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Database: PDB
Entry: 5JM6
LinkDB: 5JM6
Original site: 5JM6 
HEADER    HYDROLASE                               28-APR-16   5JM6              
TITLE     STRUCTURE OF CHAETOMIUM THERMOPHILUM MAPE1                            
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: AMINOPEPTIDASE-LIKE PROTEIN;                               
COMPND   3 CHAIN: A, E, F, B, C, D;                                             
COMPND   4 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: CHAETOMIUM THERMOPHILUM;                        
SOURCE   3 ORGANISM_TAXID: 209285;                                              
SOURCE   4 GENE: CTHT_0065300;                                                  
SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3);                       
SOURCE   6 EXPRESSION_SYSTEM_TAXID: 469008;                                     
SOURCE   7 EXPRESSION_SYSTEM_VARIANT: RIL;                                      
SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PETM33                                    
KEYWDS    AMINOPEPTIDASE, DODECAMER, CVT PATHWAY, SELECTIVE AUTOPHAGY,          
KEYWDS   2 HYDROLASE                                                            
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    C.BERTIPAGLIA,A.J.JAKOBI,M.WILMANNS,C.SACHSE                          
REVDAT   3   13-JUL-16 5JM6    1       JRNL                                     
REVDAT   2   22-JUN-16 5JM6    1       JRNL                                     
REVDAT   1   15-JUN-16 5JM6    0                                                
JRNL        AUTH   C.BERTIPAGLIA,S.SCHNEIDER,A.J.JAKOBI,A.K.TARAFDER,Y.S.BYKOV, 
JRNL        AUTH 2 A.PICCO,W.KUKULSKI,J.KOSINSKI,W.J.HAGEN,A.C.RAVICHANDRAN,    
JRNL        AUTH 3 M.WILMANNS,M.KAKSONEN,J.A.BRIGGS,C.SACHSE                    
JRNL        TITL   HIGHER-ORDER ASSEMBLIES OF OLIGOMERIC CARGO RECEPTOR         
JRNL        TITL 2 COMPLEXES FORM THE MEMBRANE SCAFFOLD OF THE CVT VESICLE.     
JRNL        REF    EMBO REP.                     V.  17  1044 2016              
JRNL        REFN                   ESSN 1469-3178                               
JRNL        PMID   27266708                                                     
JRNL        DOI    10.15252/EMBR.201541960                                      
REMARK   2                                                                      
REMARK   2 RESOLUTION.    2.76 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : PHENIX (DEV_2313: ???)                               
REMARK   3   AUTHORS     : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN            
REMARK   3               : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE,           
REMARK   3               : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER,            
REMARK   3               : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY,              
REMARK   3               : REETAL PAI,RANDY READ,JANE RICHARDSON,               
REMARK   3               : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI,           
REMARK   3               : NICHOLAS SAUTER,JACOB SMITH,LAURENT                  
REMARK   3               : STORONI,TOM TERWILLIGER,PETER ZWART                  
REMARK   3                                                                      
REMARK   3    REFINEMENT TARGET : NULL                                          
REMARK   3                                                                      
REMARK   3  DATA USED IN REFINEMENT.                                            
REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) : 2.76                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 49.07                          
REMARK   3   MIN(FOBS/SIGMA_FOBS)              : 0.060                          
REMARK   3   COMPLETENESS FOR RANGE        (%) : 98.9                           
REMARK   3   NUMBER OF REFLECTIONS             : 172988                         
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   R VALUE     (WORKING + TEST SET) : 0.209                           
REMARK   3   R VALUE            (WORKING SET) : 0.208                           
REMARK   3   FREE R VALUE                     : 0.242                           
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : 5.010                           
REMARK   3   FREE R VALUE TEST SET COUNT      : 8670                            
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT (IN BINS).                           
REMARK   3   BIN  RESOLUTION RANGE  COMPL.    NWORK NFREE   RWORK  RFREE        
REMARK   3     1 49.0807 -  8.5564    0.96     5319   258  0.2009 0.2045        
REMARK   3     2  8.5564 -  6.7972    0.97     5362   323  0.1854 0.2256        
REMARK   3     3  6.7972 -  5.9397    0.98     5445   269  0.2038 0.2432        
REMARK   3     4  5.9397 -  5.3973    0.98     5414   287  0.1875 0.2361        
REMARK   3     5  5.3973 -  5.0109    0.99     5429   343  0.1911 0.2155        
REMARK   3     6  5.0109 -  4.7157    0.99     5480   297  0.1503 0.1899        
REMARK   3     7  4.7157 -  4.4797    0.99     5501   285  0.1513 0.1768        
REMARK   3     8  4.4797 -  4.2848    0.99     5491   319  0.1513 0.1901        
REMARK   3     9  4.2848 -  4.1199    0.99     5517   240  0.1617 0.2140        
REMARK   3    10  4.1199 -  3.9778    0.99     5471   325  0.1728 0.1951        
REMARK   3    11  3.9778 -  3.8535    0.99     5499   295  0.1701 0.1895        
REMARK   3    12  3.8535 -  3.7434    0.99     5500   290  0.1784 0.2183        
REMARK   3    13  3.7434 -  3.6449    0.99     5484   319  0.1913 0.2279        
REMARK   3    14  3.6449 -  3.5560    1.00     5532   268  0.2014 0.2148        
REMARK   3    15  3.5560 -  3.4752    0.99     5512   274  0.2039 0.2380        
REMARK   3    16  3.4752 -  3.4012    0.99     5509   276  0.2059 0.2459        
REMARK   3    17  3.4012 -  3.3332    1.00     5559   285  0.2215 0.2273        
REMARK   3    18  3.3332 -  3.2703    1.00     5478   300  0.2240 0.2898        
REMARK   3    19  3.2703 -  3.2119    0.99     5551   281  0.2496 0.2936        
REMARK   3    20  3.2119 -  3.1575    1.00     5531   286  0.2679 0.3134        
REMARK   3    21  3.1575 -  3.1066    1.00     5551   277  0.2796 0.3497        
REMARK   3    22  3.1066 -  3.0588    1.00     5487   260  0.2941 0.3149        
REMARK   3    23  3.0588 -  3.0138    1.00     5515   298  0.2898 0.3454        
REMARK   3    24  3.0138 -  2.9714    0.99     5534   274  0.2943 0.3725        
REMARK   3    25  2.9714 -  2.9312    0.99     5485   311  0.3024 0.3399        
REMARK   3    26  2.9312 -  2.8931    1.00     5470   314  0.2874 0.3184        
REMARK   3    27  2.8931 -  2.8570    1.00     5567   275  0.2909 0.3514        
REMARK   3    28  2.8570 -  2.8226    1.00     5538   272  0.3097 0.3540        
REMARK   3    29  2.8226 -  2.7898    0.99     5480   299  0.3092 0.3593        
REMARK   3    30  2.7898 -  2.7584    0.92     5107   270  0.3261 0.3694        
REMARK   3                                                                      
REMARK   3  BULK SOLVENT MODELLING.                                             
REMARK   3   METHOD USED        : NULL                                          
REMARK   3   SOLVENT RADIUS     : 1.11                                          
REMARK   3   SHRINKAGE RADIUS   : 0.90                                          
REMARK   3   K_SOL              : NULL                                          
REMARK   3   B_SOL              : NULL                                          
REMARK   3                                                                      
REMARK   3  ERROR ESTIMATES.                                                    
REMARK   3   COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED)     : 0.360            
REMARK   3   PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 25.990           
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : 29.00                          
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  TWINNING INFORMATION.                                               
REMARK   3   FRACTION: NULL                                                     
REMARK   3   OPERATOR: NULL                                                     
REMARK   3                                                                      
REMARK   3  DEVIATIONS FROM IDEAL VALUES.                                       
REMARK   3                 RMSD          COUNT                                  
REMARK   3   BOND      :  0.014          20934                                  
REMARK   3   ANGLE     :  1.908          28416                                  
REMARK   3   CHIRALITY :  0.078           3204                                  
REMARK   3   PLANARITY :  0.010           3636                                  
REMARK   3   DIHEDRAL  : 14.532          12378                                  
REMARK   3                                                                      
REMARK   3  TLS DETAILS                                                         
REMARK   3   NUMBER OF TLS GROUPS  : NULL                                       
REMARK   3                                                                      
REMARK   3  NCS DETAILS                                                         
REMARK   3   NUMBER OF NCS GROUPS : NULL                                        
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 5JM6 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 29-APR-16.                  
REMARK 100 THE DEPOSITION ID IS D_1000220846.                                   
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 17-JUN-13                          
REMARK 200  TEMPERATURE           (KELVIN) : 100                                
REMARK 200  PH                             : 6.6                                
REMARK 200  NUMBER OF CRYSTALS USED        : 1                                  
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : Y                                  
REMARK 200  RADIATION SOURCE               : ESRF                               
REMARK 200  BEAMLINE                       : ID23-2                             
REMARK 200  X-RAY GENERATOR MODEL          : NULL                               
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 0.87260                            
REMARK 200  MONOCHROMATOR                  : SI(111)                            
REMARK 200  OPTICS                         : NULL                               
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : CCD                                
REMARK 200  DETECTOR MANUFACTURER          : MARMOSAIC 225 MM CCD               
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : XDS                                
REMARK 200  DATA SCALING SOFTWARE          : SCALA                              
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 172990                             
REMARK 200  RESOLUTION RANGE HIGH      (A) : 2.750                              
REMARK 200  RESOLUTION RANGE LOW       (A) : 58.700                             
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : NULL                               
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : 98.7                               
REMARK 200  DATA REDUNDANCY                : 3.100                              
REMARK 200  R MERGE                    (I) : 0.13000                            
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : 0.9800                             
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.75                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : 2.80                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : 93.5                               
REMARK 200  DATA REDUNDANCY IN SHELL       : 3.00                               
REMARK 200  R MERGE FOR SHELL          (I) : 0.77000                            
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR SHELL         : 1.300                              
REMARK 200                                                                      
REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH                              
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT        
REMARK 200 SOFTWARE USED: PHASER                                                
REMARK 200 STARTING MODEL: 3VAT                                                 
REMARK 200                                                                      
REMARK 200 REMARK: BIPYRAMIDAL                                                  
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 57.52                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.90                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: PROTEIN BUFFER: 2.0-3.0 MG/ML IN 50 MM   
REMARK 280  TRIS-HCL PH 7.5, 50 MM NACL; RESERVOIR BUFFER: 100 MM HEPES, PH     
REMARK 280  6.6, 4 M SODIUM FORMATE, VAPOR DIFFUSION, HANGING DROP,             
REMARK 280  TEMPERATURE 277K                                                    
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 2 21 21                        
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290       2555   X,-Y,-Z                                                 
REMARK 290       3555   -X,Y+1/2,-Z+1/2                                         
REMARK 290       4555   -X,-Y+1/2,Z+1/2                                         
REMARK 290                                                                      
REMARK 290     WHERE NNN -> OPERATOR NUMBER                                     
REMARK 290           MMM -> TRANSLATION VECTOR                                  
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS                            
REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM             
REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY                
REMARK 290 RELATED MOLECULES.                                                   
REMARK 290   SMTRY1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 290   SMTRY1   2  1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   2  0.000000 -1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   2  0.000000  0.000000 -1.000000        0.00000            
REMARK 290   SMTRY1   3 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   3  0.000000  1.000000  0.000000       71.94700            
REMARK 290   SMTRY3   3  0.000000  0.000000 -1.000000      100.65750            
REMARK 290   SMTRY1   4 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   4  0.000000 -1.000000  0.000000       71.94700            
REMARK 290   SMTRY3   4  0.000000  0.000000  1.000000      100.65750            
REMARK 290                                                                      
REMARK 290 REMARK: NULL                                                         
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1                                                       
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM                
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN                  
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON               
REMARK 300 BURIED SURFACE AREA.                                                 
REMARK 350                                                                      
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN           
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE                
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS          
REMARK 350 GIVEN BELOW.  BOTH NON-CRYSTALLOGRAPHIC AND                          
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.                               
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 1                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DODECAMERIC                       
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DODECAMERIC                
REMARK 350 SOFTWARE USED: PISA                                                  
REMARK 350 TOTAL BURIED SURFACE AREA: 77300 ANGSTROM**2                         
REMARK 350 SURFACE AREA OF THE COMPLEX: 162550 ANGSTROM**2                      
REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -1277.0 KCAL/MOL                      
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, E, F, 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  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   2  0.000000 -1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   2  0.000000  0.000000 -1.000000        0.00000            
REMARK 465                                                                      
REMARK 465 MISSING RESIDUES                                                     
REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE                       
REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.)                
