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Database: PDB
Entry: 4BNJ
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HEADER    OXIDOREDUCTASE                          15-MAY-13   4BNJ              
TITLE     CRYSTAL STRUCTURE OF S. AUREUS FABI IN COMPLEX WITH NADP              
TITLE    2 AND 5-METHYL-2-PHENOXYPHENOL                                         
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE [NADPH];            
COMPND   3 CHAIN: A, B, C, D, E, F, G, H;                                       
COMPND   4 SYNONYM: ENR, ENOYL-ACP REDUCTASE;                                   
COMPND   5 EC: 1.3.1.10;                                                        
COMPND   6 ENGINEERED: YES;                                                     
COMPND   7 MUTATION: YES                                                        
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS SUBSP. AUREUS;            
SOURCE   3 ORGANISM_TAXID: 158879;                                              
SOURCE   4 STRAIN: N315;                                                        
SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
SOURCE   6 EXPRESSION_SYSTEM_TAXID: 469008;                                     
SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PETM-11                                   
KEYWDS    SHORT-CHAIN DEHYDROGENASE/REDUCTASE SUPERFAMILY, FATTY ACID           
KEYWDS   2 BIOSYNTHESIS, LIPID SYNTHESIS, SAFABI, OXIDOREDUCTASE                
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    J.SCHIEBEL,A.CHANG,G.R.BOMMINENI,P.J.TONGE,C.KISKER                   
REVDAT   2   03-JUL-13 4BNJ    1       JRNL                                     
REVDAT   1   05-JUN-13 4BNJ    0                                                
JRNL        AUTH   A.CHANG,J.SCHIEBEL,W.YU,G.R.BOMMINENI,P.PAN,M.V.BAXTER,      
JRNL        AUTH 2 A.KHANNA,C.A.SOTRIFFER,C.F.KISKER,P.J.TONGE                  
JRNL        TITL   RATIONAL OPTIMIZATION OF DRUG-TARGET RESIDENCE TIME:         
JRNL        TITL 2 INSIGHTS FROM INHIBITOR BINDING TO THE S. AUREUS FABI        
JRNL        TITL 3 ENZYME-PRODUCT COMPLEX.                                      
JRNL        REF    BIOCHEMISTRY                  V.  52  4217 2013              
JRNL        REFN                   ISSN 0006-2960                               
JRNL        PMID   23697754                                                     
JRNL        DOI    10.1021/BI400413C                                            
REMARK   2                                                                      
REMARK   2 RESOLUTION.    2.40 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : REFMAC 5.5.0109                                      
REMARK   3   AUTHORS     : MURSHUDOV,VAGIN,DODSON                               
REMARK   3                                                                      
REMARK   3    REFINEMENT TARGET : MAXIMUM LIKELIHOOD                            
REMARK   3                                                                      
REMARK   3  DATA USED IN REFINEMENT.                                            
REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) : 2.40                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 49.29                          
REMARK   3   DATA CUTOFF            (SIGMA(F)) : NONE                           
REMARK   3   COMPLETENESS FOR RANGE        (%) : 98.16                          
REMARK   3   NUMBER OF REFLECTIONS             : 102398                         
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   CROSS-VALIDATION METHOD          : THROUGHOUT                      
REMARK   3   FREE R VALUE TEST SET SELECTION  : RANDOM                          
REMARK   3   R VALUE     (WORKING + TEST SET) : 0.14067                         
REMARK   3   R VALUE            (WORKING SET) : 0.13797                         
REMARK   3   FREE R VALUE                     : 0.19171                         
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : 5.1                             
REMARK   3   FREE R VALUE TEST SET COUNT      : 5485                            
REMARK   3                                                                      
REMARK   3  FIT IN THE HIGHEST RESOLUTION BIN.                                  
REMARK   3   TOTAL NUMBER OF BINS USED           : 20                           
REMARK   3   BIN RESOLUTION RANGE HIGH       (A) : 2.400                        
REMARK   3   BIN RESOLUTION RANGE LOW        (A) : 2.462                        
REMARK   3   REFLECTION IN BIN     (WORKING SET) : 7414                         
REMARK   3   BIN COMPLETENESS (WORKING+TEST) (%) : 96.93                        
REMARK   3   BIN R VALUE           (WORKING SET) : 0.204                        
REMARK   3   BIN FREE R VALUE SET COUNT          : 440                          
REMARK   3   BIN FREE R VALUE                    : 0.262                        
REMARK   3                                                                      
REMARK   3  NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.                    
REMARK   3   PROTEIN ATOMS            : 16176                                   
REMARK   3   NUCLEIC ACID ATOMS       : 0                                       
REMARK   3   HETEROGEN ATOMS          : 603                                     
REMARK   3   SOLVENT ATOMS            : 781                                     
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : NULL                           
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : 49.538                         
REMARK   3   OVERALL ANISOTROPIC B VALUE.                                       
REMARK   3    B11 (A**2) : 2.67                                                 
REMARK   3    B22 (A**2) : -2.30                                                
REMARK   3    B33 (A**2) : -0.54                                                
REMARK   3    B12 (A**2) : -0.47                                                
REMARK   3    B13 (A**2) : 0.36                                                 
REMARK   3    B23 (A**2) : -1.10                                                
REMARK   3                                                                      
REMARK   3  ESTIMATED OVERALL COORDINATE ERROR.                                 
REMARK   3   ESU BASED ON R VALUE                            (A): 0.251         
REMARK   3   ESU BASED ON FREE R VALUE                       (A): 0.195         
REMARK   3   ESU BASED ON MAXIMUM LIKELIHOOD                 (A): 0.139         
REMARK   3   ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 12.401        
REMARK   3                                                                      
REMARK   3  CORRELATION COEFFICIENTS.                                           
REMARK   3   CORRELATION COEFFICIENT FO-FC      : 0.973                         
REMARK   3   CORRELATION COEFFICIENT FO-FC FREE : 0.949                         
REMARK   3                                                                      
REMARK   3  RMS DEVIATIONS FROM IDEAL VALUES        COUNT    RMS    WEIGHT      
REMARK   3   BOND LENGTHS REFINED ATOMS        (A): 17062 ; 0.010 ; 0.022       
REMARK   3   BOND LENGTHS OTHERS               (A):  NULL ;  NULL ;  NULL       
REMARK   3   BOND ANGLES REFINED ATOMS   (DEGREES): 23114 ; 1.677 ; 2.008       
REMARK   3   BOND ANGLES OTHERS          (DEGREES):  NULL ;  NULL ;  NULL       
REMARK   3   TORSION ANGLES, PERIOD 1    (DEGREES):  2136 ; 6.804 ; 5.000       
REMARK   3   TORSION ANGLES, PERIOD 2    (DEGREES):   768 ;40.157 ;24.844       
REMARK   3   TORSION ANGLES, PERIOD 3    (DEGREES):  2986 ;16.821 ;15.000       
REMARK   3   TORSION ANGLES, PERIOD 4    (DEGREES):   106 ;18.964 ;15.000       
REMARK   3   CHIRAL-CENTER RESTRAINTS       (A**3):  2590 ; 0.088 ; 0.200       
REMARK   3   GENERAL PLANES REFINED ATOMS      (A): 12786 ; 0.013 ; 0.020       
REMARK   3   GENERAL PLANES OTHERS             (A):  NULL ;  NULL ;  NULL       
REMARK   3   NON-BONDED CONTACTS REFINED ATOMS (A):  NULL ;  NULL ;  NULL       
REMARK   3   NON-BONDED CONTACTS OTHERS        (A):  NULL ;  NULL ;  NULL       
REMARK   3   NON-BONDED TORSION REFINED ATOMS  (A):  NULL ;  NULL ;  NULL       
REMARK   3   NON-BONDED TORSION OTHERS         (A):  NULL ;  NULL ;  NULL       
REMARK   3   H-BOND (X...Y) REFINED ATOMS      (A):  NULL ;  NULL ;  NULL       
REMARK   3   H-BOND (X...Y) OTHERS             (A):  NULL ;  NULL ;  NULL       
REMARK   3   POTENTIAL METAL-ION REFINED ATOMS (A):  NULL ;  NULL ;  NULL       
REMARK   3   POTENTIAL METAL-ION OTHERS        (A):  NULL ;  NULL ;  NULL       
REMARK   3   SYMMETRY VDW REFINED ATOMS        (A):  NULL ;  NULL ;  NULL       
REMARK   3   SYMMETRY VDW OTHERS               (A):  NULL ;  NULL ;  NULL       
REMARK   3   SYMMETRY H-BOND REFINED ATOMS     (A):  NULL ;  NULL ;  NULL       
REMARK   3   SYMMETRY H-BOND OTHERS            (A):  NULL ;  NULL ;  NULL       
REMARK   3   SYMMETRY METAL-ION REFINED ATOMS  (A):  NULL ;  NULL ;  NULL       
REMARK   3   SYMMETRY METAL-ION OTHERS         (A):  NULL ;  NULL ;  NULL       
REMARK   3                                                                      
REMARK   3  ISOTROPIC THERMAL FACTOR RESTRAINTS.     COUNT   RMS    WEIGHT      
REMARK   3   MAIN-CHAIN BOND REFINED ATOMS  (A**2): 10398 ; 1.250 ; 1.500       
REMARK   3   MAIN-CHAIN BOND OTHER ATOMS    (A**2):  NULL ;  NULL ;  NULL       
REMARK   3   MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 16662 ; 2.155 ; 2.000       
REMARK   3   SIDE-CHAIN BOND REFINED ATOMS  (A**2):  6664 ; 3.916 ; 3.000       
REMARK   3   SIDE-CHAIN ANGLE REFINED ATOMS (A**2):  6428 ; 6.054 ; 4.500       
REMARK   3                                                                      
REMARK   3  ANISOTROPIC THERMAL FACTOR RESTRAINTS.   COUNT   RMS    WEIGHT      
REMARK   3   RIGID-BOND RESTRAINTS          (A**2):  NULL ;  NULL ;  NULL       
REMARK   3   SPHERICITY; FREE ATOMS         (A**2):  NULL ;  NULL ;  NULL       
REMARK   3   SPHERICITY; BONDED ATOMS       (A**2):  NULL ;  NULL ;  NULL       
REMARK   3                                                                      
REMARK   3  NCS RESTRAINTS STATISTICS                                           
REMARK   3   NUMBER OF DIFFERENT NCS GROUPS : NULL                              
REMARK   3                                                                      
REMARK   3  TLS DETAILS                                                         
REMARK   3   NUMBER OF TLS GROUPS  : 56                                         
REMARK   3                                                                      
REMARK   3   TLS GROUP :     1                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   A     3        A    29                          
REMARK   3    ORIGIN FOR THE GROUP (A):  12.5634  32.5524  20.1127              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.0896 T22:   0.1953                                     
REMARK   3      T33:   0.0904 T12:   0.0569                                     
REMARK   3      T13:  -0.0522 T23:   0.0501                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.9947 L22:   4.2470                                     
REMARK   3      L33:   2.0724 L12:   1.3261                                     
REMARK   3      L13:  -1.2287 L23:   0.1782                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0811 S12:  -0.4160 S13:  -0.2762                       
