.796  20.914  -2.901  1.00 14.87           O  
HETATM  830  O   HOH    20     -12.150  30.167 -15.696  1.00 25.94           O  
HETATM  831  O   HOH    21       7.589  23.722  -0.675  1.00 30.04           O  
HETATM  832  O   HOH    22     -10.158  26.138 -16.420  1.00 32.00           O  
HETATM  833  O   HOH    23       2.511  31.539  -4.858  1.00 37.90           O  
HETATM  834  O   HOH    24     -10.167  24.498   5.505  1.00 38.79           O  
HETATM  835  O   HOH    25     -17.398  37.389   0.877  1.00 11.89           O  
HETATM  836  O   HOH    26      13.931  24.304   0.663  1.00 25.38           O  
HETATM  837  O   HOH    27     -15.180  31.518 -15.169  1.00 21.07           O  
HETATM  838  O   HOH    28     -11.917  25.601  -4.159  1.00 52.43           O  
HETATM  839  O   HOH    29       3.391  21.446   0.966  1.00 26.00           O  
HETATM  840  O   HOH    30      -2.876  23.327  -4.814  1.00 35.55           O  
HETATM  841  O   HOH    31      -2.077  36.482  11.978  1.00 49.52           O  
HETATM  842  O   HOH    32      12.188  23.890   5.534  1.00 22.12           O  
HETATM  843  O   HOH    33       8.961  28.457  16.611  1.00 35.21           O  
HETATM  844  O   HOH    34     -11.461  42.498  -7.572  1.00 56.45           O  
HETATM  845  O   HOH    35       2.356  33.988 -14.136  1.00 15.47           O  
HETATM  846  O   HOH    36      -9.177  30.740 -18.527  1.00 20.88           O  
HETATM  847  O   HOH    37     -10.670  34.465 -20.514  1.00 28.47           O  
HETATM  848  O   HOH    38      -2.228  30.217 -15.687  1.00 52.65           O  
HETATM  849  O   HOH    39      -7.151  35.525   8.121  1.00 15.52           O  
HETATM  850  O   HOH    40       6.569  43.175 -13.521  1.00 55.97           O  
HETATM  851  O   HOH    41       8.259  22.204  -7.522  1.00 46.66           O  
HETATM  852  O   HOH    42      12.312  22.090  -2.670  1.00 38.74           O  
HETATM  853  O   HOH    43      -2.662  27.393  21.038  1.00 25.35           O  
HETATM  854  O   HOH    44      -7.046  23.286  -7.766  1.00 40.80           O  
HETATM  855  O   HOH    45      -6.441  38.173  10.771  1.00 30.69           O  
HETATM  856  O   HOH    46      -8.401  41.815  -7.315  1.00 37.04           O  
HETATM  857  O   HOH    47       5.538  40.456  -2.616  1.00 42.70           O  
HETATM  858  O   HOH    48       9.600  30.615 -12.742  1.00 19.39           O  
HETATM  859  O   HOH    49       7.497  33.086  -9.750  1.00 28.63           O  
HETATM  860  O   HOH    50      -5.284  33.615  -7.261  1.00 23.45           O  
HETATM  861  O   HOH    51     -14.589  28.984   8.772  1.00 40.23           O  
HETATM  862  O   HOH    52       9.037  19.925  -9.839  1.00 22.75           O  
HETATM  863  O   HOH    53       9.335  31.771  -6.548  1.00 52.80           O  
HETATM  864  O   HOH    54     -12.444  33.742 -23.365  1.00 56.16           O  
HETATM  865  O   HOH    55       4.819  23.545 -13.298  1.00 33.46           O  
HETATM  866  O   HOH    56       6.466  35.440  20.195  1.00 35.48           O  
HETATM  867  O   HOH    57     -11.596  34.127  -2.853  1.00 22.07           O  
HETATM  868  O   HOH    58       9.309  23.748 -10.625  1.00 54.46           O  
HETATM  869  O   HOH    59      -4.481  28.822  18.918  1.00 54.93           O  
HETATM  870  O   HOH    61      10.256  26.674 -13.598  1.00 30.34           O  
HETATM  871  O   HOH    62      -2.253  25.306  16.872  1.00 24.78           O  
HETATM  872  O   HOH    63      11.610  24.968   2.884  1.00 26.40           O  
HETATM  873  O   HOH    64     -12.472  30.210  14.172  1.00 26.29           O  
HETATM  874  O   HOH    65       3.070  31.673   6.613  1.00 27.23           O  
HETATM  875  O   HOH    66      -4.120  37.659 -17.252  1.00 39.70           O  
HETATM  876  O   HOH    67      15.588  22.101  -3.467  1.00 34.21           O  
HETATM  877  O   HOH    68       4.769  32.139  20.584  1.00 24.04           O  
HETATM  878  O   HOH    69       3.083  21.555 -11.279  1.00 50.97           O  
HETATM  879  O   HOH    70      -8.620  27.758  -8.720  1.00 30.75           O  
HETATM  880  O   HOH    71       2.283  19.394 -15.873  1.00 31.56           O  
CONECT    5    6                                                                
CONECT    6    5    7    9                                                      
CONECT    7    6    8                                                           
CONECT    8    7                                                                
CONECT    9    6   10   11                                                      
CONECT   10    9                                                                
CONECT   11    9   12                                                           
CONECT   12   11                                                                
CONECT   43   76                                                                
CONECT   49  223                                                                
CONECT   76   43                                                                
CONECT  154  313                                                                
CONECT  223   49                                                                
CONECT  313  154                                                                
CONECT  412  413                                                                
CONECT  413  412  414  416                                                      
CONECT  414  413  415                                                           
CONECT  415  414                                                                
CONECT  416  413  417  418                                                      
CONECT  417  416                                                                
CONECT  418  416  419                                                           
CONECT  419  418                                                                
CONECT  450  483                                                                
CONECT  456  630                                                                
CONECT  483  450                                                                
CONECT  561  720                                                                
CONECT  630  456                                                                
CONECT  720  561                                                                
MASTER      300    0    4    6    2    0    0    6  876    4   28   10          
END                                                                             