REMARK 465                                                                      
REMARK 465   M RES C SSSEQI                                                     
REMARK 465     MET A     1                                                      
REMARK 465     THR A     2                                                      
REMARK 465     ARG A     3                                                      
REMARK 465     LEU A     4                                                      
REMARK 465     THR A     5                                                      
REMARK 465     PRO A     6                                                      
REMARK 465     ASP A     7                                                      
REMARK 465     VAL A     8                                                      
REMARK 465     LEU A     9                                                      
REMARK 465     ARG A    10                                                      
REMARK 465     MET A    11                                                      
REMARK 465     ARG A    12                                                      
REMARK 465     SER A    13                                                      
REMARK 465     SER A    14                                                      
REMARK 465     GLN A    15                                                      
REMARK 465     LEU A    16                                                      
REMARK 465     SER A    17                                                      
REMARK 465     LEU A    18                                                      
REMARK 465     ARG A    19                                                      
REMARK 465     SER A    20                                                      
REMARK 465     LEU A    21                                                      
REMARK 465     ALA A    22                                                      
REMARK 465     MET A    23                                                      
REMARK 465     GLU A    24                                                      
REMARK 465     GLN A    25                                                      
REMARK 465     PRO A    26                                                      
REMARK 465     GLN A    27                                                      
REMARK 465     GLN A    28                                                      
REMARK 465     ARG A    29                                                      
REMARK 465     THR A    30                                                      
REMARK 465     ALA A    31                                                      
REMARK 465     ALA A    32                                                      
REMARK 465     PRO A    33                                                      
REMARK 465     PRO A    34                                                      
REMARK 465     THR A    35                                                      
REMARK 465     ILE A    36                                                      
REMARK 465     ASP A    37                                                      
REMARK 465     GLU A    38                                                      
REMARK 465     ALA A    39                                                      
REMARK 465     PRO A    40                                                      
REMARK 465     THR A    41                                                      
REMARK 465     VAL A    42                                                      
REMARK 465     PRO A    43                                                      
REMARK 465     LEU A    44                                                      
REMARK 465     GLU A    45                                                      
REMARK 465     ALA A    46                                                      
REMARK 465     LYS A    47                                                      
REMARK 465     ASP A    48                                                      
REMARK 465     LEU A    49                                                      
REMARK 465     LEU A   237                                                      
REMARK 465     GLY A   238                                                      
REMARK 465     GLU A   239                                                      
REMARK 465     LYS A   240                                                      
REMARK 465     ALA A   241                                                      
REMARK 465     GLU A   242                                                      
REMARK 465     SER A   243                                                      
REMARK 465     GLU A   244                                                      
REMARK 465     LYS A   245                                                      
REMARK 465     ALA A   422                                                      
REMARK 465     SER A   423                                                      
REMARK 465     ALA A   424                                                      
REMARK 465     HIS A   425                                                      
REMARK 465     MET A   426                                                      
REMARK 465     ARG A   453                                                      
REMARK 465     ASN A   454                                                      
REMARK 465     ASP A   455                                                      
REMARK 465     SER A   456                                                      
REMARK 465     ARG A   457                                                      
REMARK 465     SER A   458                                                      
REMARK 465     GLY A   459                                                      
REMARK 465     GLY A   460                                                      
REMARK 465     THR A   461                                                      
REMARK 465     VAL A   462                                                      
REMARK 465     HIS A   519                                                      
REMARK 465     MET E     1                                                      
REMARK 465     THR E     2                                                      
REMARK 465     ARG E     3                                                      
REMARK 465     LEU E     4                                                      
REMARK 465     THR E     5                                                      
REMARK 465     PRO E     6                                                      
REMARK 465     ASP E     7                                                      
REMARK 465     VAL E     8                                                      
REMARK 465     LEU E     9                                                      
REMARK 465     ARG E    10                                                      
REMARK 465     MET E    11                                                      
REMARK 465     ARG E    12                                                      
REMARK 465     SER E    13                                                      
REMARK 465     SER E    14                                                      
REMARK 465     GLN E    15                                                      
REMARK 465     LEU E    16                                                      
REMARK 465     SER E    17                                                      
REMARK 465     LEU E    18                                                      
REMARK 465     ARG E    19                                                      
REMARK 465     SER E    20                                                      
REMARK 465     LEU E    21                                                      
REMARK 465     ALA E    22                                                      
REMARK 465     MET E    23                                                      
REMARK 465     GLU E    24                                                      
REMARK 465     GLN E    25                                                      
REMARK 465     PRO E    26                                                      
REMARK 465     GLN E    27                                                      
REMARK 465     GLN E    28                                                      
REMARK 465     ARG E    29                                                      
REMARK 465     THR E    30                                                      
REMARK 465     ALA E    31                                                      
REMARK 465     ALA E    32                                                      
REMARK 465     PRO E    33                                                      
REMARK 465     PRO E    34                                                      
REMARK 465     THR E    35                                                      
REMARK 465     ILE E    36                                                      
REMARK 465     ASP E    37                                                      
REMARK 465     GLU E    38                                                      
REMARK 465     ALA E    39                                                      
REMARK 465     PRO E    40                                                      
REMARK 465     THR E    41                                                      
REMARK 465     VAL E    42                                                      
REMARK 465     PRO E    43                                                      
REMARK 465     LEU E    44                                                      
REMARK 465     GLU E    45                                                      
REMARK 465     ALA E    46                                                      
REMARK 465     LYS E    47                                                      
REMARK 465     ASP E    48                                                      
REMARK 465     LEU E    49                                                      
REMARK 465     LEU E   237                                                      
REMARK 465     GLY E   238                                                      
REMARK 465     GLU E   239                                                      
REMARK 465     LYS E   240                                                      
REMARK 465     ALA E   241                                                      
REMARK 465     GLU E   242                                                      
REMARK 465     SER E   243                                                      
REMARK 465     GLU E   244                                                      
REMARK 465     LYS E   245                                                      
REMARK 465     ALA E   422                                                      
REMARK 465     SER E   423                                                      
REMARK 465     ALA E   424                                                      
REMARK 465     HIS E   425                                                      
REMARK 465     MET E   426                                                      
REMARK 465     ARG E   453                                                      
REMARK 465     ASN E   454                                                      
REMARK 465     ASP E   455                                                      
REMARK 465     SER E   456                                                      
REMARK 465     ARG E   457                                                      
REMARK 465     SER E   458                                                      
REMARK 465     GLY E   459                                                      
REMARK 465     GLY E   460                                                      
REMARK 465     THR E   461                                                      
REMARK 465     VAL E   462                                                      
REMARK 465     HIS E   519                                                      
REMARK 465     MET F     1                                                      
REMARK 465     THR F     2                                                      
REMARK 465     ARG F     3                                                      
REMARK 465     LEU F     4                                                      
REMARK 465     THR F     5                                                      
REMARK 465     PRO F     6                                                      
REMARK 465     ASP F     7                                                      
REMARK 465     VAL F     8                                                      
REMARK 465     LEU F     9                                                      
REMARK 465     ARG F    10                                                      
REMARK 465     MET F    11                                                      
REMARK 465     ARG F    12                                                      
REMARK 465     SER F    13                                                      
REMARK 465     SER F    14                                                      
REMARK 465     GLN F    15                                                      
REMARK 465     LEU F    16                                                      
REMARK 465     SER F    17                                                      
REMARK 465     LEU F    18                                                      
REMARK 465     ARG F    19                                                      
REMARK 465     SER F    20                                                      
REMARK 465     LEU F    21                                                      
REMARK 465     ALA F    22                                                      
REMARK 465     MET F    23                                                      
REMARK 465     GLU F    24                                                      
REMARK 465     GLN F    25                                                      
REMARK 465     PRO F    26                                                      
REMARK 465     GLN F    27                                                      
REMARK 465     GLN F    28                                                      
REMARK 465     ARG F    29                                                      
REMARK 465     THR F    30                                                      
REMARK 465     ALA F    31                                                      
REMARK 465     ALA F    32                                                      
REMARK 465     PRO F    33                                                      
REMARK 465     PRO F    34                                                      
REMARK 465     THR F    35                                                      
REMARK 465     ILE F    36                                                      
REMARK 465     ASP F    37                                                      
REMARK 465     GLU F    38                                                      
REMARK 465     ALA F    39                                                      
REMARK 465     PRO F    40                                                      
REMARK 465     THR F    41                                                      
REMARK 465     VAL F    42                                                      
REMARK 465     PRO F    43                                                      
REMARK 465     LEU F    44                                                      
REMARK 465     GLU F    45                                                      
REMARK 465     ALA F    46                                                      
REMARK 465     LYS F    47                                                      
REMARK 465     ASP F    48                                                      
REMARK 465     LEU F    49                                                      
REMARK 465     LEU F   237                                                      
REMARK 465     GLY F   238                                                      
REMARK 465     GLU F   239                                                      
REMARK 465     LYS F   240                                                      
REMARK 465     ALA F   241                                                      
REMARK 465     GLU F   242                                                      
REMARK 465     SER F   243                                                      
REMARK 465     GLU F   244                                                      
REMARK 465     LYS F   245                                                      
REMARK 465     ALA F   422                                                      
REMARK 465     SER F   423                                                      
REMARK 465     ALA F   424                                                      
REMARK 465     HIS F   425                                                      
REMARK 465     MET F   426                                                      
REMARK 465     ARG F   453                                                      
REMARK 465     ASN F   454                                                      
REMARK 465     ASP F   455                                                      
REMARK 465     SER F   456                                                      
REMARK 465     ARG F   457                                                      
REMARK 465     SER F   458                                                      
REMARK 465     GLY F   459                                                      
REMARK 465     GLY F   460                                                      
REMARK 465     THR F   461                                                      
REMARK 465     VAL F   462                                                      
REMARK 465     HIS F   519                                                      
REMARK 465     MET B     1                                                      
REMARK 465     THR B     2                                                      
REMARK 465     ARG B     3                                                      
REMARK 465     LEU B     4                                                      
REMARK 465     THR B     5                                                      
REMARK 465     PRO B     6                                                      
REMARK 465     ASP B     7                                                      
REMARK 465     VAL B     8                                                      
REMARK 465     LEU B     9                                                      
REMARK 465     ARG B    10                                                      
REMARK 465     MET B    11                                                      
REMARK 465     ARG B    12                                                      
REMARK 465     SER B    13                                                      
REMARK 465     SER B    14                                                      
REMARK 465     GLN B    15                                                      
REMARK 465     LEU B    16                                                      
REMARK 465     SER B    17                                                      
REMARK 465     LEU B    18                                                      
REMARK 465     ARG B    19                                                      
REMARK 465     SER B    20                                                      
REMARK 465     LEU B    21                                                      
REMARK 465     ALA B    22                                                      
REMARK 465     MET B    23                                                      
REMARK 465     GLU B    24                                                      
REMARK 465     GLN B    25                                                      
REMARK 465     PRO B    26                                                      
REMARK 465     GLN B    27                                                      
REMARK 465     GLN B    28                                                      
REMARK 465     ARG B    29                                                      
REMARK 465     THR B    30                                                      
REMARK 465     ALA B    31                                                      
REMARK 465     ALA B    32                                                      
REMARK 465     PRO B    33                                                      
REMARK 465     PRO B    34                                                      
REMARK 465     THR B    35                                                      
REMARK 465     ILE B    36                                                      
REMARK 465     ASP B    37                                                      
REMARK 465     GLU B    38                                                      
REMARK 465     ALA B    39                                                      
REMARK 465     PRO B    40                                                      
REMARK 465     THR B    41                                                      
REMARK 465     VAL B    42                                                      
REMARK 465     PRO B    43                                                      
REMARK 465     LEU B    44                                                      
REMARK 465     GLU B    45                                                      
REMARK 465     ALA B    46                                                      
REMARK 465     LYS B    47                                                      
REMARK 465     ASP B    48                                                      
REMARK 465     LEU B    49                                                      
REMARK 465     LEU B   237                                                      
REMARK 465     GLY B   238                                                      