REMARK   3      S21:   0.3432 S22:   0.2067 S23:  -0.2260                       
REMARK   3      S31:   0.2606 S32:   0.3677 S33:  -0.1256                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :     2                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   A    30        A    61                          
REMARK   3    ORIGIN FOR THE GROUP (A):   8.7762  28.8473  27.0847              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1458 T22:   0.1958                                     
REMARK   3      T33:   0.0966 T12:   0.0654                                     
REMARK   3      T13:  -0.0152 T23:   0.0914                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   5.6300 L22:   2.8745                                     
REMARK   3      L33:   3.6661 L12:   0.7773                                     
REMARK   3      L13:  -0.6201 L23:  -0.3998                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.1628 S12:  -0.6944 S13:  -0.3134                       
REMARK   3      S21:   0.3794 S22:   0.0066 S23:  -0.0789                       
REMARK   3      S31:   0.2338 S32:   0.3516 S33:   0.1563                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :     3                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   A    62        A   104                          
REMARK   3    ORIGIN FOR THE GROUP (A):  -0.8283  38.5595  22.5277              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1191 T22:   0.1216                                     
REMARK   3      T33:   0.1021 T12:   0.0202                                     
REMARK   3      T13:   0.0101 T23:   0.0533                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.6252 L22:   2.0728                                     
REMARK   3      L33:   1.8776 L12:   0.1738                                     
REMARK   3      L13:   0.2412 L23:   0.3689                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0385 S12:  -0.3272 S13:   0.0161                       
REMARK   3      S21:   0.2065 S22:   0.0128 S23:   0.0217                       
REMARK   3      S31:  -0.0600 S32:  -0.0723 S33:   0.0257                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :     4                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   A   105        A   154                          
REMARK   3    ORIGIN FOR THE GROUP (A):  -3.1361  42.1584  11.9556              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1221 T22:   0.0456                                     
REMARK   3      T33:   0.1152 T12:  -0.0063                                     
REMARK   3      T13:   0.0187 T23:   0.0439                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.8902 L22:   0.6363                                     
REMARK   3      L33:   2.2740 L12:  -0.0677                                     
REMARK   3      L13:   0.5776 L23:   0.3934                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0372 S12:  -0.0640 S13:   0.0280                       
REMARK   3      S21:   0.1024 S22:   0.0586 S23:   0.1516                       
REMARK   3      S31:  -0.0551 S32:   0.0617 S33:  -0.0213                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :     5                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   A   155        A   193                          
REMARK   3    ORIGIN FOR THE GROUP (A):   2.8033  43.9232   8.3363              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.0967 T22:   0.0945                                     
REMARK   3      T33:   0.0844 T12:  -0.0049                                     
REMARK   3      T13:   0.0175 T23:   0.0134                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.5252 L22:   3.1314                                     
REMARK   3      L33:   1.0345 L12:   0.6831                                     
REMARK   3      L13:   0.2792 L23:   0.6398                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0697 S12:  -0.0458 S13:   0.0646                       
REMARK   3      S21:   0.0971 S22:   0.0611 S23:   0.0047                       
REMARK   3      S31:  -0.1150 S32:   0.0595 S33:   0.0086                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :     6                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   A   194        A   214                          
REMARK   3    ORIGIN FOR THE GROUP (A):   2.0398  23.5094   1.0492              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1185 T22:   0.1377                                     
REMARK   3      T33:   0.2354 T12:  -0.0534                                     
REMARK   3      T13:  -0.0404 T23:   0.0201                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   8.6922 L22:   4.5938                                     
REMARK   3      L33:  12.5905 L12:  -0.2958                                     
REMARK   3      L13:  -5.9777 L23:   2.9937                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.2165 S12:   0.6795 S13:  -0.3595                       
REMARK   3      S21:   0.1175 S22:   0.1611 S23:  -0.0734                       
REMARK   3      S31:   0.7161 S32:  -1.0308 S33:   0.0554                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :     7                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   A   215        A   256                          
REMARK   3    ORIGIN FOR THE GROUP (A):  13.5880  35.8224   4.1413              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1062 T22:   0.1651                                     
REMARK   3      T33:   0.1848 T12:  -0.0111                                     
REMARK   3      T13:  -0.0145 T23:   0.0096                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.9785 L22:   1.0810                                     
REMARK   3      L33:   0.4140 L12:   0.0388                                     
REMARK   3      L13:  -0.8228 L23:  -0.2145                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0525 S12:  -0.1273 S13:  -0.1730                       
REMARK   3      S21:  -0.0671 S22:   0.0253 S23:  -0.1058                       
REMARK   3      S31:   0.0227 S32:   0.0867 S33:   0.0273                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :     8                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   B     3        B    29                          
REMARK   3    ORIGIN FOR THE GROUP (A): -23.0155  58.0639 -11.3655              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1342 T22:   0.1625                                     
REMARK   3      T33:   0.1404 T12:   0.1173                                     
REMARK   3      T13:  -0.0315 T23:   0.0136                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.7546 L22:   4.1474                                     
REMARK   3      L33:   3.6698 L12:  -0.4892                                     
REMARK   3      L13:  -0.5986 L23:   0.3946                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0233 S12:   0.2721 S13:   0.1994                       
REMARK   3      S21:  -0.3230 S22:  -0.0337 S23:   0.2449                       
REMARK   3      S31:  -0.4941 S32:  -0.4229 S33:   0.0104                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :     9                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   B    30        B    61                          
REMARK   3    ORIGIN FOR THE GROUP (A): -30.1098  60.3403  -7.0547              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1388 T22:   0.2674                                     
REMARK   3      T33:   0.2265 T12:   0.1855                                     
REMARK   3      T13:  -0.0404 T23:  -0.0157                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.0402 L22:   4.0070                                     
REMARK   3      L33:   8.6116 L12:  -0.0412                                     
REMARK   3      L13:   0.8185 L23:  -0.3449                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.1155 S12:   0.2081 S13:   0.1354                       
REMARK   3      S21:  -0.1398 S22:   0.0023 S23:   0.3708                       
REMARK   3      S31:  -0.6635 S32:  -0.7785 S33:  -0.1178                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    10                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   B    62        B   104                          
REMARK   3    ORIGIN FOR THE GROUP (A): -24.4418  50.0323   0.9130              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.0679 T22:   0.1168                                     
REMARK   3      T33:   0.1660 T12:   0.0839                                     
REMARK   3      T13:   0.0044 T23:  -0.0003                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.3192 L22:   1.6909                                     
REMARK   3      L33:   4.5627 L12:   0.0670                                     
REMARK   3      L13:   1.1678 L23:   1.1121                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0336 S12:  -0.0423 S13:   0.0619                       
REMARK   3      S21:  -0.0313 S22:  -0.1099 S23:   0.2761                       
REMARK   3      S31:  -0.1797 S32:  -0.4501 S33:   0.0763                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    11                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   B   105        B   154                          
REMARK   3    ORIGIN FOR THE GROUP (A): -13.2530  47.7614   2.5080              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.0561 T22:   0.0549                                     
REMARK   3      T33:   0.1278 T12:   0.0477                                     
REMARK   3      T13:   0.0228 T23:   0.0041                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.2946 L22:   0.7620                                     
REMARK   3      L33:   2.8241 L12:   0.1364                                     
REMARK   3      L13:   1.0462 L23:   0.0517                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0624 S12:  -0.0240 S13:  -0.0590                       
REMARK   3      S21:   0.0575 S22:  -0.0130 S23:   0.0960                       
REMARK   3      S31:  -0.1073 S32:  -0.2477 S33:  -0.0494                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    12                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   B   155        B   193                          
REMARK   3    ORIGIN FOR THE GROUP (A):  -9.6675  47.2646  -3.3691              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1025 T22:   0.0760                                     
REMARK   3      T33:   0.1083 T12:   0.0154                                     
REMARK   3      T13:   0.0032 T23:   0.0156                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.0188 L22:   1.2818                                     
REMARK   3      L33:   1.9231 L12:  -0.9405                                     
REMARK   3      L13:  -0.4506 L23:   0.4872                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0204 S12:   0.0166 S13:  -0.0169                       
REMARK   3      S21:  -0.0812 S22:  -0.0632 S23:   0.1304                       
REMARK   3      S31:  -0.1665 S32:  -0.0945 S33:   0.0428                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    13                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   B   194        B   214                          