REMARK 465     GLU B   239                                                      
REMARK 465     LYS B   240                                                      
REMARK 465     ALA B   241                                                      
REMARK 465     GLU B   242                                                      
REMARK 465     SER B   243                                                      
REMARK 465     GLU B   244                                                      
REMARK 465     LYS B   245                                                      
REMARK 465     ALA B   422                                                      
REMARK 465     SER B   423                                                      
REMARK 465     ALA B   424                                                      
REMARK 465     HIS B   425                                                      
REMARK 465     MET B   426                                                      
REMARK 465     ARG B   453                                                      
REMARK 465     ASN B   454                                                      
REMARK 465     ASP B   455                                                      
REMARK 465     SER B   456                                                      
REMARK 465     ARG B   457                                                      
REMARK 465     SER B   458                                                      
REMARK 465     GLY B   459                                                      
REMARK 465     GLY B   460                                                      
REMARK 465     THR B   461                                                      
REMARK 465     VAL B   462                                                      
REMARK 465     HIS B   519                                                      
REMARK 465     MET C     1                                                      
REMARK 465     THR C     2                                                      
REMARK 465     ARG C     3                                                      
REMARK 465     LEU C     4                                                      
REMARK 465     THR C     5                                                      
REMARK 465     PRO C     6                                                      
REMARK 465     ASP C     7                                                      
REMARK 465     VAL C     8                                                      
REMARK 465     LEU C     9                                                      
REMARK 465     ARG C    10                                                      
REMARK 465     MET C    11                                                      
REMARK 465     ARG C    12                                                      
REMARK 465     SER C    13                                                      
REMARK 465     SER C    14                                                      
REMARK 465     GLN C    15                                                      
REMARK 465     LEU C    16                                                      
REMARK 465     SER C    17                                                      
REMARK 465     LEU C    18                                                      
REMARK 465     ARG C    19                                                      
REMARK 465     SER C    20                                                      
REMARK 465     LEU C    21                                                      
REMARK 465     ALA C    22                                                      
REMARK 465     MET C    23                                                      
REMARK 465     GLU C    24                                                      
REMARK 465     GLN C    25                                                      
REMARK 465     PRO C    26                                                      
REMARK 465     GLN C    27                                                      
REMARK 465     GLN C    28                                                      
REMARK 465     ARG C    29                                                      
REMARK 465     THR C    30                                                      
REMARK 465     ALA C    31                                                      
REMARK 465     ALA C    32                                                      
REMARK 465     PRO C    33                                                      
REMARK 465     PRO C    34                                                      
REMARK 465     THR C    35                                                      
REMARK 465     ILE C    36                                                      
REMARK 465     ASP C    37                                                      
REMARK 465     GLU C    38                                                      
REMARK 465     ALA C    39                                                      
REMARK 465     PRO C    40                                                      
REMARK 465     THR C    41                                                      
REMARK 465     VAL C    42                                                      
REMARK 465     PRO C    43                                                      
REMARK 465     LEU C    44                                                      
REMARK 465     GLU C    45                                                      
REMARK 465     ALA C    46                                                      
REMARK 465     LYS C    47                                                      
REMARK 465     ASP C    48                                                      
REMARK 465     LEU C    49                                                      
REMARK 465     LEU C   237                                                      
REMARK 465     GLY C   238                                                      
REMARK 465     GLU C   239                                                      
REMARK 465     LYS C   240                                                      
REMARK 465     ALA C   241                                                      
REMARK 465     GLU C   242                                                      
REMARK 465     SER C   243                                                      
REMARK 465     GLU C   244                                                      
REMARK 465     LYS C   245                                                      
REMARK 465     ALA C   422                                                      
REMARK 465     SER C   423                                                      
REMARK 465     ALA C   424                                                      
REMARK 465     HIS C   425                                                      
REMARK 465     MET C   426                                                      
REMARK 465     ARG C   453                                                      
REMARK 465     ASN C   454                                                      
REMARK 465     ASP C   455                                                      
REMARK 465     SER C   456                                                      
REMARK 465     ARG C   457                                                      
REMARK 465     SER C   458                                                      
REMARK 465     GLY C   459                                                      
REMARK 465     GLY C   460                                                      
REMARK 465     THR C   461                                                      
REMARK 465     VAL C   462                                                      
REMARK 465     HIS C   519                                                      
REMARK 465     MET D     1                                                      
REMARK 465     THR D     2                                                      
REMARK 465     ARG D     3                                                      
REMARK 465     LEU D     4                                                      
REMARK 465     THR D     5                                                      
REMARK 465     PRO D     6                                                      
REMARK 465     ASP D     7                                                      
REMARK 465     VAL D     8                                                      
REMARK 465     LEU D     9                                                      
REMARK 465     ARG D    10                                                      
REMARK 465     MET D    11                                                      
REMARK 465     ARG D    12                                                      
REMARK 465     SER D    13                                                      
REMARK 465     SER D    14                                                      
REMARK 465     GLN D    15                                                      
REMARK 465     LEU D    16                                                      
REMARK 465     SER D    17                                                      
REMARK 465     LEU D    18                                                      
REMARK 465     ARG D    19                                                      
REMARK 465     SER D    20                                                      
REMARK 465     LEU D    21                                                      
REMARK 465     ALA D    22                                                      
REMARK 465     MET D    23                                                      
REMARK 465     GLU D    24                                                      
REMARK 465     GLN D    25                                                      
REMARK 465     PRO D    26                                                      
REMARK 465     GLN D    27                                                      
REMARK 465     GLN D    28                                                      
REMARK 465     ARG D    29                                                      
REMARK 465     THR D    30                                                      
REMARK 465     ALA D    31                                                      
REMARK 465     ALA D    32                                                      
REMARK 465     PRO D    33                                                      
REMARK 465     PRO D    34                                                      
REMARK 465     THR D    35                                                      
REMARK 465     ILE D    36                                                      
REMARK 465     ASP D    37                                                      
REMARK 465     GLU D    38                                                      
REMARK 465     ALA D    39                                                      
REMARK 465     PRO D    40                                                      
REMARK 465     THR D    41                                                      
REMARK 465     VAL D    42                                                      
REMARK 465     PRO D    43                                                      
REMARK 465     LEU D    44                                                      
REMARK 465     GLU D    45                                                      
REMARK 465     ALA D    46                                                      
REMARK 465     LYS D    47                                                      
REMARK 465     ASP D    48                                                      
REMARK 465     LEU D    49                                                      
REMARK 465     LEU D   237                                                      
REMARK 465     GLY D   238                                                      
REMARK 465     GLU D   239                                                      
REMARK 465     LYS D   240                                                      
REMARK 465     ALA D   241                                                      
REMARK 465     GLU D   242                                                      
REMARK 465     SER D   243                                                      
REMARK 465     GLU D   244                                                      
REMARK 465     LYS D   245                                                      
REMARK 465     ALA D   422                                                      
REMARK 465     SER D   423                                                      
REMARK 465     ALA D   424                                                      
REMARK 465     HIS D   425                                                      
REMARK 465     MET D   426                                                      
REMARK 465     ARG D   453                                                      
REMARK 465     ASN D   454                                                      
REMARK 465     ASP D   455                                                      
REMARK 465     SER D   456                                                      
REMARK 465     ARG D   457                                                      
REMARK 465     SER D   458                                                      
REMARK 465     GLY D   459                                                      
REMARK 465     GLY D   460                                                      
REMARK 465     THR D   461                                                      
REMARK 465     VAL D   462                                                      
REMARK 465     HIS D   519                                                      
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT                     
REMARK 500                                                                      
REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT.                            
REMARK 500                                                                      
REMARK 500  ATM1  RES C  SSEQI   ATM2  RES C  SSEQI           DISTANCE          
REMARK 500   OE2  GLU E   339     OG   SER E   343              1.93            
REMARK 500   O    PRO E   205     O    HOH E   701              2.03            
REMARK 500   OD1  ASN B   404     O    HOH B   701              2.05            
REMARK 500   O    HOH D   752     O    HOH D   757              2.06            
REMARK 500   N    LYS D   249     O    HOH D   701              2.06            
REMARK 500   O    GLY F   348     O    HOH F   701              2.08            
REMARK 500   O    TRP F   170     O    HOH F   702              2.08            
REMARK 500   OE1  GLU E   339     N    GLY E   463              2.08            
REMARK 500   O    ILE E   231     O    HOH E   702              2.09            
REMARK 500   O    GLY B   109     O    HOH B   702              2.10            
REMARK 500   NH2  ARG C   304     O    HOH C   701              2.11            
REMARK 500   OD1  ASN A   404     O    HOH A   701              2.11            
REMARK 500   OE2  GLU D   151     O    HOH D   702              2.11            
REMARK 500   O    ASP D   337     O    HOH D   703              2.11            
REMARK 500   NZ   LYS B    78     O    HOH B   703              2.12            
REMARK 500   OD1  ASP E   173     O    HOH E   703              2.12            
REMARK 500   O    PRO B    51     O    HOH B   704              2.13            
REMARK 500   OE2  GLU A   516     O    HOH A   702              2.13            
REMARK 500   O    HOH E   749     O    HOH D   725              2.15            
REMARK 500   O    HOH D   726     O    HOH D   731              2.15            
REMARK 500   OE2  GLU B   363     O    HOH B   705              2.16            
REMARK 500   NH2  ARG B   346     O    HOH B   706              2.16            
REMARK 500   O    HOH B   742     O    HOH B   748              2.18            
REMARK 500   O    HOH F   746     O    HOH F   749              2.19            
REMARK 500   OD1  ASP D   275     O    HOH D   701              2.19            
REMARK 500   O    GLY A   100     NH1  ARG A   323              2.19            
REMARK 500   O    HOH E   750     O    HOH F   747              2.19            
REMARK 500   OE1  GLN D   288     O    HOH D   704              2.19            
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: CLOSE CONTACTS                                             
REMARK 500                                                                      
REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC             
REMARK 500 SYMMETRY ARE IN CLOSE CONTACT.  AN ATOM LOCATED WITHIN 0.15          
REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A           
REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375             
REMARK 500 INSTEAD OF REMARK 500.  ATOMS WITH NON-BLANK ALTERNATE               
REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS.            
REMARK 500                                                                      
REMARK 500 DISTANCE CUTOFF:                                                     
REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS              
REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS                  
REMARK 500                                                                      
REMARK 500  ATM1  RES C  SSEQI   ATM2  RES C  SSEQI  SSYMOP   DISTANCE          
REMARK 500   NH2  ARG F   323     O    ARG C   323     4555     2.01            
REMARK 500   O    ARG F   323     NH2  ARG C   323     4555     2.12            
REMARK 500   NH2  ARG A   172     O    HOH F   702     2555     2.18            
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: COVALENT BOND ANGLES                                       
REMARK 500                                                                      
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES              
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE               
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                 
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)              
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999                        
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996                     
REMARK 500                                                                      
REMARK 500  M RES CSSEQI ATM1   ATM2   ATM3                                     
REMARK 500    LEU A 344   CA  -  CB  -  CG  ANGL. DEV. =  22.9 DEGREES          
REMARK 500    LEU A 345   CA  -  CB  -  CG  ANGL. DEV. =  16.5 DEGREES          
REMARK 500    LEU F 344   CA  -  CB  -  CG  ANGL. DEV. =  15.2 DEGREES          
REMARK 500    LEU F 345   CA  -  CB  -  CG  ANGL. DEV. =  18.9 DEGREES          
REMARK 500    LEU D 344   CA  -  CB  -  CG  ANGL. DEV. =  15.8 DEGREES          
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: TORSION ANGLES                                             
REMARK 500                                                                      
REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS:            
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2)                    
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI-           
REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400            
REMARK 500                                                                      
REMARK 500  M RES CSSEQI        PSI       PHI                                   
REMARK 500    ASP A 307       -6.39     60.40                                   
REMARK 500    ASP A 338       41.00     71.06                                   
REMARK 500    VAL A 414      -59.67   -126.81                                   
REMARK 500    ASN E 108       17.88     59.09                                   
REMARK 500    ASP E 306      104.50    -58.86                                   
REMARK 500    ASP E 307       -4.65     59.48                                   
REMARK 500    ASP E 338       38.88     72.09                                   
REMARK 500    VAL E 414      -58.18   -128.90                                   
REMARK 500    ASP F 307       -3.72     60.40                                   
REMARK 500    VAL F 414      -58.13   -128.89                                   
REMARK 500    ASN B 108       16.44     59.30                                   
REMARK 500    ASP B 307       28.85     42.47                                   
REMARK 500    ASP B 338       38.60     70.34                                   
REMARK 500    VAL B 414      -58.56   -124.77                                   
REMARK 500    HIS B 485       -0.30     74.95                                   
REMARK 500    ASN C 108       17.12     59.47                                   
REMARK 500    TYR C 161      -73.65    -58.42                                   
REMARK 500    ASP C 307       -3.96     61.72                                   
REMARK 500    ASP C 338       40.14     71.77                                   
REMARK 500    VAL C 414      -58.74   -128.87                                   
REMARK 500    ASN D 108       15.93     59.67                                   
REMARK 500    SER D 234       -7.01    -59.74                                   
REMARK 500    ASP D 307       -3.22     61.81                                   
REMARK 500    ASP D 338       40.85     70.60                                   
REMARK 500    VAL D 414      -59.95   -127.64                                   
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: NON-CIS, NON-TRANS                                         
REMARK 500                                                                      
REMARK 500 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH          
REMARK 500 CIS AND TRANS CONFORMATION.  CIS BONDS, IF ANY, ARE LISTED           
REMARK 500 ON CISPEP RECORDS.  TRANS IS DEFINED AS 180 +/- 30 AND               
REMARK 500 CIS IS DEFINED AS 0 +/- 30 DEGREES.                                  