REMARK   3    ORIGIN FOR THE GROUP (A):  -4.7927  67.9889  -0.1421              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3941 T22:   0.1411                                     
REMARK   3      T33:   0.2463 T12:   0.0725                                     
REMARK   3      T13:   0.0072 T23:  -0.0613                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:  15.5039 L22:   3.7149                                     
REMARK   3      L33:   8.5372 L12:   3.6638                                     
REMARK   3      L13:  -5.3444 L23:  -0.5342                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.2698 S12:  -1.2734 S13:   0.7858                       
REMARK   3      S21:   0.0560 S22:  -0.1137 S23:   0.1886                       
REMARK   3      S31:  -0.6357 S32:   0.4322 S33:  -0.1560                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    14                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   B   215        B   256                          
REMARK   3    ORIGIN FOR THE GROUP (A):  -6.7632  56.6659 -13.0389              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1563 T22:   0.0968                                     
REMARK   3      T33:   0.0640 T12:   0.0535                                     
REMARK   3      T13:   0.0016 T23:   0.0149                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   0.9813 L22:   2.0842                                     
REMARK   3      L33:   1.4374 L12:   0.2393                                     
REMARK   3      L13:  -0.5149 L23:  -0.0499                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0628 S12:   0.0285 S13:   0.0628                       
REMARK   3      S21:  -0.0980 S22:  -0.0107 S23:  -0.0168                       
REMARK   3      S31:  -0.2387 S32:  -0.1069 S33:  -0.0522                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    15                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   C     3        C    29                          
REMARK   3    ORIGIN FOR THE GROUP (A):  -4.7740  50.1625 -34.5203              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2154 T22:   0.2123                                     
REMARK   3      T33:   0.0484 T12:   0.0618                                     
REMARK   3      T13:  -0.0284 T23:   0.0325                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.9885 L22:   3.6036                                     
REMARK   3      L33:   2.1862 L12:   0.9002                                     
REMARK   3      L13:  -0.8237 L23:   1.4351                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0592 S12:   0.4347 S13:   0.0181                       
REMARK   3      S21:  -0.0971 S22:  -0.0200 S23:   0.1960                       
REMARK   3      S31:  -0.2135 S32:  -0.2255 S33:  -0.0392                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    16                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   C    30        C    61                          
REMARK   3    ORIGIN FOR THE GROUP (A):  -1.4983  49.7812 -42.6191              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2865 T22:   0.2824                                     
REMARK   3      T33:   0.0124 T12:   0.0193                                     
REMARK   3      T13:  -0.0120 T23:   0.0535                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   6.6548 L22:   5.6101                                     
REMARK   3      L33:   2.1636 L12:  -2.5192                                     
REMARK   3      L13:  -0.5461 L23:   2.2643                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.1075 S12:   0.6155 S13:   0.0736                       
REMARK   3      S21:  -0.6771 S22:  -0.0675 S23:   0.0906                       
REMARK   3      S31:  -0.4765 S32:  -0.3750 S33:  -0.0399                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    17                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   C    62        C   104                          
REMARK   3    ORIGIN FOR THE GROUP (A):  10.0386  52.8280 -34.8794              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1949 T22:   0.1702                                     
REMARK   3      T33:   0.0387 T12:  -0.0348                                     
REMARK   3      T13:   0.0529 T23:   0.0407                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.4840 L22:   2.2917                                     
REMARK   3      L33:   2.6984 L12:  -0.3375                                     
REMARK   3      L13:   0.8865 L23:  -0.0341                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0334 S12:   0.2983 S13:   0.1601                       
REMARK   3      S21:  -0.2836 S22:   0.0525 S23:  -0.1477                       
REMARK   3      S31:  -0.2618 S32:   0.2323 S33:  -0.0191                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    18                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   C   105        C   154                          
REMARK   3    ORIGIN FOR THE GROUP (A):  12.0720  49.5630 -23.9752              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1543 T22:   0.1111                                     
REMARK   3      T33:   0.0403 T12:  -0.0400                                     
REMARK   3      T13:   0.0224 T23:  -0.0260                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.7251 L22:   2.1882                                     
REMARK   3      L33:   1.8566 L12:  -0.8006                                     
REMARK   3      L13:   0.3413 L23:  -1.0988                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0125 S12:   0.1452 S13:   0.1303                       
REMARK   3      S21:  -0.1486 S22:   0.1137 S23:  -0.0826                       
REMARK   3      S31:  -0.2506 S32:   0.0854 S33:  -0.1261                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    19                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   C   155        C   193                          
REMARK   3    ORIGIN FOR THE GROUP (A):   7.0191  50.6322 -19.6766              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1550 T22:   0.0885                                     
REMARK   3      T33:   0.0641 T12:  -0.0199                                     
REMARK   3      T13:   0.0303 T23:   0.0169                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.0167 L22:   1.5559                                     
REMARK   3      L33:   1.3969 L12:  -0.1703                                     
REMARK   3      L13:  -0.0072 L23:   1.3773                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0526 S12:   0.0493 S13:  -0.0354                       
REMARK   3      S21:  -0.2331 S22:   0.0332 S23:  -0.1186                       
REMARK   3      S31:  -0.2197 S32:  -0.0495 S33:  -0.0858                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    20                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   C   194        C   214                          
REMARK   3    ORIGIN FOR THE GROUP (A):   1.1874  30.3784 -23.6906              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1828 T22:   0.0841                                     
REMARK   3      T33:   0.1468 T12:   0.0437                                     
REMARK   3      T13:  -0.0193 T23:  -0.0639                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   8.4252 L22:   5.9679                                     
REMARK   3      L33:   9.2545 L12:   1.9039                                     
REMARK   3      L13:  -4.1990 L23:  -3.7944                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.3241 S12:   0.0241 S13:  -0.6654                       
REMARK   3      S21:  -0.2478 S22:  -0.1415 S23:  -0.2005                       
REMARK   3      S31:   0.6549 S32:   0.4068 S33:   0.4656                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    21                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   C   215        C   256                          
REMARK   3    ORIGIN FOR THE GROUP (A):  -5.8768  45.4305 -19.2596              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1063 T22:   0.1028                                     
REMARK   3      T33:   0.0400 T12:   0.0375                                     
REMARK   3      T13:  -0.0073 T23:  -0.0075                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.9528 L22:   2.0530                                     
REMARK   3      L33:   1.2124 L12:   0.1895                                     
REMARK   3      L13:  -0.4698 L23:   0.6070                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0096 S12:   0.2030 S13:  -0.0153                       
REMARK   3      S21:  -0.0310 S22:  -0.0820 S23:   0.0516                       
REMARK   3      S31:  -0.0845 S32:  -0.1351 S33:   0.0723                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    22                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   D     3        D    29                          
REMARK   3    ORIGIN FOR THE GROUP (A):  34.1068  45.3242   2.3090              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1140 T22:   0.3667                                     
REMARK   3      T33:   0.2093 T12:  -0.0150                                     
REMARK   3      T13:  -0.0679 T23:  -0.0820                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.5052 L22:   1.7381                                     
REMARK   3      L33:   3.6436 L12:   1.0420                                     
REMARK   3      L13:  -0.3205 L23:   1.6536                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0131 S12:  -0.0670 S13:  -0.0170                       
REMARK   3      S21:   0.0267 S22:   0.3715 S23:  -0.2690                       
REMARK   3      S31:  -0.0793 S32:   0.7671 S33:  -0.3846                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    23                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   D    30        D    61                          
REMARK   3    ORIGIN FOR THE GROUP (A):  42.0140  46.7530  -0.9668              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.0452 T22:   0.4268                                     
REMARK   3      T33:   0.3028 T12:  -0.0552                                     
REMARK   3      T13:  -0.0580 T23:  -0.1320                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   5.1446 L22:   0.8648                                     
REMARK   3      L33:   7.2488 L12:   1.0776                                     
REMARK   3      L13:   1.8178 L23:   1.1038                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0150 S12:  -0.1802 S13:   0.2463                       
REMARK   3      S21:   0.0477 S22:   0.1397 S23:  -0.2755                       
REMARK   3      S31:  -0.4188 S32:   1.1165 S33:  -0.1247                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    24                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   D    62        D   104                          
REMARK   3    ORIGIN FOR THE GROUP (A):  34.0882  44.4097 -12.3868              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.0328 T22:   0.2975                                     
REMARK   3      T33:   0.1794 T12:  -0.0856                                     