REMARK 500                                 MODEL     OMEGA                      
REMARK 500 ALA A  162     GLY A  163                 -149.43                    
REMARK 500 LEU A  344     LEU A  345                  142.60                    
REMARK 500 GLY A  376     ILE A  377                  145.60                    
REMARK 500 ALA E  162     GLY E  163                 -139.76                    
REMARK 500 GLY E  376     ILE E  377                  142.53                    
REMARK 500 GLY F   95     LYS F   96                 -146.42                    
REMARK 500 LEU F  344     LEU F  345                  149.45                    
REMARK 500 GLY F  376     ILE F  377                  146.48                    
REMARK 500 GLY B   95     LYS B   96                 -144.83                    
REMARK 500 GLY B  376     ILE B  377                  147.85                    
REMARK 500 GLY C   95     LYS C   96                 -146.82                    
REMARK 500 GLY C  376     ILE C  377                  144.76                    
REMARK 500 GLY D   95     LYS D   96                 -143.95                    
REMARK 500 ALA D  162     GLY D  163                 -141.51                    
REMARK 500 GLY D  376     ILE D  377                  145.79                    
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 620                                                                      
REMARK 620 METAL COORDINATION                                                   
REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE):                             
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              ZN A 602  ZN                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 HIS A 133   NE2                                                    
REMARK 620 2 ASP A 306   OD1  88.7                                              
REMARK 620 3 ASP A 391   OD1  99.6 108.0                                        
REMARK 620 4 ASP A 391   OD2 110.2 160.1  64.0                                  
REMARK 620 N                    1     2     3                                   
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              ZN A 601  ZN                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 ASP A 306   OD2                                                    
REMARK 620 2 GLU A 340   OE1 168.6                                              
REMARK 620 3 GLU A 340   OE2 118.2  59.7                                        
REMARK 620 4 HIS A 485   NE2 106.1  71.9 129.3                                  
REMARK 620 N                    1     2     3                                   
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              ZN E 602  ZN                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 HIS E 133   NE2                                                    
REMARK 620 2 ASP E 306   OD1 110.2                                              
REMARK 620 3 GLU E 340   OE2  80.1  91.1                                        
REMARK 620 4 ASP E 391   OD1 103.4  88.3 176.5                                  
REMARK 620 5 ASP E 391   OD2 107.7 136.5 116.1  62.3                            
REMARK 620 N                    1     2     3     4                             
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              ZN E 601  ZN                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 ASP E 306   OD2                                                    
REMARK 620 2 GLU E 340   OE1  94.5                                              
REMARK 620 3 GLU E 340   OE2  88.7  55.9                                        
REMARK 620 4 HIS E 485   NE2  91.0 103.6 159.4                                  
REMARK 620 N                    1     2     3                                   
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              ZN F 602  ZN                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 HIS F 133   NE2                                                    
REMARK 620 2 ASP F 306   OD1 109.2                                              
REMARK 620 3 ASP F 391   OD1 102.7  85.4                                        
REMARK 620 4 ASP F 391   OD2 106.7 136.2  62.8                                  
REMARK 620 N                    1     2     3                                   
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              ZN F 601  ZN                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 ASP F 306   OD2                                                    
REMARK 620 2 GLU F 340   OE1  81.9                                              
REMARK 620 3 GLU F 340   OE2 133.4  61.6                                        
REMARK 620 4 HIS F 485   NE2  90.1 103.8 124.4                                  
REMARK 620 N                    1     2     3                                   
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              ZN B 602  ZN                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 HIS B 133   NE2                                                    
REMARK 620 2 ASP B 306   OD1 111.1                                              
REMARK 620 3 ASP B 391   OD1 110.8  92.1                                        
REMARK 620 4 ASP B 391   OD2 101.9 142.0  58.0                                  
REMARK 620 N                    1     2     3                                   
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              ZN B 601  ZN                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 ASP B 306   OD2                                                    
REMARK 620 2 GLU B 340   OE1  70.4                                              
REMARK 620 3 GLU B 340   OE2 130.2  60.6                                        
REMARK 620 4 HIS B 485   NE2  90.9 100.4 105.8                                  
REMARK 620 N                    1     2     3                                   
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              ZN C 602  ZN                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 HIS C 133   NE2                                                    
REMARK 620 2 ASP C 306   OD1 110.0                                              
REMARK 620 3 ASP C 391   OD1  98.0  89.7                                        
REMARK 620 4 ASP C 391   OD2 104.5 138.5  62.8                                  
REMARK 620 N                    1     2     3                                   
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              ZN C 601  ZN                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 ASP C 306   OD2                                                    
REMARK 620 2 GLU C 340   OE1  70.1                                              
REMARK 620 3 GLU C 340   OE2 130.1  60.2                                        
REMARK 620 4 HIS C 485   NE2  83.8 102.5 101.7                                  
REMARK 620 N                    1     2     3                                   
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              ZN D 602  ZN                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 HIS D 133   NE2                                                    
REMARK 620 2 ASP D 306   OD1 108.4                                              
REMARK 620 3 ASP D 391   OD1  97.4  90.0                                        
REMARK 620 4 ASP D 391   OD2 105.3 138.9  62.7                                  
REMARK 620 N                    1     2     3                                   
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              ZN D 601  ZN                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 ASP D 306   OD2                                                    
REMARK 620 2 GLU D 340   OE1 148.0                                              
REMARK 620 3 GLU D 340   OE2  87.5  63.3                                        
REMARK 620 4 HIS D 485   NE2  85.7 100.8 126.1                                  
REMARK 620 5 HOH D 748   O    93.0 110.4 115.0 118.7                            
REMARK 620 N                    1     2     3     4                             
REMARK 800                                                                      
REMARK 800 SITE                                                                 
REMARK 800 SITE_IDENTIFIER: AC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue ZN A 601                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC2                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue ZN A 602                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC3                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue ZN E 601                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC4                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue ZN E 602                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC5                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue ZN F 601                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC6                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue ZN F 602                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC7                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue ZN B 601                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC8                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue ZN B 602                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC9                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue ZN C 601                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AD1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue ZN C 602                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AD2                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue ZN D 601                  
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AD3                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: binding site for residue ZN D 602                  
DBREF  5JM6 A    1   519  UNP    G0SG74   G0SG74_CHATD     1    519             
DBREF  5JM6 E    1   519  UNP    G0SG74   G0SG74_CHATD     1    519             
DBREF  5JM6 F    1   519  UNP    G0SG74   G0SG74_CHATD     1    519             
DBREF  5JM6 B    1   519  UNP    G0SG74   G0SG74_CHATD     1    519             
DBREF  5JM6 C    1   519  UNP    G0SG74   G0SG74_CHATD     1    519             
DBREF  5JM6 D    1   519  UNP    G0SG74   G0SG74_CHATD     1    519             
SEQRES   1 A  519  MET THR ARG LEU THR PRO ASP VAL LEU ARG MET ARG SER          
SEQRES   2 A  519  SER GLN LEU SER LEU ARG SER LEU ALA MET GLU GLN PRO          