REMARK   3      T13:   0.0232 T23:  -0.1175                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.0720 L22:   4.0853                                     
REMARK   3      L33:   2.9113 L12:  -1.5132                                     
REMARK   3      L13:   1.0520 L23:  -1.4780                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0709 S12:   0.0877 S13:   0.0832                       
REMARK   3      S21:   0.0025 S22:   0.1471 S23:  -0.3493                       
REMARK   3      S31:  -0.0917 S32:   0.5461 S33:  -0.0762                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    25                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   D   105        D   154                          
REMARK   3    ORIGIN FOR THE GROUP (A):  22.9901  46.4170 -13.9960              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.0678 T22:   0.1515                                     
REMARK   3      T33:   0.0970 T12:  -0.0853                                     
REMARK   3      T13:   0.0209 T23:  -0.0418                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.7192 L22:   1.6880                                     
REMARK   3      L33:   1.9561 L12:  -0.4337                                     
REMARK   3      L13:  -0.0666 L23:  -0.7210                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0841 S12:   0.0624 S13:   0.0294                       
REMARK   3      S21:  -0.1878 S22:   0.0891 S23:  -0.1616                       
REMARK   3      S31:  -0.0984 S32:   0.2840 S33:  -0.1731                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    26                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   D   155        D   193                          
REMARK   3    ORIGIN FOR THE GROUP (A):  18.9388  44.2697  -8.8740              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.0793 T22:   0.1706                                     
REMARK   3      T33:   0.1249 T12:  -0.0296                                     
REMARK   3      T13:  -0.0071 T23:  -0.0220                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.4425 L22:   0.4411                                     
REMARK   3      L33:   1.7288 L12:   0.7453                                     
REMARK   3      L13:  -0.0726 L23:  -0.2960                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0536 S12:   0.0224 S13:   0.0196                       
REMARK   3      S21:   0.0556 S22:   0.0095 S23:  -0.0147                       
REMARK   3      S31:  -0.1015 S32:   0.2208 S33:  -0.0631                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    27                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   D   194        D   214                          
REMARK   3    ORIGIN FOR THE GROUP (A):  21.1986  64.0172  -1.1597              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3400 T22:   0.2328                                     
REMARK   3      T33:   0.4053 T12:  -0.1458                                     
REMARK   3      T13:  -0.0344 T23:  -0.0581                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   9.1189 L22:   2.6816                                     
REMARK   3      L33:   8.6415 L12:  -0.6108                                     
REMARK   3      L13:  -6.4768 L23:  -2.0299                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.4087 S12:   0.3124 S13:   1.1696                       
REMARK   3      S21:   0.0151 S22:   0.2243 S23:  -0.2735                       
REMARK   3      S31:  -0.6830 S32:   0.0033 S33:  -0.6330                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    28                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   D   215        D   256                          
REMARK   3    ORIGIN FOR THE GROUP (A):  18.4298  47.7895   4.4204              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.0571 T22:   0.1440                                     
REMARK   3      T33:   0.0917 T12:  -0.0659                                     
REMARK   3      T13:  -0.0022 T23:  -0.0206                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   0.8486 L22:   3.0345                                     
REMARK   3      L33:   1.6443 L12:   0.0778                                     
REMARK   3      L13:  -0.3933 L23:   0.9451                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0057 S12:  -0.0610 S13:   0.0157                       
REMARK   3      S21:   0.1999 S22:   0.0709 S23:  -0.0953                       
REMARK   3      S31:  -0.1187 S32:   0.2497 S33:  -0.0765                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    29                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   E     3        E    29                          
REMARK   3    ORIGIN FOR THE GROUP (A): -32.4889  17.6552   8.4972              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1300 T22:   0.1164                                     
REMARK   3      T33:   0.1261 T12:   0.0396                                     
REMARK   3      T13:  -0.0705 T23:   0.0032                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.0676 L22:   3.3475                                     
REMARK   3      L33:   3.9535 L12:   0.9053                                     
REMARK   3      L13:  -1.0817 L23:  -0.0569                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0161 S12:   0.2467 S13:   0.0449                       
REMARK   3      S21:  -0.2811 S22:  -0.1391 S23:   0.3166                       
REMARK   3      S31:  -0.3117 S32:  -0.2946 S33:   0.1230                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    30                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   E    30        E    61                          
REMARK   3    ORIGIN FOR THE GROUP (A): -31.7048  26.2895   7.1218              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1837 T22:   0.0672                                     
REMARK   3      T33:   0.1394 T12:   0.0535                                     
REMARK   3      T13:  -0.0790 T23:   0.0463                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.8495 L22:   5.9440                                     
REMARK   3      L33:   3.9499 L12:   2.3975                                     
REMARK   3      L13:   1.4801 L23:   0.4576                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0534 S12:   0.2886 S13:   0.3847                       
REMARK   3      S21:  -0.5953 S22:  -0.0838 S23:   0.4441                       
REMARK   3      S31:  -0.5109 S32:  -0.1854 S33:   0.1372                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    31                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   E    62        E   104                          
REMARK   3    ORIGIN FOR THE GROUP (A): -27.3644  24.6308  20.7136              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1509 T22:   0.0951                                     
REMARK   3      T33:   0.1296 T12:   0.0102                                     
REMARK   3      T13:  -0.0096 T23:   0.0270                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.8968 L22:   1.5733                                     
REMARK   3      L33:   1.6404 L12:   0.0690                                     
REMARK   3      L13:  -0.2159 L23:  -0.2767                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0284 S12:  -0.0360 S13:   0.2821                       
REMARK   3      S21:   0.0145 S22:  -0.0064 S23:   0.1467                       
REMARK   3      S31:  -0.2920 S32:  -0.1276 S33:   0.0348                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    32                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   E   105        E   154                          
REMARK   3    ORIGIN FOR THE GROUP (A): -21.3042  15.4907  25.1585              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1402 T22:   0.0897                                     
REMARK   3      T33:   0.0835 T12:  -0.0329                                     
REMARK   3      T13:   0.0350 T23:   0.0366                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.9334 L22:   1.5025                                     
REMARK   3      L33:   0.8786 L12:  -0.5428                                     
REMARK   3      L13:   1.0082 L23:   0.0844                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0038 S12:  -0.1093 S13:  -0.0438                       
REMARK   3      S21:  -0.0333 S22:  -0.0597 S23:   0.0718                       
REMARK   3      S31:  -0.1216 S32:  -0.0287 S33:   0.0559                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    33                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   E   155        E   193                          
REMARK   3    ORIGIN FOR THE GROUP (A): -24.4090   9.5088  23.7188              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.0924 T22:   0.0913                                     
REMARK   3      T33:   0.0890 T12:  -0.0084                                     
REMARK   3      T13:   0.0146 T23:   0.0000                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.5469 L22:   2.0784                                     
REMARK   3      L33:   1.0634 L12:   0.4372                                     
REMARK   3      L13:  -0.0902 L23:  -0.2411                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0168 S12:  -0.0768 S13:  -0.1278                       
REMARK   3      S21:  -0.0142 S22:  -0.0211 S23:   0.1334                       
REMARK   3      S31:  -0.0208 S32:  -0.0410 S33:   0.0379                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    34                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   E   194        E   214                          
REMARK   3    ORIGIN FOR THE GROUP (A): -10.5241   9.0663   7.3051              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2150 T22:   0.2926                                     
REMARK   3      T33:   0.3401 T12:  -0.0400                                     
REMARK   3      T13:  -0.0014 T23:   0.0801                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   6.7290 L22:   9.0276                                     
REMARK   3      L33:   3.6177 L12:  -2.3863                                     
REMARK   3      L13:  -0.2942 L23:   4.2073                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.3251 S12:   0.2808 S13:   0.0739                       
REMARK   3      S21:  -0.1742 S22:   0.0606 S23:  -1.3537                       
REMARK   3      S31:  -0.4429 S32:   0.1557 S33:  -0.3857                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    35                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   E   215        E   256                          
REMARK   3    ORIGIN FOR THE GROUP (A): -26.2338   2.9869  11.5673              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.0740 T22:   0.0745                                     
REMARK   3      T33:   0.1290 T12:  -0.0317                                     
REMARK   3      T13:  -0.0145 T23:   0.0142                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.0664 L22:   1.6183                                     
REMARK   3      L33:   2.4003 L12:   0.3150                                     