SEQRES   3 A  519  GLN GLN ARG THR ALA ALA PRO PRO THR ILE ASP GLU ALA          
SEQRES   4 A  519  PRO THR VAL PRO LEU GLU ALA LYS ASP LEU ARG PRO GLU          
SEQRES   5 A  519  HIS PHE THR GLN PRO TYR LEU ASP PHE MET THR HIS ASN          
SEQRES   6 A  519  PRO THR VAL PHE HIS VAL VAL ASP TYR CYS LYS GLN LYS          
SEQRES   7 A  519  LEU LEU LYS ALA GLY TYR VAL GLU LEU PRO ALA ARG ASP          
SEQRES   8 A  519  SER TRP THR GLY LYS LEU VAL PRO GLY GLY LYS TYR PHE          
SEQRES   9 A  519  THR THR ARG ASN GLY SER SER ILE ILE ALA PHE THR VAL          
SEQRES  10 A  519  GLY GLN ALA TYR LYS PRO GLY ASN GLY ILE ALA MET ILE          
SEQRES  11 A  519  ALA GLY HIS ILE ASP ALA LEU THR ALA ARG LEU LYS PRO          
SEQRES  12 A  519  THR SER VAL LYS PRO THR LYS GLU GLY TYR VAL GLN LEU          
SEQRES  13 A  519  GLY VAL ALA GLN TYR ALA GLY ALA LEU ASN GLU THR TRP          
SEQRES  14 A  519  TRP ASP ARG ASP LEU SER VAL GLY GLY ARG VAL ILE VAL          
SEQRES  15 A  519  LYS ASP PRO LYS THR GLY LYS THR THR VAL LYS LEU VAL          
SEQRES  16 A  519  LYS VAL ASP TRP PRO VAL ALA ARG ILE PRO THR LEU ALA          
SEQRES  17 A  519  PRO HIS PHE GLY ILE GLY MET THR GLY HIS GLY ASN ARG          
SEQRES  18 A  519  GLU THR GLU MET VAL PRO VAL ILE GLY ILE ASP ASN SER          
SEQRES  19 A  519  ASP LEU LEU GLY GLU LYS ALA GLU SER GLU LYS PRO VAL          
SEQRES  20 A  519  GLY LYS PRO GLY SER PHE ALA SER THR GLN PRO PRO LYS          
SEQRES  21 A  519  LEU VAL LYS LEU ILE LEU SER GLN LEU GLY LEU SER ASP          
SEQRES  22 A  519  PRO ASP SER ILE LEU ASN TRP GLU LEU GLU LEU PHE ASP          
SEQRES  23 A  519  ALA GLN PRO ALA THR VAL GLY GLY LEU ASP LYS GLU PHE          
SEQRES  24 A  519  ILE PHE ALA GLY ARG ILE ASP ASP LYS LEU CYS SER TRP          
SEQRES  25 A  519  ALA ALA PHE MET ALA LEU LEU HIS ALA LYS ARG ALA PRO          
SEQRES  26 A  519  THR ASP GLY VAL ILE LYS LEU VAL ALA LEU PHE ASP ASP          
SEQRES  27 A  519  GLU GLU ILE GLY SER LEU LEU ARG GLN GLY ALA ARG GLY          
SEQRES  28 A  519  ASN PHE LEU PRO ILE THR ILE GLU ARG ILE LEU GLU SER          
SEQRES  29 A  519  PHE CYS SER SER ASN SER VAL PRO PHE GLY PRO GLY ILE          
SEQRES  30 A  519  LEU GLY GLN THR TYR ALA ARG SER PHE LEU VAL SER SER          
SEQRES  31 A  519  ASP VAL THR HIS ALA ALA HIS PRO ASN PHE THR GLN THR          
SEQRES  32 A  519  ASN LEU PRO GLY HIS SER PRO ARG LEU ASN VAL GLY VAL          
SEQRES  33 A  519  ALA LEU CYS VAL ASP ALA SER ALA HIS MET THR THR ASP          
SEQRES  34 A  519  SER VAL SER MET ALA ILE LEU ASP ARG ILE ALA GLU LEU          
SEQRES  35 A  519  SER GLY CYS VAL ASN GLN ARG HIS MET ILE ARG ASN ASP          
SEQRES  36 A  519  SER ARG SER GLY GLY THR VAL GLY PRO MET LEU SER ALA          
SEQRES  37 A  519  ALA MET GLY VAL LYS ALA ALA ASP VAL GLY ILE PRO GLN          
SEQRES  38 A  519  LEU SER MET HIS SER ILE ARG ALA MET THR GLY SER LEU          
SEQRES  39 A  519  ASP PRO GLY LEU GLY VAL LYS PHE TYR LYS GLY PHE LEU          
SEQRES  40 A  519  ASP PHE TRP GLU GLU VAL ASP LEU GLU TRP SER HIS              
SEQRES   1 E  519  MET THR ARG LEU THR PRO ASP VAL LEU ARG MET ARG SER          
SEQRES   2 E  519  SER GLN LEU SER LEU ARG SER LEU ALA MET GLU GLN PRO          
SEQRES   3 E  519  GLN GLN ARG THR ALA ALA PRO PRO THR ILE ASP GLU ALA          
SEQRES   4 E  519  PRO THR VAL PRO LEU GLU ALA LYS ASP LEU ARG PRO GLU          
SEQRES   5 E  519  HIS PHE THR GLN PRO TYR LEU ASP PHE MET THR HIS ASN          
SEQRES   6 E  519  PRO THR VAL PHE HIS VAL VAL ASP TYR CYS LYS GLN LYS          
SEQRES   7 E  519  LEU LEU LYS ALA GLY TYR VAL GLU LEU PRO ALA ARG ASP          
SEQRES   8 E  519  SER TRP THR GLY LYS LEU VAL PRO GLY GLY LYS TYR PHE          
SEQRES   9 E  519  THR THR ARG ASN GLY SER SER ILE ILE ALA PHE THR VAL          
SEQRES  10 E  519  GLY GLN ALA TYR LYS PRO GLY ASN GLY ILE ALA MET ILE          
SEQRES  11 E  519  ALA GLY HIS ILE ASP ALA LEU THR ALA ARG LEU LYS PRO          
SEQRES  12 E  519  THR SER VAL LYS PRO THR LYS GLU GLY TYR VAL GLN LEU          
SEQRES  13 E  519  GLY VAL ALA GLN TYR ALA GLY ALA LEU ASN GLU THR TRP          
SEQRES  14 E  519  TRP ASP ARG ASP LEU SER VAL GLY GLY ARG VAL ILE VAL          
SEQRES  15 E  519  LYS ASP PRO LYS THR GLY LYS THR THR VAL LYS LEU VAL          
SEQRES  16 E  519  LYS VAL ASP TRP PRO VAL ALA ARG ILE PRO THR LEU ALA          
SEQRES  17 E  519  PRO HIS PHE GLY ILE GLY MET THR GLY HIS GLY ASN ARG          
SEQRES  18 E  519  GLU THR GLU MET VAL PRO VAL ILE GLY ILE ASP ASN SER          
SEQRES  19 E  519  ASP LEU LEU GLY GLU LYS ALA GLU SER GLU LYS PRO VAL          
SEQRES  20 E  519  GLY LYS PRO GLY SER PHE ALA SER THR GLN PRO PRO LYS          
SEQRES  21 E  519  LEU VAL LYS LEU ILE LEU SER GLN LEU GLY LEU SER ASP          
SEQRES  22 E  519  PRO ASP SER ILE LEU ASN TRP GLU LEU GLU LEU PHE ASP          
SEQRES  23 E  519  ALA GLN PRO ALA THR VAL GLY GLY LEU ASP LYS GLU PHE          
SEQRES  24 E  519  ILE PHE ALA GLY ARG ILE ASP ASP LYS LEU CYS SER TRP          
SEQRES  25 E  519  ALA ALA PHE MET ALA LEU LEU HIS ALA LYS ARG ALA PRO          
SEQRES  26 E  519  THR ASP GLY VAL ILE LYS LEU VAL ALA LEU PHE ASP ASP          
SEQRES  27 E  519  GLU GLU ILE GLY SER LEU LEU ARG GLN GLY ALA ARG GLY          
SEQRES  28 E  519  ASN PHE LEU PRO ILE THR ILE GLU ARG ILE LEU GLU SER          
SEQRES  29 E  519  PHE CYS SER SER ASN SER VAL PRO PHE GLY PRO GLY ILE          
SEQRES  30 E  519  LEU GLY GLN THR TYR ALA ARG SER PHE LEU VAL SER SER          
SEQRES  31 E  519  ASP VAL THR HIS ALA ALA HIS PRO ASN PHE THR GLN THR          
SEQRES  32 E  519  ASN LEU PRO GLY HIS SER PRO ARG LEU ASN VAL GLY VAL          
SEQRES  33 E  519  ALA LEU CYS VAL ASP ALA SER ALA HIS MET THR THR ASP          
SEQRES  34 E  519  SER VAL SER MET ALA ILE LEU ASP ARG ILE ALA GLU LEU          
SEQRES  35 E  519  SER GLY CYS VAL ASN GLN ARG HIS MET ILE ARG ASN ASP          
SEQRES  36 E  519  SER ARG SER GLY GLY THR VAL GLY PRO MET LEU SER ALA          
SEQRES  37 E  519  ALA MET GLY VAL LYS ALA ALA ASP VAL GLY ILE PRO GLN          
SEQRES  38 E  519  LEU SER MET HIS SER ILE ARG ALA MET THR GLY SER LEU          
SEQRES  39 E  519  ASP PRO GLY LEU GLY VAL LYS PHE TYR LYS GLY PHE LEU          
SEQRES  40 E  519  ASP PHE TRP GLU GLU VAL ASP LEU GLU TRP SER HIS              
SEQRES   1 F  519  MET THR ARG LEU THR PRO ASP VAL LEU ARG MET ARG SER          
SEQRES   2 F  519  SER GLN LEU SER LEU ARG SER LEU ALA MET GLU GLN PRO          
SEQRES   3 F  519  GLN GLN ARG THR ALA ALA PRO PRO THR ILE ASP GLU ALA          
SEQRES   4 F  519  PRO THR VAL PRO LEU GLU ALA LYS ASP LEU ARG PRO GLU          
SEQRES   5 F  519  HIS PHE THR GLN PRO TYR LEU ASP PHE MET THR HIS ASN          
SEQRES   6 F  519  PRO THR VAL PHE HIS VAL VAL ASP TYR CYS LYS GLN LYS          
SEQRES   7 F  519  LEU LEU LYS ALA GLY TYR VAL GLU LEU PRO ALA ARG ASP          
SEQRES   8 F  519  SER TRP THR GLY LYS LEU VAL PRO GLY GLY LYS TYR PHE          
SEQRES   9 F  519  THR THR ARG ASN GLY SER SER ILE ILE ALA PHE THR VAL          
SEQRES  10 F  519  GLY GLN ALA TYR LYS PRO GLY ASN GLY ILE ALA MET ILE          
SEQRES  11 F  519  ALA GLY HIS ILE ASP ALA LEU THR ALA ARG LEU LYS PRO          
SEQRES  12 F  519  THR SER VAL LYS PRO THR LYS GLU GLY TYR VAL GLN LEU          
SEQRES  13 F  519  GLY VAL ALA GLN TYR ALA GLY ALA LEU ASN GLU THR TRP          
SEQRES  14 F  519  TRP ASP ARG ASP LEU SER VAL GLY GLY ARG VAL ILE VAL          
SEQRES  15 F  519  LYS ASP PRO LYS THR GLY LYS THR THR VAL LYS LEU VAL          
SEQRES  16 F  519  LYS VAL ASP TRP PRO VAL ALA ARG ILE PRO THR LEU ALA          
SEQRES  17 F  519  PRO HIS PHE GLY ILE GLY MET THR GLY HIS GLY ASN ARG          
SEQRES  18 F  519  GLU THR GLU MET VAL PRO VAL ILE GLY ILE ASP ASN SER          
SEQRES  19 F  519  ASP LEU LEU GLY GLU LYS ALA GLU SER GLU LYS PRO VAL          
SEQRES  20 F  519  GLY LYS PRO GLY SER PHE ALA SER THR GLN PRO PRO LYS          
SEQRES  21 F  519  LEU VAL LYS LEU ILE LEU SER GLN LEU GLY LEU SER ASP          
SEQRES  22 F  519  PRO ASP SER ILE LEU ASN TRP GLU LEU GLU LEU PHE ASP          
SEQRES  23 F  519  ALA GLN PRO ALA THR VAL GLY GLY LEU ASP LYS GLU PHE          
SEQRES  24 F  519  ILE PHE ALA GLY ARG ILE ASP ASP LYS LEU CYS SER TRP          
SEQRES  25 F  519  ALA ALA PHE MET ALA LEU LEU HIS ALA LYS ARG ALA PRO          
SEQRES  26 F  519  THR ASP GLY VAL ILE LYS LEU VAL ALA LEU PHE ASP ASP          
SEQRES  27 F  519  GLU GLU ILE GLY SER LEU LEU ARG GLN GLY ALA ARG GLY          
SEQRES  28 F  519  ASN PHE LEU PRO ILE THR ILE GLU ARG ILE LEU GLU SER          
SEQRES  29 F  519  PHE CYS SER SER ASN SER VAL PRO PHE GLY PRO GLY ILE          
SEQRES  30 F  519  LEU GLY GLN THR TYR ALA ARG SER PHE LEU VAL SER SER          
SEQRES  31 F  519  ASP VAL THR HIS ALA ALA HIS PRO ASN PHE THR GLN THR          
SEQRES  32 F  519  ASN LEU PRO GLY HIS SER PRO ARG LEU ASN VAL GLY VAL          
SEQRES  33 F  519  ALA LEU CYS VAL ASP ALA SER ALA HIS MET THR THR ASP          
SEQRES  34 F  519  SER VAL SER MET ALA ILE LEU ASP ARG ILE ALA GLU LEU          
SEQRES  35 F  519  SER GLY CYS VAL ASN GLN ARG HIS MET ILE ARG ASN ASP          
SEQRES  36 F  519  SER ARG SER GLY GLY THR VAL GLY PRO MET LEU SER ALA          
SEQRES  37 F  519  ALA MET GLY VAL LYS ALA ALA ASP VAL GLY ILE PRO GLN          
SEQRES  38 F  519  LEU SER MET HIS SER ILE ARG ALA MET THR GLY SER LEU          
SEQRES  39 F  519  ASP PRO GLY LEU GLY VAL LYS PHE TYR LYS GLY PHE LEU          
SEQRES  40 F  519  ASP PHE TRP GLU GLU VAL ASP LEU GLU TRP SER HIS              
SEQRES   1 B  519  MET THR ARG LEU THR PRO ASP VAL LEU ARG MET ARG SER          
SEQRES   2 B  519  SER GLN LEU SER LEU ARG SER LEU ALA MET GLU GLN PRO          
SEQRES   3 B  519  GLN GLN ARG THR ALA ALA PRO PRO THR ILE ASP GLU ALA          
SEQRES   4 B  519  PRO THR VAL PRO LEU GLU ALA LYS ASP LEU ARG PRO GLU          
SEQRES   5 B  519  HIS PHE THR GLN PRO TYR LEU ASP PHE MET THR HIS ASN          
SEQRES   6 B  519  PRO THR VAL PHE HIS VAL VAL ASP TYR CYS LYS GLN LYS          
SEQRES   7 B  519  LEU LEU LYS ALA GLY TYR VAL GLU LEU PRO ALA ARG ASP          
SEQRES   8 B  519  SER TRP THR GLY LYS LEU VAL PRO GLY GLY LYS TYR PHE          
SEQRES   9 B  519  THR THR ARG ASN GLY SER SER ILE ILE ALA PHE THR VAL          
SEQRES  10 B  519  GLY GLN ALA TYR LYS PRO GLY ASN GLY ILE ALA MET ILE          
SEQRES  11 B  519  ALA GLY HIS ILE ASP ALA LEU THR ALA ARG LEU LYS PRO          
SEQRES  12 B  519  THR SER VAL LYS PRO THR LYS GLU GLY TYR VAL GLN LEU          
SEQRES  13 B  519  GLY VAL ALA GLN TYR ALA GLY ALA LEU ASN GLU THR TRP          
SEQRES  14 B  519  TRP ASP ARG ASP LEU SER VAL GLY GLY ARG VAL ILE VAL          
SEQRES  15 B  519  LYS ASP PRO LYS THR GLY LYS THR THR VAL LYS LEU VAL          
SEQRES  16 B  519  LYS VAL ASP TRP PRO VAL ALA ARG ILE PRO THR LEU ALA          
SEQRES  17 B  519  PRO HIS PHE GLY ILE GLY MET THR GLY HIS GLY ASN ARG          
SEQRES  18 B  519  GLU THR GLU MET VAL PRO VAL ILE GLY ILE ASP ASN SER          
SEQRES  19 B  519  ASP LEU LEU GLY GLU LYS ALA GLU SER GLU LYS PRO VAL          
SEQRES  20 B  519  GLY LYS PRO GLY SER PHE ALA SER THR GLN PRO PRO LYS          
SEQRES  21 B  519  LEU VAL LYS LEU ILE LEU SER GLN LEU GLY LEU SER ASP          
SEQRES  22 B  519  PRO ASP SER ILE LEU ASN TRP GLU LEU GLU LEU PHE ASP          
SEQRES  23 B  519  ALA GLN PRO ALA THR VAL GLY GLY LEU ASP LYS GLU PHE          
SEQRES  24 B  519  ILE PHE ALA GLY ARG ILE ASP ASP LYS LEU CYS SER TRP          
SEQRES  25 B  519  ALA ALA PHE MET ALA LEU LEU HIS ALA LYS ARG ALA PRO          
SEQRES  26 B  519  THR ASP GLY VAL ILE LYS LEU VAL ALA LEU PHE ASP ASP          
SEQRES  27 B  519  GLU GLU ILE GLY SER LEU LEU ARG GLN GLY ALA ARG GLY          
SEQRES  28 B  519  ASN PHE LEU PRO ILE THR ILE GLU ARG ILE LEU GLU SER          
SEQRES  29 B  519  PHE CYS SER SER ASN SER VAL PRO PHE GLY PRO GLY ILE          
SEQRES  30 B  519  LEU GLY GLN THR TYR ALA ARG SER PHE LEU VAL SER SER          
SEQRES  31 B  519  ASP VAL THR HIS ALA ALA HIS PRO ASN PHE THR GLN THR          
SEQRES  32 B  519  ASN LEU PRO GLY HIS SER PRO ARG LEU ASN VAL GLY VAL          
SEQRES  33 B  519  ALA LEU CYS VAL ASP ALA SER ALA HIS MET THR THR ASP          
SEQRES  34 B  519  SER VAL SER MET ALA ILE LEU ASP ARG ILE ALA GLU LEU          
SEQRES  35 B  519  SER GLY CYS VAL ASN GLN ARG HIS MET ILE ARG ASN ASP          
SEQRES  36 B  519  SER ARG SER GLY GLY THR VAL GLY PRO MET LEU SER ALA          
SEQRES  37 B  519  ALA MET GLY VAL LYS ALA ALA ASP VAL GLY ILE PRO GLN          
SEQRES  38 B  519  LEU SER MET HIS SER ILE ARG ALA MET THR GLY SER LEU          
SEQRES  39 B  519  ASP PRO GLY LEU GLY VAL LYS PHE TYR LYS GLY PHE LEU          
SEQRES  40 B  519  ASP PHE TRP GLU GLU VAL ASP LEU GLU TRP SER HIS              
SEQRES   1 C  519  MET THR ARG LEU THR PRO ASP VAL LEU ARG MET ARG SER          
SEQRES   2 C  519  SER GLN LEU SER LEU ARG SER LEU ALA MET GLU GLN PRO          
SEQRES   3 C  519  GLN GLN ARG THR ALA ALA PRO PRO THR ILE ASP GLU ALA          
SEQRES   4 C  519  PRO THR VAL PRO LEU GLU ALA LYS ASP LEU ARG PRO GLU          
SEQRES   5 C  519  HIS PHE THR GLN PRO TYR LEU ASP PHE MET THR HIS ASN          
SEQRES   6 C  519  PRO THR VAL PHE HIS VAL VAL ASP TYR CYS LYS GLN LYS          
SEQRES   7 C  519  LEU LEU LYS ALA GLY TYR VAL GLU LEU PRO ALA ARG ASP          
SEQRES   8 C  519  SER TRP THR GLY LYS LEU VAL PRO GLY GLY LYS TYR PHE          
SEQRES   9 C  519  THR THR ARG ASN GLY SER SER ILE ILE ALA PHE THR VAL          
SEQRES  10 C  519  GLY GLN ALA TYR LYS PRO GLY ASN GLY ILE ALA MET ILE          
SEQRES  11 C  519  ALA GLY HIS ILE ASP ALA LEU THR ALA ARG LEU LYS PRO          
SEQRES  12 C  519  THR SER VAL LYS PRO THR LYS GLU GLY TYR VAL GLN LEU          
SEQRES  13 C  519  GLY VAL ALA GLN TYR ALA GLY ALA LEU ASN GLU THR TRP          
SEQRES  14 C  519  TRP ASP ARG ASP LEU SER VAL GLY GLY ARG VAL ILE VAL          
SEQRES  15 C  519  LYS ASP PRO LYS THR GLY LYS THR THR VAL LYS LEU VAL          
SEQRES  16 C  519  LYS VAL ASP TRP PRO VAL ALA ARG ILE PRO THR LEU ALA          
SEQRES  17 C  519  PRO HIS PHE GLY ILE GLY MET THR GLY HIS GLY ASN ARG          
SEQRES  18 C  519  GLU THR GLU MET VAL PRO VAL ILE GLY ILE ASP ASN SER          
SEQRES  19 C  519  ASP LEU LEU GLY GLU LYS ALA GLU SER GLU LYS PRO VAL          
SEQRES  20 C  519  GLY LYS PRO GLY SER PHE ALA SER THR GLN PRO PRO LYS          
SEQRES  21 C  519  LEU VAL LYS LEU ILE LEU SER GLN LEU GLY LEU SER ASP          
SEQRES  22 C  519  PRO ASP SER ILE LEU ASN TRP GLU LEU GLU LEU PHE ASP          
SEQRES  23 C  519  ALA GLN PRO ALA THR VAL GLY GLY LEU ASP LYS GLU PHE          
SEQRES  24 C  519  ILE PHE ALA GLY ARG ILE ASP ASP LYS LEU CYS SER TRP          
SEQRES  25 C  519  ALA ALA PHE MET ALA LEU LEU HIS ALA LYS ARG ALA PRO          
SEQRES  26 C  519  THR ASP GLY VAL ILE LYS LEU VAL ALA LEU PHE ASP ASP          
SEQRES  27 C  519  GLU GLU ILE GLY SER LEU LEU ARG GLN GLY ALA ARG GLY          
SEQRES  28 C  519  ASN PHE LEU PRO ILE THR ILE GLU ARG ILE LEU GLU SER          
SEQRES  29 C  519  PHE CYS SER SER ASN SER VAL PRO PHE GLY PRO GLY ILE          
SEQRES  30 C  519  LEU GLY GLN THR TYR ALA ARG SER PHE LEU VAL SER SER          
SEQRES  31 C  519  ASP VAL THR HIS ALA ALA HIS PRO ASN PHE THR GLN THR          
SEQRES  32 C  519  ASN LEU PRO GLY HIS SER PRO ARG LEU ASN VAL GLY VAL          
SEQRES  33 C  519  ALA LEU CYS VAL ASP ALA SER ALA HIS MET THR THR ASP          
SEQRES  34 C  519  SER VAL SER MET ALA ILE LEU ASP ARG ILE ALA GLU LEU          
SEQRES  35 C  519  SER GLY CYS VAL ASN GLN ARG HIS MET ILE ARG ASN ASP          
SEQRES  36 C  519  SER ARG SER GLY GLY THR VAL GLY PRO MET LEU SER ALA          
SEQRES  37 C  519  ALA MET GLY VAL LYS ALA ALA ASP VAL GLY ILE PRO GLN          
SEQRES  38 C  519  LEU SER MET HIS SER ILE ARG ALA MET THR GLY SER LEU          
SEQRES  39 C  519  ASP PRO GLY LEU GLY VAL LYS PHE TYR LYS GLY PHE LEU          
SEQRES  40 C  519  ASP PHE TRP GLU GLU VAL ASP LEU GLU TRP SER HIS              
SEQRES   1 D  519  MET THR ARG LEU THR PRO ASP VAL LEU ARG MET ARG SER          
SEQRES   2 D  519  SER GLN LEU SER LEU ARG SER LEU ALA MET GLU GLN PRO          
SEQRES   3 D  519  GLN GLN ARG THR ALA ALA PRO PRO THR ILE ASP GLU ALA          
SEQRES   4 D  519  PRO THR VAL PRO LEU GLU ALA LYS ASP LEU ARG PRO GLU          
SEQRES   5 D  519  HIS PHE THR GLN PRO TYR LEU ASP PHE MET THR HIS ASN          
SEQRES   6 D  519  PRO THR VAL PHE HIS VAL VAL ASP TYR CYS LYS GLN LYS          
SEQRES   7 D  519  LEU LEU LYS ALA GLY TYR VAL GLU LEU PRO ALA ARG ASP          
SEQRES   8 D  519  SER TRP THR GLY LYS LEU VAL PRO GLY GLY LYS TYR PHE          
SEQRES   9 D  519  THR THR ARG ASN GLY SER SER ILE ILE ALA PHE THR VAL          
SEQRES  10 D  519  GLY GLN ALA TYR LYS PRO GLY ASN GLY ILE ALA MET ILE          
SEQRES  11 D  519  ALA GLY HIS ILE ASP ALA LEU THR ALA ARG LEU LYS PRO          
SEQRES  12 D  519  THR SER VAL LYS PRO THR LYS GLU GLY TYR VAL GLN LEU          
SEQRES  13 D  519  GLY VAL ALA GLN TYR ALA GLY ALA LEU ASN GLU THR TRP          
SEQRES  14 D  519  TRP ASP ARG ASP LEU SER VAL GLY GLY ARG VAL ILE VAL          
SEQRES  15 D  519  LYS ASP PRO LYS THR GLY LYS THR THR VAL LYS LEU VAL          
SEQRES  16 D  519  LYS VAL ASP TRP PRO VAL ALA ARG ILE PRO THR LEU ALA          
SEQRES  17 D  519  PRO HIS PHE GLY ILE GLY MET THR GLY HIS GLY ASN ARG          
SEQRES  18 D  519  GLU THR GLU MET VAL PRO VAL ILE GLY ILE ASP ASN SER          
SEQRES  19 D  519  ASP LEU LEU GLY GLU LYS ALA GLU SER GLU LYS PRO VAL          
SEQRES  20 D  519  GLY LYS PRO GLY SER PHE ALA SER THR GLN PRO PRO LYS          
SEQRES  21 D  519  LEU VAL LYS LEU ILE LEU SER GLN LEU GLY LEU SER ASP          
SEQRES  22 D  519  PRO ASP SER ILE LEU ASN TRP GLU LEU GLU LEU PHE ASP          
SEQRES  23 D  519  ALA GLN PRO ALA THR VAL GLY GLY LEU ASP LYS GLU PHE          
SEQRES  24 D  519  ILE PHE ALA GLY ARG ILE ASP ASP LYS LEU CYS SER TRP          
SEQRES  25 D  519  ALA ALA PHE MET ALA LEU LEU HIS ALA LYS ARG ALA PRO          
SEQRES  26 D  519  THR ASP GLY VAL ILE LYS LEU VAL ALA LEU PHE ASP ASP          
SEQRES  27 D  519  GLU GLU ILE GLY SER LEU LEU ARG GLN GLY ALA ARG GLY          
SEQRES  28 D  519  ASN PHE LEU PRO ILE THR ILE GLU ARG ILE LEU GLU SER          
SEQRES  29 D  519  PHE CYS SER SER ASN SER VAL PRO PHE GLY PRO GLY ILE          
SEQRES  30 D  519  LEU GLY GLN THR TYR ALA ARG SER PHE LEU VAL SER SER          
SEQRES  31 D  519  ASP VAL THR HIS ALA ALA HIS PRO ASN PHE THR GLN THR          
SEQRES  32 D  519  ASN LEU PRO GLY HIS SER PRO ARG LEU ASN VAL GLY VAL          
SEQRES  33 D  519  ALA LEU CYS VAL ASP ALA SER ALA HIS MET THR THR ASP          
SEQRES  34 D  519  SER VAL SER MET ALA ILE LEU ASP ARG ILE ALA GLU LEU          
SEQRES  35 D  519  SER GLY CYS VAL ASN GLN ARG HIS MET ILE ARG ASN ASP          
SEQRES  36 D  519  SER ARG SER GLY GLY THR VAL GLY PRO MET LEU SER ALA          
SEQRES  37 D  519  ALA MET GLY VAL LYS ALA ALA ASP VAL GLY ILE PRO GLN          
SEQRES  38 D  519  LEU SER MET HIS SER ILE ARG ALA MET THR GLY SER LEU          
SEQRES  39 D  519  ASP PRO GLY LEU GLY VAL LYS PHE TYR LYS GLY PHE LEU          
SEQRES  40 D  519  ASP PHE TRP GLU GLU VAL ASP LEU GLU TRP SER HIS              
HET     ZN  A 601       1                                                       
HET     ZN  A 602       1                                                       
HET     ZN  E 601       1                                                       
HET     ZN  E 602       1                                                       
HET     ZN  F 601       1                                                       
HET     ZN  F 602       1                                                       
HET     ZN  B 601       1                                                       
HET     ZN  B 602       1                                                       
HET     ZN  C 601       1                                                       
HET     ZN  C 602       1                                                       
HET     ZN  D 601       1                                                       
HET     ZN  D 602       1                                                       
HETNAM      ZN ZINC ION                                                         
FORMUL   7   ZN    12(ZN 2+)                                                    
FORMUL  19  HOH   *279(H2 O)                                                    
HELIX    1 AA1 ARG A   50  HIS A   53  5                                   4    
HELIX    2 AA2 PHE A   54  ASN A   65  1                                  12    
HELIX    3 AA3 THR A   67  ALA A   82  1                                  16    
HELIX    4 AA4 ASN A  166  TRP A  170  5                                   5    
HELIX    5 AA5 ALA A  208  GLY A  212  5                                   5    
HELIX    6 AA6 PHE A  253  GLN A  257  5                                   5    
HELIX    7 AA7 PRO A  258  LEU A  269  1                                  12    
HELIX    8 AA8 ASP A  273  ASP A  275  5                                   3    
HELIX    9 AA9 ARG A  304  ALA A  321  1                                  18    
HELIX   10 AB1 ASN A  352  ASN A  369  1                                  18    
HELIX   11 AB2 GLY A  379  ARG A  384  1                                   6    
HELIX   12 AB3 PHE A  400  ASN A  404  5                                   5    
HELIX   13 AB4 ASP A  429  GLY A  444  1                                  16    
HELIX   14 AB5 MET A  465  GLY A  471  1                                   7    
HELIX   15 AB6 LEU A  494  LEU A  515  1                                  22    
HELIX   16 AB7 ARG E   50  HIS E   53  5                                   4    