REMARK   3      L13:  -0.0073 L23:   0.6685                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0539 S12:   0.1181 S13:  -0.1675                       
REMARK   3      S21:  -0.1276 S22:  -0.0361 S23:   0.1023                       
REMARK   3      S31:   0.0447 S32:  -0.0469 S33:   0.0900                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    36                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   F     3        F    29                          
REMARK   3    ORIGIN FOR THE GROUP (A):  -2.5190   1.2634  50.2708              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2296 T22:   0.1940                                     
REMARK   3      T33:   0.0538 T12:   0.0467                                     
REMARK   3      T13:  -0.0300 T23:   0.0136                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.1916 L22:   2.8892                                     
REMARK   3      L33:   2.7735 L12:   0.9166                                     
REMARK   3      L13:   0.0834 L23:  -0.2227                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.1431 S12:  -0.2611 S13:  -0.1414                       
REMARK   3      S21:   0.3772 S22:   0.1423 S23:  -0.2294                       
REMARK   3      S31:   0.1891 S32:   0.0568 S33:   0.0008                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    37                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   F    30        F    61                          
REMARK   3    ORIGIN FOR THE GROUP (A):  -0.8131   7.7157  55.8023              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2082 T22:   0.2127                                     
REMARK   3      T33:   0.0544 T12:  -0.0105                                     
REMARK   3      T13:  -0.0940 T23:  -0.0322                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   5.6360 L22:   6.6185                                     
REMARK   3      L33:   3.5111 L12:  -3.5625                                     
REMARK   3      L13:  -0.8129 L23:   0.5501                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0467 S12:  -0.4720 S13:   0.1644                       
REMARK   3      S21:   0.6151 S22:   0.1100 S23:  -0.3009                       
REMARK   3      S31:   0.2257 S32:   0.3334 S33:  -0.0633                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    38                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   F    62        F   104                          
REMARK   3    ORIGIN FOR THE GROUP (A):  -4.0433  14.5030  43.8210              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1759 T22:   0.1336                                     
REMARK   3      T33:   0.0314 T12:  -0.0360                                     
REMARK   3      T13:  -0.0349 T23:  -0.0088                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.2020 L22:   1.9729                                     
REMARK   3      L33:   1.7045 L12:  -1.1626                                     
REMARK   3      L13:  -0.2498 L23:   0.2747                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0433 S12:  -0.1916 S13:   0.2107                       
REMARK   3      S21:   0.1961 S22:   0.0673 S23:  -0.2152                       
REMARK   3      S31:  -0.1276 S32:   0.1896 S33:  -0.0240                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    39                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   F   105        F   154                          
REMARK   3    ORIGIN FOR THE GROUP (A): -11.7316  11.0335  35.7936              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1282 T22:   0.0940                                     
REMARK   3      T33:   0.0196 T12:  -0.0223                                     
REMARK   3      T13:   0.0289 T23:  -0.0054                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.4651 L22:   1.4483                                     
REMARK   3      L33:   1.1622 L12:  -0.7162                                     
REMARK   3      L13:   0.7007 L23:   0.0118                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0714 S12:   0.0208 S13:   0.0980                       
REMARK   3      S21:   0.1205 S22:  -0.0365 S23:  -0.0900                       
REMARK   3      S31:  -0.1050 S32:   0.0402 S33:  -0.0350                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    40                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   F   155        F   193                          
REMARK   3    ORIGIN FOR THE GROUP (A): -11.1320   4.5441  33.7286              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1266 T22:   0.0904                                     
REMARK   3      T33:   0.0812 T12:  -0.0258                                     
REMARK   3      T13:   0.0201 T23:   0.0269                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.4765 L22:   1.4914                                     
REMARK   3      L33:   2.3256 L12:  -0.5164                                     
REMARK   3      L13:  -0.3033 L23:   0.5401                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0101 S12:  -0.0181 S13:   0.1112                       
REMARK   3      S21:   0.1439 S22:   0.0231 S23:  -0.0274                       
REMARK   3      S31:   0.0790 S32:   0.0271 S33:  -0.0130                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    41                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   F   194        F   214                          
REMARK   3    ORIGIN FOR THE GROUP (A): -25.8450  -0.1093  48.6605              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3314 T22:   0.3465                                     
REMARK   3      T33:   0.2369 T12:   0.0354                                     
REMARK   3      T13:   0.1050 T23:  -0.0041                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   8.4109 L22:  11.8997                                     
REMARK   3      L33:   2.4210 L12:   3.9368                                     
REMARK   3      L13:   0.8358 L23:   2.5754                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0966 S12:  -0.5258 S13:   0.6501                       
REMARK   3      S21:   0.4870 S22:  -0.4229 S23:   1.4018                       
REMARK   3      S31:  -0.0903 S32:  -0.3081 S33:   0.5195                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    42                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   F   215        F   256                          
REMARK   3    ORIGIN FOR THE GROUP (A): -12.5093  -7.4680  40.7334              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1644 T22:   0.1002                                     
REMARK   3      T33:   0.0680 T12:   0.0096                                     
REMARK   3      T13:   0.0255 T23:   0.0124                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   0.9552 L22:   1.9966                                     
REMARK   3      L33:   1.4690 L12:  -0.1036                                     
REMARK   3      L13:  -0.1880 L23:   0.2643                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0628 S12:  -0.0970 S13:  -0.0863                       
REMARK   3      S21:   0.2687 S22:  -0.0127 S23:   0.0645                       
REMARK   3      S31:   0.1637 S32:   0.0198 S33:   0.0755                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    43                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   G     3        G    29                          
REMARK   3    ORIGIN FOR THE GROUP (A):   0.6534 -24.9880  34.6486              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2207 T22:   0.0755                                     
REMARK   3      T33:   0.1777 T12:   0.0898                                     
REMARK   3      T13:  -0.0211 T23:   0.0210                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.7453 L22:   1.3023                                     
REMARK   3      L33:   3.3106 L12:   0.2804                                     
REMARK   3      L13:  -0.3890 L23:   0.1984                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0944 S12:  -0.0779 S13:  -0.2366                       
REMARK   3      S21:   0.2435 S22:   0.0922 S23:  -0.2748                       
REMARK   3      S31:   0.0871 S32:   0.3107 S33:  -0.1866                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    44                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   G    30        G    61                          
REMARK   3    ORIGIN FOR THE GROUP (A):   2.9779 -33.1097  33.1567              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.3258 T22:   0.1652                                     
REMARK   3      T33:   0.3745 T12:   0.0963                                     
REMARK   3      T13:  -0.1005 T23:   0.0221                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.3945 L22:   1.9702                                     
REMARK   3      L33:   5.6616 L12:  -1.7626                                     
REMARK   3      L13:  -0.9638 L23:   1.5324                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0093 S12:  -0.0846 S13:  -0.2881                       
REMARK   3      S21:   0.4149 S22:   0.2092 S23:  -0.3650                       
REMARK   3      S31:   0.6000 S32:   0.4166 S33:  -0.1999                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    45                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   G    62        G   104                          
REMARK   3    ORIGIN FOR THE GROUP (A): -10.8114 -32.5764  29.1781              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.2149 T22:   0.0109                                     
REMARK   3      T33:   0.1897 T12:   0.0318                                     
REMARK   3      T13:  -0.0063 T23:   0.0052                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.6090 L22:   1.3090                                     
REMARK   3      L33:   4.5589 L12:  -0.5534                                     
REMARK   3      L13:   0.1508 L23:  -0.4203                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0829 S12:  -0.0845 S13:  -0.4274                       
REMARK   3      S21:   0.1220 S22:   0.0294 S23:   0.0816                       
REMARK   3      S31:   0.5005 S32:   0.0244 S33:  -0.1123                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    46                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   G   105        G   154                          
REMARK   3    ORIGIN FOR THE GROUP (A): -16.7489 -23.7791  24.8941              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1133 T22:   0.0485                                     
REMARK   3      T33:   0.1600 T12:   0.0156                                     
REMARK   3      T13:   0.0465 T23:  -0.0067                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.1361 L22:   1.4832                                     
REMARK   3      L33:   2.2347 L12:  -0.1399                                     
REMARK   3      L13:   0.8399 L23:  -0.2343                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0174 S12:  -0.0173 S13:  -0.2144                       
REMARK   3      S21:   0.1771 S22:  -0.0402 S23:   0.1694                       