HELIX   17 AB8 PHE E   54  ASN E   65  1                                  12    
HELIX   18 AB9 THR E   67  ALA E   82  1                                  16    
HELIX   19 AC1 ASN E  166  TRP E  170  5                                   5    
HELIX   20 AC2 ALA E  208  GLY E  212  5                                   5    
HELIX   21 AC3 PHE E  253  GLN E  257  5                                   5    
HELIX   22 AC4 PRO E  258  GLY E  270  1                                  13    
HELIX   23 AC5 ASP E  273  ASP E  275  5                                   3    
HELIX   24 AC6 ARG E  304  HIS E  320  1                                  17    
HELIX   25 AC7 ASN E  352  ASN E  369  1                                  18    
HELIX   26 AC8 GLY E  379  ARG E  384  1                                   6    
HELIX   27 AC9 PHE E  400  ASN E  404  5                                   5    
HELIX   28 AD1 ASP E  429  GLY E  444  1                                  16    
HELIX   29 AD2 MET E  465  GLY E  471  1                                   7    
HELIX   30 AD3 LEU E  494  LEU E  515  1                                  22    
HELIX   31 AD4 ARG F   50  HIS F   53  5                                   4    
HELIX   32 AD5 PHE F   54  ASN F   65  1                                  12    
HELIX   33 AD6 THR F   67  ALA F   82  1                                  16    
HELIX   34 AD7 ASN F  166  TRP F  170  5                                   5    
HELIX   35 AD8 ALA F  208  GLY F  212  5                                   5    
HELIX   36 AD9 PHE F  253  GLN F  257  5                                   5    
HELIX   37 AE1 PRO F  258  LEU F  269  1                                  12    
HELIX   38 AE2 ASP F  273  ASP F  275  5                                   3    
HELIX   39 AE3 ARG F  304  HIS F  320  1                                  17    
HELIX   40 AE4 ASN F  352  ASN F  369  1                                  18    
HELIX   41 AE5 GLY F  379  ARG F  384  1                                   6    
HELIX   42 AE6 PHE F  400  ASN F  404  5                                   5    
HELIX   43 AE7 ASP F  429  GLY F  444  1                                  16    
HELIX   44 AE8 MET F  465  GLY F  471  1                                   7    
HELIX   45 AE9 LEU F  494  LEU F  515  1                                  22    
HELIX   46 AF1 ARG B   50  HIS B   53  5                                   4    
HELIX   47 AF2 PHE B   54  ASN B   65  1                                  12    
HELIX   48 AF3 THR B   67  ALA B   82  1                                  16    
HELIX   49 AF4 ASN B  166  TRP B  170  5                                   5    
HELIX   50 AF5 ALA B  208  GLY B  212  5                                   5    
HELIX   51 AF6 PHE B  253  GLN B  257  5                                   5    
HELIX   52 AF7 PRO B  258  LEU B  269  1                                  12    
HELIX   53 AF8 ASP B  273  ASP B  275  5                                   3    
HELIX   54 AF9 ARG B  304  HIS B  320  1                                  17    
HELIX   55 AG1 ASP B  338  GLY B  342  5                                   5    
HELIX   56 AG2 ASN B  352  ASN B  369  1                                  18    
HELIX   57 AG3 GLY B  379  ARG B  384  1                                   6    
HELIX   58 AG4 PHE B  400  ASN B  404  5                                   5    
HELIX   59 AG5 ASP B  429  GLY B  444  1                                  16    
HELIX   60 AG6 MET B  465  GLY B  471  1                                   7    
HELIX   61 AG7 LEU B  494  LEU B  515  1                                  22    
HELIX   62 AG8 ARG C   50  HIS C   53  5                                   4    
HELIX   63 AG9 PHE C   54  ASN C   65  1                                  12    
HELIX   64 AH1 THR C   67  ALA C   82  1                                  16    
HELIX   65 AH2 ASN C  166  TRP C  170  5                                   5    
HELIX   66 AH3 ALA C  208  GLY C  212  5                                   5    
HELIX   67 AH4 PHE C  253  GLN C  257  5                                   5    
HELIX   68 AH5 PRO C  258  LEU C  269  1                                  12    
HELIX   69 AH6 ASP C  273  ASP C  275  5                                   3    
HELIX   70 AH7 ARG C  304  HIS C  320  1                                  17    
HELIX   71 AH8 ASN C  352  ASN C  369  1                                  18    
HELIX   72 AH9 GLY C  379  ARG C  384  1                                   6    
HELIX   73 AI1 PHE C  400  ASN C  404  5                                   5    
HELIX   74 AI2 ASP C  429  GLY C  444  1                                  16    
HELIX   75 AI3 MET C  465  GLY C  471  1                                   7    
HELIX   76 AI4 LEU C  494  LEU C  515  1                                  22    
HELIX   77 AI5 ARG D   50  HIS D   53  5                                   4    
HELIX   78 AI6 PHE D   54  ASN D   65  1                                  12    
HELIX   79 AI7 THR D   67  ALA D   82  1                                  16    
HELIX   80 AI8 ASN D  166  TRP D  170  5                                   5    
HELIX   81 AI9 ALA D  208  GLY D  212  5                                   5    
HELIX   82 AJ1 PHE D  253  GLN D  257  5                                   5    
HELIX   83 AJ2 PRO D  258  LEU D  269  1                                  12    
HELIX   84 AJ3 ASP D  273  ASP D  275  5                                   3    
HELIX   85 AJ4 ARG D  304  ALA D  321  1                                  18    
HELIX   86 AJ5 ASN D  352  ASN D  369  1                                  18    
HELIX   87 AJ6 GLY D  379  ARG D  384  1                                   6    
HELIX   88 AJ7 PHE D  400  ASN D  404  5                                   5    
HELIX   89 AJ8 ASP D  429  GLY D  444  1                                  16    
HELIX   90 AJ9 MET D  465  GLY D  471  1                                   7    
HELIX   91 AK1 LEU D  494  LEU D  515  1                                  22    
SHEET    1 AA1 9 VAL A  85  GLU A  86  0                                        
SHEET    2 AA1 9 LYS A 102  ARG A 107  1  O  LYS A 102   N  VAL A  85           
SHEET    3 AA1 9 SER A 111  VAL A 117 -1  O  PHE A 115   N  TYR A 103           
SHEET    4 AA1 9 ILE A 330  PHE A 336 -1  O  LEU A 335   N  ILE A 112           
SHEET    5 AA1 9 ILE A 127  HIS A 133  1  N  ILE A 130   O  ALA A 334           
SHEET    6 AA1 9 PHE A 386  SER A 390  1  O  SER A 390   N  ALA A 131           
SHEET    7 AA1 9 LYS A 473  GLY A 478  1  O  LYS A 473   N  LEU A 387           
SHEET    8 AA1 9 ALA A 417  CYS A 419 -1  N  ALA A 417   O  GLY A 478           
SHEET    9 AA1 9 GLN A 448  HIS A 450  1  O  GLN A 448   N  LEU A 418           
SHEET    1 AA2 5 VAL A 158  GLN A 160  0                                        
SHEET    2 AA2 5 ALA A 139  LEU A 141 -1  N  ARG A 140   O  ALA A 159           
SHEET    3 AA2 5 ILE A 277  ASP A 286 -1  O  LEU A 282   N  LEU A 141           
SHEET    4 AA2 5 LEU A 174  LYS A 183 -1  N  ARG A 179   O  GLU A 281           
SHEET    5 AA2 5 THR A 190  LYS A 196 -1  O  LYS A 193   N  VAL A 180           
SHEET    1 AA3 2 TYR A 153  GLN A 155  0                                        
SHEET    2 AA3 2 VAL A 228  ILE A 231 -1  O  GLY A 230   N  VAL A 154           
SHEET    1 AA4 3 THR A 291  GLY A 293  0                                        
SHEET    2 AA4 3 PHE A 299  ALA A 302 -1  O  PHE A 299   N  GLY A 293           
SHEET    3 AA4 3 ALA A 489  GLY A 492 -1  O  THR A 491   N  ILE A 300           
SHEET    1 AA5 2 THR A 393  HIS A 394  0                                        
SHEET    2 AA5 2 PRO A 480  GLN A 481  1  O  GLN A 481   N  THR A 393           
SHEET    1 AA6 9 VAL E  85  GLU E  86  0                                        
SHEET    2 AA6 9 LYS E 102  ARG E 107  1  O  LYS E 102   N  VAL E  85           
SHEET    3 AA6 9 SER E 111  VAL E 117 -1  O  PHE E 115   N  TYR E 103           
SHEET    4 AA6 9 ILE E 330  PHE E 336 -1  O  LEU E 335   N  ILE E 112           
SHEET    5 AA6 9 ILE E 127  HIS E 133  1  N  ILE E 130   O  ALA E 334           
SHEET    6 AA6 9 PHE E 386  SER E 390  1  O  VAL E 388   N  MET E 129           
SHEET    7 AA6 9 LYS E 473  GLY E 478  1  O  LYS E 473   N  LEU E 387           
SHEET    8 AA6 9 ALA E 417  CYS E 419 -1  N  ALA E 417   O  GLY E 478           
SHEET    9 AA6 9 GLN E 448  HIS E 450  1  O  GLN E 448   N  LEU E 418           
SHEET    1 AA7 6 THR E 190  LYS E 196  0                                        
SHEET    2 AA7 6 LEU E 174  LYS E 183 -1  N  VAL E 180   O  LYS E 193           
SHEET    3 AA7 6 ILE E 277  ASP E 286 -1  O  ASN E 279   N  ILE E 181           
SHEET    4 AA7 6 ALA E 139  VAL E 146 -1  N  LEU E 141   O  LEU E 282           
SHEET    5 AA7 6 TYR E 153  GLN E 160 -1  O  GLY E 157   N  SER E 145           
SHEET    6 AA7 6 VAL E 228  ILE E 231 -1  O  GLY E 230   N  VAL E 154           
SHEET    1 AA8 3 THR E 291  GLY E 293  0                                        
SHEET    2 AA8 3 PHE E 299  ALA E 302 -1  O  PHE E 299   N  GLY E 293           
SHEET    3 AA8 3 ALA E 489  GLY E 492 -1  O  THR E 491   N  ILE E 300           
SHEET    1 AA9 2 THR E 393  HIS E 394  0                                        
SHEET    2 AA9 2 PRO E 480  GLN E 481  1  O  GLN E 481   N  THR E 393           
SHEET    1 AB1 9 VAL F  85  GLU F  86  0                                        
SHEET    2 AB1 9 LYS F 102  ARG F 107  1  O  LYS F 102   N  VAL F  85           
SHEET    3 AB1 9 SER F 111  VAL F 117 -1  O  PHE F 115   N  TYR F 103           
SHEET    4 AB1 9 ILE F 330  PHE F 336 -1  O  LEU F 335   N  ILE F 112           
SHEET    5 AB1 9 ILE F 127  HIS F 133  1  N  GLY F 132   O  PHE F 336           
SHEET    6 AB1 9 PHE F 386  SER F 390  1  O  SER F 390   N  ALA F 131           
SHEET    7 AB1 9 LYS F 473  GLY F 478  1  O  ALA F 475   N  SER F 389           
SHEET    8 AB1 9 ALA F 417  CYS F 419 -1  N  ALA F 417   O  GLY F 478           
SHEET    9 AB1 9 GLN F 448  HIS F 450  1  O  GLN F 448   N  LEU F 418           
SHEET    1 AB2 5 VAL F 158  GLN F 160  0                                        
SHEET    2 AB2 5 ALA F 139  LEU F 141 -1  N  ARG F 140   O  ALA F 159           
SHEET    3 AB2 5 ILE F 277  ASP F 286 -1  O  LEU F 282   N  LEU F 141           
SHEET    4 AB2 5 LEU F 174  LYS F 183 -1  N  ILE F 181   O  ASN F 279           
SHEET    5 AB2 5 THR F 190  LYS F 196 -1  O  LYS F 193   N  VAL F 180           
SHEET    1 AB3 2 TYR F 153  GLN F 155  0                                        
SHEET    2 AB3 2 VAL F 228  ILE F 231 -1  O  ILE F 229   N  VAL F 154           
SHEET    1 AB4 3 THR F 291  GLY F 293  0                                        
SHEET    2 AB4 3 PHE F 299  ALA F 302 -1  O  PHE F 301   N  THR F 291           
SHEET    3 AB4 3 ALA F 489  GLY F 492 -1  O  ALA F 489   N  ALA F 302           
SHEET    1 AB5 2 THR F 393  HIS F 394  0                                        
SHEET    2 AB5 2 PRO F 480  GLN F 481  1  O  GLN F 481   N  THR F 393           
SHEET    1 AB6 9 VAL B  85  GLU B  86  0                                        
SHEET    2 AB6 9 LYS B 102  ARG B 107  1  O  LYS B 102   N  VAL B  85           
SHEET    3 AB6 9 SER B 111  VAL B 117 -1  O  PHE B 115   N  TYR B 103           
SHEET    4 AB6 9 ILE B 330  PHE B 336 -1  O  VAL B 333   N  ALA B 114           
SHEET    5 AB6 9 ILE B 127  HIS B 133  1  N  ILE B 130   O  ALA B 334           
SHEET    6 AB6 9 PHE B 386  SER B 390  1  O  SER B 390   N  ALA B 131           
SHEET    7 AB6 9 LYS B 473  GLY B 478  1  O  ALA B 475   N  SER B 389           
SHEET    8 AB6 9 ALA B 417  CYS B 419 -1  N  ALA B 417   O  GLY B 478           
SHEET    9 AB6 9 GLN B 448  HIS B 450  1  O  GLN B 448   N  LEU B 418           
SHEET    1 AB7 5 VAL B 158  GLN B 160  0                                        
SHEET    2 AB7 5 ALA B 139  LEU B 141 -1  N  ARG B 140   O  ALA B 159           
SHEET    3 AB7 5 ILE B 277  ASP B 286 -1  O  LEU B 282   N  LEU B 141           
SHEET    4 AB7 5 LEU B 174  LYS B 183 -1  N  ARG B 179   O  GLU B 281           
SHEET    5 AB7 5 THR B 190  LYS B 196 -1  O  LYS B 193   N  VAL B 180           
SHEET    1 AB8 2 TYR B 153  GLN B 155  0                                        
SHEET    2 AB8 2 VAL B 228  ILE B 231 -1  O  GLY B 230   N  VAL B 154           
SHEET    1 AB9 3 THR B 291  GLY B 293  0                                        
SHEET    2 AB9 3 PHE B 299  ALA B 302 -1  O  PHE B 301   N  THR B 291           
SHEET    3 AB9 3 ALA B 489  GLY B 492 -1  O  ALA B 489   N  ALA B 302           
SHEET    1 AC1 2 THR B 393  HIS B 394  0                                        
SHEET    2 AC1 2 PRO B 480  GLN B 481  1  O  GLN B 481   N  THR B 393           
SHEET    1 AC2 9 VAL C  85  GLU C  86  0                                        
SHEET    2 AC2 9 LYS C 102  ARG C 107  1  O  LYS C 102   N  VAL C  85           
SHEET    3 AC2 9 SER C 111  VAL C 117 -1  O  PHE C 115   N  TYR C 103           
SHEET    4 AC2 9 ILE C 330  PHE C 336 -1  O  LEU C 335   N  ILE C 112           
SHEET    5 AC2 9 ILE C 127  HIS C 133  1  N  ILE C 130   O  ALA C 334           
SHEET    6 AC2 9 PHE C 386  SER C 390  1  O  SER C 390   N  ALA C 131           
SHEET    7 AC2 9 LYS C 473  GLY C 478  1  O  ALA C 475   N  SER C 389           
SHEET    8 AC2 9 ALA C 417  CYS C 419 -1  N  ALA C 417   O  GLY C 478           
SHEET    9 AC2 9 GLN C 448  HIS C 450  1  O  GLN C 448   N  LEU C 418           
SHEET    1 AC3 6 THR C 190  LYS C 196  0                                        
SHEET    2 AC3 6 LEU C 174  LYS C 183 -1  N  VAL C 180   O  LYS C 193           
SHEET    3 AC3 6 ILE C 277  ASP C 286 -1  O  ASN C 279   N  ILE C 181           
SHEET    4 AC3 6 ALA C 139  VAL C 146 -1  N  LEU C 141   O  LEU C 282           
SHEET    5 AC3 6 TYR C 153  GLN C 160 -1  O  GLY C 157   N  SER C 145           
SHEET    6 AC3 6 VAL C 228  ILE C 231 -1  O  GLY C 230   N  VAL C 154           
SHEET    1 AC4 3 THR C 291  GLY C 293  0                                        
SHEET    2 AC4 3 PHE C 299  ALA C 302 -1  O  PHE C 301   N  THR C 291           
SHEET    3 AC4 3 ALA C 489  GLY C 492 -1  O  THR C 491   N  ILE C 300           
SHEET    1 AC5 2 THR C 393  HIS C 394  0                                        
SHEET    2 AC5 2 PRO C 480  GLN C 481  1  O  GLN C 481   N  THR C 393           
SHEET    1 AC6 9 VAL D  85  GLU D  86  0                                        
SHEET    2 AC6 9 LYS D 102  ARG D 107  1  O  LYS D 102   N  VAL D  85           
SHEET    3 AC6 9 SER D 111  VAL D 117 -1  O  PHE D 115   N  TYR D 103           
SHEET    4 AC6 9 ILE D 330  PHE D 336 -1  O  VAL D 333   N  ALA D 114           
SHEET    5 AC6 9 ILE D 127  HIS D 133  1  N  ALA D 128   O  ILE D 330           
SHEET    6 AC6 9 PHE D 386  SER D 390  1  O  SER D 390   N  ALA D 131           
SHEET    7 AC6 9 LYS D 473  GLY D 478  1  O  LYS D 473   N  LEU D 387           
SHEET    8 AC6 9 ALA D 417  CYS D 419 -1  N  ALA D 417   O  GLY D 478           
SHEET    9 AC6 9 GLN D 448  HIS D 450  1  O  GLN D 448   N  LEU D 418           
SHEET    1 AC7 5 VAL D 158  GLN D 160  0                                        
SHEET    2 AC7 5 ALA D 139  LEU D 141 -1  N  ARG D 140   O  ALA D 159           
SHEET    3 AC7 5 ILE D 277  ASP D 286 -1  O  LEU D 282   N  LEU D 141           
SHEET    4 AC7 5 LEU D 174  LYS D 183 -1  N  ARG D 179   O  GLU D 281           
SHEET    5 AC7 5 THR D 190  LYS D 196 -1  O  LYS D 193   N  VAL D 180           
SHEET    1 AC8 2 TYR D 153  GLN D 155  0                                        
SHEET    2 AC8 2 VAL D 228  ILE D 231 -1  O  ILE D 229   N  VAL D 154           
SHEET    1 AC9 3 THR D 291  GLY D 293  0                                        
SHEET    2 AC9 3 PHE D 299  ALA D 302 -1  O  PHE D 301   N  THR D 291           
SHEET    3 AC9 3 ALA D 489  GLY D 492 -1  O  THR D 491   N  ILE D 300           
SHEET    1 AD1 2 THR D 393  HIS D 394  0                                        
SHEET    2 AD1 2 PRO D 480  GLN D 481  1  O  GLN D 481   N  THR D 393           
LINK         NE2 HIS A 133                ZN    ZN A 602     1555   1555  2.13  
LINK         OD1 ASP A 306                ZN    ZN A 602     1555   1555  1.97  
LINK         OD2 ASP A 306                ZN    ZN A 601     1555   1555  1.81  
LINK         OE1 GLU A 340                ZN    ZN A 601     1555   1555  2.44  
LINK         OE2 GLU A 340                ZN    ZN A 601     1555   1555  1.85  
LINK         OD1 ASP A 391                ZN    ZN A 602     1555   1555  2.04  
LINK         OD2 ASP A 391                ZN    ZN A 602     1555   1555  2.10  
LINK         NE2 HIS A 485                ZN    ZN A 601     1555   1555  1.89  
LINK         NE2 HIS E 133                ZN    ZN E 602     1555   1555  2.12  
LINK         OD1 ASP E 306                ZN    ZN E 602     1555   1555  2.13  
LINK         OD2 ASP E 306                ZN    ZN E 601     1555   1555  1.98  
LINK         OE1 GLU E 340                ZN    ZN E 601     1555   1555  2.51  
LINK         OE2 GLU E 340                ZN    ZN E 601     1555   1555  2.08  
LINK         OE2 GLU E 340                ZN    ZN E 602     1555   1555  2.68  
LINK         OD1 ASP E 391                ZN    ZN E 602     1555   1555  2.07  
LINK         OD2 ASP E 391                ZN    ZN E 602     1555   1555  2.16  
LINK         NE2 HIS E 485                ZN    ZN E 601     1555   1555  2.00  
LINK         NE2 HIS F 133                ZN    ZN F 602     1555   1555  2.12  
LINK         OD1 ASP F 306                ZN    ZN F 602     1555   1555  2.08  
LINK         OD2 ASP F 306                ZN    ZN F 601     1555   1555  1.97  
LINK         OE1 GLU F 340                ZN    ZN F 601     1555   1555  2.24  
LINK         OE2 GLU F 340                ZN    ZN F 601     1555   1555  2.01  
LINK         OD1 ASP F 391                ZN    ZN F 602     1555   1555  2.06  
LINK         OD2 ASP F 391                ZN    ZN F 602     1555   1555  2.15  
LINK         NE2 HIS F 485                ZN    ZN F 601     1555   1555  2.05  
LINK         NE2 HIS B 133                ZN    ZN B 602     1555   1555  2.09  
LINK         OD1 ASP B 306                ZN    ZN B 602     1555   1555  2.12  
LINK         OD2 ASP B 306                ZN    ZN B 601     1555   1555  2.04  
LINK         OE1 GLU B 340                ZN    ZN B 601     1555   1555  2.20  
LINK         OE2 GLU B 340                ZN    ZN B 601     1555   1555  2.13  
LINK         OD1 ASP B 391                ZN    ZN B 602     1555   1555  1.99  
LINK         OD2 ASP B 391                ZN    ZN B 602     1555   1555  2.39  
LINK         NE2 HIS B 485                ZN    ZN B 601     1555   1555  2.13  
LINK         NE2 HIS C 133                ZN    ZN C 602     1555   1555  2.11  
LINK         OD1 ASP C 306                ZN    ZN C 602     1555   1555  2.11  
LINK         OD2 ASP C 306                ZN    ZN C 601     1555   1555  2.10  
LINK         OE1 GLU C 340                ZN    ZN C 601     1555   1555  2.19  
LINK         OE2 GLU C 340                ZN    ZN C 601     1555   1555  2.17  
LINK         OD1 ASP C 391                ZN    ZN C 602     1555   1555  2.06  
LINK         OD2 ASP C 391                ZN    ZN C 602     1555   1555  2.14  
LINK         NE2 HIS C 485                ZN    ZN C 601     1555   1555  2.14  
LINK         NE2 HIS D 133                ZN    ZN D 602     1555   1555  2.14  
LINK         OD1 ASP D 306                ZN    ZN D 602     1555   1555  2.10  
LINK         OD2 ASP D 306                ZN    ZN D 601     1555   1555  2.04  
LINK         OE1 GLU D 340                ZN    ZN D 601     1555   1555  2.13  
LINK         OE2 GLU D 340                ZN    ZN D 601     1555   1555  2.05  
LINK         OD1 ASP D 391                ZN    ZN D 602     1555   1555  2.07  
LINK         OD2 ASP D 391                ZN    ZN D 602     1555   1555  2.15  
LINK         NE2 HIS D 485                ZN    ZN D 601     1555   1555  2.10  
LINK        ZN    ZN D 601                 O   HOH D 748     1555   1555  2.44  
SITE     1 AC1  3 ASP A 306  GLU A 340  HIS A 485                               
SITE     1 AC2  4 HIS A 133  ASP A 306  GLU A 339  ASP A 391                    
SITE     1 AC3  3 ASP E 306  GLU E 340  HIS E 485                               
SITE     1 AC4  4 HIS E 133  ASP E 306  GLU E 340  ASP E 391                    
SITE     1 AC5  3 ASP F 306  GLU F 340  HIS F 485                               
SITE     1 AC6  3 HIS F 133  ASP F 306  ASP F 391                               
SITE     1 AC7  3 ASP B 306  GLU B 340  HIS B 485                               
SITE     1 AC8  4 HIS B 133  ASP B 306  ASP B 307  ASP B 391                    
SITE     1 AC9  4 ASP C 306  GLU C 340  HIS C 485   ZN C 602                    
SITE     1 AD1  5 HIS C 133  ASP C 306  GLU C 339  ASP C 391                    
SITE     2 AD1  5  ZN C 601                                                     
SITE     1 AD2  4 ASP D 306  GLU D 340  HIS D 485  HOH D 748                    
SITE     1 AD3  5 HIS D 133  ASP D 306  GLU D 339  ASP D 391                    
SITE     2 AD3  5 HOH D 748                                                     
CRYST1  121.019  143.894  201.315  90.00  90.00  90.00 P 2 21 21    24          
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      0.008263  0.000000  0.000000        0.00000                         
SCALE2      0.000000  0.006950  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.004967        0.00000                         
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
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