REMARK   3      S31:   0.2410 S32:  -0.1217 S33:   0.0577                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    47                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   G   155        G   193                          
REMARK   3    ORIGIN FOR THE GROUP (A): -15.8906 -17.9169  28.1490              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1386 T22:   0.0463                                     
REMARK   3      T33:   0.1435 T12:   0.0158                                     
REMARK   3      T13:   0.0436 T23:   0.0324                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.2362 L22:   0.8455                                     
REMARK   3      L33:   1.8382 L12:  -0.1165                                     
REMARK   3      L13:   0.0030 L23:   0.6097                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0435 S12:  -0.0139 S13:  -0.1440                       
REMARK   3      S21:   0.1214 S22:  -0.0200 S23:   0.0131                       
REMARK   3      S31:   0.1686 S32:  -0.0282 S33:   0.0634                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    48                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   G   194        G   214                          
REMARK   3    ORIGIN FOR THE GROUP (A):  -0.1025 -13.4637  14.3636              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1691 T22:   0.2951                                     
REMARK   3      T33:   0.1933 T12:   0.0735                                     
REMARK   3      T13:   0.0610 T23:  -0.0235                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.9627 L22:  19.9621                                     
REMARK   3      L33:   6.6081 L12:   4.1396                                     
REMARK   3      L13:  -0.1376 L23:  -2.6157                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.2363 S12:   0.2034 S13:  -0.1860                       
REMARK   3      S21:  -1.5714 S22:   0.2335 S23:  -0.2387                       
REMARK   3      S31:   0.2001 S32:   0.2082 S33:   0.0028                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    49                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   G   215        G   256                          
REMARK   3    ORIGIN FOR THE GROUP (A):  -4.5192 -10.2815  30.9032              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1195 T22:   0.1584                                     
REMARK   3      T33:   0.1585 T12:   0.0384                                     
REMARK   3      T13:   0.0024 T23:  -0.0064                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   0.7981 L22:   1.6957                                     
REMARK   3      L33:   0.7908 L12:   0.2611                                     
REMARK   3      L13:   0.1882 L23:   1.1362                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0842 S12:  -0.0404 S13:  -0.0987                       
REMARK   3      S21:   0.0841 S22:   0.0384 S23:  -0.0730                       
REMARK   3      S31:   0.0633 S32:   0.0706 S33:  -0.1226                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    50                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   H     3        H    29                          
REMARK   3    ORIGIN FOR THE GROUP (A): -44.1535 -10.4434   8.7168              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1591 T22:   0.3539                                     
REMARK   3      T33:   0.3629 T12:  -0.1120                                     
REMARK   3      T13:  -0.0800 T23:  -0.1213                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.2509 L22:   6.2134                                     
REMARK   3      L33:   0.8875 L12:   0.0273                                     
REMARK   3      L13:   0.7233 L23:   1.7560                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0346 S12:   0.0838 S13:  -0.2727                       
REMARK   3      S21:  -0.3660 S22:  -0.2597 S23:   0.8085                       
REMARK   3      S31:   0.0435 S32:  -0.3278 S33:   0.2252                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    51                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   H    30        H    61                          
REMARK   3    ORIGIN FOR THE GROUP (A): -48.9249 -17.6154   6.0440              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1595 T22:   0.3496                                     
REMARK   3      T33:   0.4265 T12:  -0.0812                                     
REMARK   3      T13:  -0.1340 T23:  -0.1523                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   4.9554 L22:   8.8255                                     
REMARK   3      L33:   0.8618 L12:   0.3983                                     
REMARK   3      L13:  -0.1690 L23:   0.1183                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.1283 S12:   0.1084 S13:  -0.1009                       
REMARK   3      S21:  -0.3542 S22:  -0.0158 S23:   0.8760                       
REMARK   3      S31:   0.2574 S32:  -0.4411 S33:   0.1441                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    52                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   H    62        H   104                          
REMARK   3    ORIGIN FOR THE GROUP (A): -36.0073 -22.8369   8.5581              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.0624 T22:   0.0833                                     
REMARK   3      T33:   0.3134 T12:  -0.0299                                     
REMARK   3      T13:  -0.0548 T23:  -0.1087                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   3.8307 L22:   3.2592                                     
REMARK   3      L33:   4.8080 L12:   0.0529                                     
REMARK   3      L13:   0.9227 L23:  -2.7085                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.1646 S12:   0.0890 S13:  -0.4981                       
REMARK   3      S21:  -0.2117 S22:  -0.0728 S23:   0.4961                       
REMARK   3      S31:   0.2620 S32:  -0.2000 S33:  -0.0919                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    53                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   H   105        H   154                          
REMARK   3    ORIGIN FOR THE GROUP (A): -28.1899 -19.3728  16.0821              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.0285 T22:   0.0721                                     
REMARK   3      T33:   0.1836 T12:  -0.0257                                     
REMARK   3      T13:   0.0136 T23:  -0.0500                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.0686 L22:   2.5733                                     
REMARK   3      L33:   1.7332 L12:   0.0422                                     
REMARK   3      L13:   0.7646 L23:  -0.1965                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0439 S12:   0.1107 S13:  -0.2187                       
REMARK   3      S21:  -0.0486 S22:  -0.1215 S23:   0.3421                       
REMARK   3      S31:   0.2015 S32:  -0.0846 S33:   0.0776                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    54                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   H   155        H   193                          
REMARK   3    ORIGIN FOR THE GROUP (A): -26.9367 -12.7855  16.1887              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1427 T22:   0.1359                                     
REMARK   3      T33:   0.1833 T12:  -0.0275                                     
REMARK   3      T13:   0.0102 T23:  -0.0364                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   1.9260 L22:   1.4716                                     
REMARK   3      L33:   0.2611 L12:   0.2829                                     
REMARK   3      L13:  -0.6175 L23:  -0.1626                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:  -0.0636 S12:   0.1333 S13:  -0.1251                       
REMARK   3      S21:  -0.1712 S22:   0.0057 S23:   0.1576                       
REMARK   3      S31:   0.1108 S32:  -0.0820 S33:   0.0578                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    55                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   H   194        H   214                          
REMARK   3    ORIGIN FOR THE GROUP (A): -41.8760 -11.8935  31.8123              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.1864 T22:   0.4306                                     
REMARK   3      T33:   0.4086 T12:  -0.1568                                     
REMARK   3      T13:   0.0530 T23:   0.0686                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.2558 L22:  15.0523                                     
REMARK   3      L33:   7.5185 L12:   2.2369                                     
REMARK   3      L13:  -0.3694 L23:   5.0037                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.3536 S12:  -0.1255 S13:  -0.3839                       
REMARK   3      S21:   1.4375 S22:  -0.4402 S23:   0.7749                       
REMARK   3      S31:   0.6483 S32:  -0.7850 S33:   0.0866                       
REMARK   3                                                                      
REMARK   3   TLS GROUP :    56                                                  
REMARK   3    NUMBER OF COMPONENTS GROUP :    1                                 
REMARK   3    COMPONENTS        C SSSEQI   TO  C SSSEQI                         
REMARK   3    RESIDUE RANGE :   H   215        H   256                          
REMARK   3    ORIGIN FOR THE GROUP (A): -35.3625  -2.0131  19.1176              
REMARK   3    T TENSOR                                                          
REMARK   3      T11:   0.0213 T22:   0.0669                                     
REMARK   3      T33:   0.1814 T12:  -0.0373                                     
REMARK   3      T13:   0.0007 T23:  -0.0151                                     
REMARK   3    L TENSOR                                                          
REMARK   3      L11:   2.0477 L22:   2.3269                                     
REMARK   3      L33:   1.5770 L12:  -0.2430                                     
REMARK   3      L13:  -0.8560 L23:  -0.0061                                     
REMARK   3    S TENSOR                                                          
REMARK   3      S11:   0.0146 S12:   0.0025 S13:  -0.1420                       
REMARK   3      S21:   0.0023 S22:  -0.0239 S23:   0.3441                       
REMARK   3      S31:   0.0355 S32:  -0.0949 S33:   0.0093                       
REMARK   3                                                                      
REMARK   3  BULK SOLVENT MODELLING.                                             
REMARK   3   METHOD USED : BABINET MODEL WITH MASK                              
REMARK   3   PARAMETERS FOR MASK CALCULATION                                    
REMARK   3   VDW PROBE RADIUS   : 1.40                                          
REMARK   3   ION PROBE RADIUS   : 0.80                                          
REMARK   3   SHRINKAGE RADIUS   : 0.80                                          
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE          
REMARK   3   RIDING POSITIONS.                                                  
REMARK   4                                                                      
REMARK   4 4BNJ COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 15-MAY-13.                  
REMARK 100 THE PDBE ID CODE IS EBI-56189.                                       
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : 08-SEP-10                          
REMARK 200  TEMPERATURE           (KELVIN) : 100                                
REMARK 200  PH                             : 6.5                                
REMARK 200  NUMBER OF CRYSTALS USED        : 1                                  
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : Y                                  
REMARK 200  RADIATION SOURCE               : ESRF                               
REMARK 200  BEAMLINE                       : ID29                               
REMARK 200  X-RAY GENERATOR MODEL          : NULL                               
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : M                                  
REMARK 200  WAVELENGTH OR RANGE        (A) : 0.9763                             
REMARK 200  MONOCHROMATOR                  : NULL                               
REMARK 200  OPTICS                         : NULL                               
REMARK 200                                                                      
REMARK 200  DETECTOR TYPE                  : NULL                               
REMARK 200  DETECTOR MANUFACTURER          : NULL                               
REMARK 200  INTENSITY-INTEGRATION SOFTWARE : XDS                                
REMARK 200  DATA SCALING SOFTWARE          : XSCALE                             
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : 107887                             
REMARK 200  RESOLUTION RANGE HIGH      (A) : 2.40                               
REMARK 200  RESOLUTION RANGE LOW       (A) : 50.00                              
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : -3.0                               
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : 98.0                               
REMARK 200  DATA REDUNDANCY                : 3.9                                
REMARK 200  R MERGE                    (I) : 0.01                               
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : 8.70                               
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.40                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : 2.50                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : 96.8                               
REMARK 200  DATA REDUNDANCY IN SHELL       : 3.9                                
REMARK 200  R MERGE FOR SHELL          (I) : 0.57                               
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR SHELL         : 2.30                               
REMARK 200                                                                      
REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH                              
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT        
REMARK 200 SOFTWARE USED: PHASER                                                
REMARK 200 STARTING MODEL: PDB ENTRY 4ALK                                       
REMARK 200                                                                      
REMARK 200 REMARK: NONE                                                         
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 58                                        
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.92                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: 0.1 M NA/K-PHOSPHATE PH 6.5,             
REMARK 280  35% MPD                                                             
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1                              
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290                                                                      
REMARK 290     WHERE NNN -> OPERATOR NUMBER                                     
REMARK 290           MMM -> TRANSLATION VECTOR                                  
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS                            
REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM             
REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY                
REMARK 290 RELATED MOLECULES.                                                   
REMARK 290   SMTRY1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 290                                                                      
REMARK 290 REMARK: NULL                                                         
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1, 2                                                    
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM                
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN                  
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON               
REMARK 300 BURIED SURFACE AREA.                                                 
REMARK 350                                                                      
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN           
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE                
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS          
REMARK 350 GIVEN BELOW.  BOTH NON-CRYSTALLOGRAPHIC AND                          
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.                               
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 1                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC                        
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC                 
REMARK 350 SOFTWARE USED: PISA                                                  
REMARK 350 TOTAL BURIED SURFACE AREA: 21790 ANGSTROM**2                         
REMARK 350 SURFACE AREA OF THE COMPLEX: 32100 ANGSTROM**2                       
REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -83.9 KCAL/MOL                        
REMARK 350 APPLY THE FOLLOWING TO CHAINS: E, F, G, H                            
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                                                                      
REMARK 350 BIOMOLECULE: 2                                                       
REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC                 
REMARK 350 SOFTWARE USED: PISA                                                  
REMARK 350 TOTAL BURIED SURFACE AREA: 21690 ANGSTROM**2                         
REMARK 350 SURFACE AREA OF THE COMPLEX: 32050 ANGSTROM**2                       
REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -83.8 KCAL/MOL                        
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, C, D                            
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 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   -25                                                      
REMARK 465     LYS A   -24                                                      
REMARK 465     HIS A   -23                                                      
REMARK 465     HIS A   -22                                                      
REMARK 465     HIS A   -21                                                      
REMARK 465     HIS A   -20                                                      
REMARK 465     HIS A   -19                                                      
REMARK 465     HIS A   -18                                                      
REMARK 465     PRO A   -17                                                      
REMARK 465     MET A   -16                                                      
REMARK 465     SER A   -15                                                      
REMARK 465     ASP A   -14                                                      
REMARK 465     TYR A   -13                                                      
REMARK 465     ASP A   -12                                                      
REMARK 465     ILE A   -11                                                      
REMARK 465     PRO A   -10                                                      
REMARK 465     THR A    -9                                                      
REMARK 465     THR A    -8                                                      
REMARK 465     GLU A    -7                                                      
REMARK 465     ASN A    -6                                                      
REMARK 465     LEU A    -5                                                      
REMARK 465     TYR A    -4                                                      
REMARK 465     PHE A    -3                                                      
REMARK 465     GLN A    -2                                                      
REMARK 465     GLY A    -1                                                      
REMARK 465     ALA A     0                                                      
REMARK 465     MET A     1                                                      
REMARK 465     MET B   -25                                                      
REMARK 465     LYS B   -24                                                      
REMARK 465     HIS B   -23                                                      
REMARK 465     HIS B   -22                                                      
REMARK 465     HIS B   -21                                                      
REMARK 465     HIS B   -20                                                      
REMARK 465     HIS B   -19                                                      
REMARK 465     HIS B   -18                                                      
REMARK 465     PRO B   -17                                                      
REMARK 465     MET B   -16                                                      
REMARK 465     SER B   -15                                                      
REMARK 465     ASP B   -14                                                      
REMARK 465     TYR B   -13                                                      
REMARK 465     ASP B   -12                                                      
REMARK 465     ILE B   -11                                                      
REMARK 465     PRO B   -10                                                      
REMARK 465     THR B    -9                                                      
REMARK 465     THR B    -8                                                      
REMARK 465     GLU B    -7                                                      
REMARK 465     ASN B    -6                                                      
REMARK 465     LEU B    -5                                                      
REMARK 465     TYR B    -4                                                      
REMARK 465     PHE B    -3                                                      
REMARK 465     GLN B    -2                                                      
REMARK 465     GLY B    -1                                                      
REMARK 465     ALA B     0                                                      
REMARK 465     MET B     1                                                      
REMARK 465     MET C   -25                                                      
REMARK 465     LYS C   -24                                                      
REMARK 465     HIS C   -23                                                      
REMARK 465     HIS C   -22                                                      
REMARK 465     HIS C   -21                                                      
REMARK 465     HIS C   -20                                                      
REMARK 465     HIS C   -19                                                      
REMARK 465     HIS C   -18                                                      
REMARK 465     PRO C   -17                                                      
REMARK 465     MET C   -16                                                      
REMARK 465     SER C   -15                                                      
REMARK 465     ASP C   -14                                                      
REMARK 465     TYR C   -13                                                      
REMARK 465     ASP C   -12                                                      
REMARK 465     ILE C   -11                                                      
REMARK 465     PRO C   -10                                                      
REMARK 465     THR C    -9                                                      
REMARK 465     THR C    -8                                                      
REMARK 465     GLU C    -7                                                      
REMARK 465     ASN C    -6                                                      
REMARK 465     LEU C    -5                                                      
REMARK 465     TYR C    -4                                                      
REMARK 465     PHE C    -3                                                      
REMARK 465     GLN C    -2                                                      
REMARK 465     GLY C    -1                                                      
REMARK 465     ALA C     0                                                      
REMARK 465     MET C     1                                                      
REMARK 465     MET D   -25                                                      
REMARK 465     LYS D   -24                                                      
REMARK 465     HIS D   -23                                                      
REMARK 465     HIS D   -22                                                      
REMARK 465     HIS D   -21                                                      
REMARK 465     HIS D   -20                                                      
REMARK 465     HIS D   -19                                                      
REMARK 465     HIS D   -18                                                      
REMARK 465     PRO D   -17                                                      
REMARK 465     MET D   -16                                                      
REMARK 465     SER D   -15                                                      
REMARK 465     ASP D   -14                                                      
REMARK 465     TYR D   -13                                                      
REMARK 465     ASP D   -12                                                      
REMARK 465     ILE D   -11                                                      
REMARK 465     PRO D   -10                                                      
REMARK 465     THR D    -9                                                      
REMARK 465     THR D    -8                                                      
REMARK 465     GLU D    -7                                                      
REMARK 465     ASN D    -6                                                      
REMARK 465     LEU D    -5                                                      
REMARK 465     TYR D    -4                                                      
REMARK 465     PHE D    -3                                                      
REMARK 465     GLN D    -2                                                      
REMARK 465     GLY D    -1                                                      
REMARK 465     ALA D     0                                                      
REMARK 465     MET D     1                                                      
REMARK 465     MET E   -25                                                      
REMARK 465     LYS E   -24                                                      
REMARK 465     HIS E   -23                                                      
REMARK 465     HIS E   -22                                                      
REMARK 465     HIS E   -21                                                      
REMARK 465     HIS E   -20                                                      
REMARK 465     HIS E   -19                                                      
REMARK 465     HIS E   -18                                                      
REMARK 465     PRO E   -17                                                      
REMARK 465     MET E   -16                                                      
REMARK 465     SER E   -15                                                      
REMARK 465     ASP E   -14                                                      
REMARK 465     TYR E   -13                                                      
REMARK 465     ASP E   -12                                                      
REMARK 465     ILE E   -11                                                      
REMARK 465     PRO E   -10                                                      
REMARK 465     THR E    -9                                                      
REMARK 465     THR E    -8                                                      
REMARK 465     GLU E    -7                                                      
REMARK 465     ASN E    -6                                                      
REMARK 465     LEU E    -5                                                      
REMARK 465     TYR E    -4                                                      
REMARK 465     PHE E    -3                                                      
REMARK 465     GLN E    -2                                                      
REMARK 465     GLY E    -1                                                      
REMARK 465     ALA E     0                                                      
REMARK 465     MET E     1                                                      
REMARK 465     MET F   -25                                                      
REMARK 465     LYS F   -24                                                      
REMARK 465     HIS F   -23                                                      
REMARK 465     HIS F   -22                                                      
REMARK 465     HIS F   -21                                                      
REMARK 465     HIS F   -20                                                      
REMARK 465     HIS F   -19                                                      
REMARK 465     HIS F   -18                                                      
REMARK 465     PRO F   -17                                                      
REMARK 465     MET F   -16                                                      
REMARK 465     SER F   -15                                                      
REMARK 465     ASP F   -14                                                      
REMARK 465     TYR F   -13                                                      
REMARK 465     ASP F   -12                                                      
REMARK 465     ILE F   -11                                                      
REMARK 465     PRO F   -10                                                      
REMARK 465     THR F    -9                                                      
REMARK 465     THR F    -8                                                      
REMARK 465     GLU F    -7                                                      
REMARK 465     ASN F    -6                                                      
REMARK 465     LEU F    -5                                                      
REMARK 465     TYR F    -4                                                      
REMARK 465     PHE F    -3                                                      
REMARK 465     GLN F    -2                                                      
REMARK 465     GLY F    -1                                                      
REMARK 465     ALA F     0                                                      
REMARK 465     MET F     1                                                      
REMARK 465     MET G   -25                                                      
REMARK 465     LYS G   -24                                                      
REMARK 465     HIS G   -23                                                      
REMARK 465     HIS G   -22                                                      
REMARK 465     HIS G   -21                                                      
REMARK 465     HIS G   -20                                                      
REMARK 465     HIS G   -19                                                      
REMARK 465     HIS G   -18                                                      
REMARK 465     PRO G   -17                                                      
REMARK 465     MET G   -16                                                      
REMARK 465     SER G   -15                                                      
REMARK 465     ASP G   -14                                                      
REMARK 465     TYR G   -13                                                      
REMARK 465     ASP G   -12                                                      
REMARK 465     ILE G   -11                                                      
REMARK 465     PRO G   -10                                                      
REMARK 465     THR G    -9                                                      
REMARK 465     THR G    -8                                                      
REMARK 465     GLU G    -7                                                      
REMARK 465     ASN G    -6                                                      
REMARK 465     LEU G    -5                                                      
REMARK 465     TYR G    -4                                                      
REMARK 465     PHE G    -3                                                      
REMARK 465     GLN G    -2                                                      
REMARK 465     GLY G    -1                                                      
REMARK 465     ALA G     0                                                      
REMARK 465     MET G     1                                                      
REMARK 465     MET H   -25                                                      
REMARK 465     LYS H   -24                                                      
REMARK 465     HIS H   -23                                                      
REMARK 465     HIS H   -22                                                      
REMARK 465     HIS H   -21                                                      
REMARK 465     HIS H   -20                                                      
REMARK 465     HIS H   -19                                                      
REMARK 465     HIS H   -18                                                      
REMARK 465     PRO H   -17                                                      
REMARK 465     MET H   -16                                                      
REMARK 465     SER H   -15                                                      
REMARK 465     ASP H   -14                                                      
REMARK 465     TYR H   -13                                                      
REMARK 465     ASP H   -12                                                      
REMARK 465     ILE H   -11                                                      
REMARK 465     PRO H   -10                                                      
REMARK 465     THR H    -9                                                      
REMARK 465     THR H    -8                                                      
REMARK 465     GLU H    -7                                                      
REMARK 465     ASN H    -6                                                      
REMARK 465     LEU H    -5                                                      
REMARK 465     TYR H    -4                                                      
REMARK 465     PHE H    -3                                                      
REMARK 465     GLN H    -2                                                      
REMARK 465     GLY H    -1                                                      
REMARK 465     ALA H     0                                                      
REMARK 465     MET H     1                                                      
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   OE1  GLU C   244     O    HOH C  2095              2.00            
REMARK 500   O  A SER D   239     O    HOH A  2108              2.14            
REMARK 500   OE1  GLU E  1258     O    HOH E  2091              2.12            
REMARK 500   OE1A GLU F    42     NH1A ARG F    45              2.02            
REMARK 500   OD1  ASP G   101     O    HOH G  2051              2.13            
REMARK 500   O  A SER G   239     O    HOH F  2092              2.15            
REMARK 500   O  A SER H   239     O    HOH E  2098              2.13            
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    ASN A  56       37.30    -96.49                                   
REMARK 500    VAL A  67        1.12    -66.29                                   
REMARK 500    SER A 122      -59.01   -130.33                                   
REMARK 500    ASN A 156      -24.40     69.27                                   
REMARK 500    ASN A 158     -121.09     52.38                                   
REMARK 500    VAL A 248       76.46   -112.82                                   
REMARK 500    ASP A 249       26.88   -148.73                                   
REMARK 500    ASN B   6       -4.44     78.90                                   
REMARK 500    SER B 122      -51.68   -134.74                                   
REMARK 500    ASN B 156      -22.24     73.84                                   
REMARK 500    ASN B 158     -118.92     49.94                                   
REMARK 500    VAL B 248       75.92   -111.38                                   
REMARK 500    ASP B 249       23.59   -152.31                                   
REMARK 500    VAL C  67        0.83    -68.54                                   
REMARK 500    SER C 122      -59.40   -121.26                                   
REMARK 500    ASN C 156      -25.49     75.54                                   
REMARK 500    ASN C 158     -117.18     42.69                                   
REMARK 500    VAL C 248       79.09   -109.19                                   
REMARK 500    ASP C 249       25.38   -150.47                                   
REMARK 500    ARG D  45      -73.62    -69.51                                   
REMARK 500    LYS D  46      -76.53    -26.76                                   
REMARK 500    GLU D  47      -71.54    -13.79                                   
REMARK 500    SER D 122      -58.67   -121.04                                   
REMARK 500    ASN D 156      -28.01     76.36                                   
REMARK 500    ASN D 158     -112.93     43.78                                   
REMARK 500    ASP D 249       27.21   -156.29                                   
REMARK 500    SER D 250       15.86     59.59                                   
REMARK 500    ASN E  16     -166.50   -160.66                                   
REMARK 500    SER E 122      -56.10   -127.76                                   
REMARK 500    ASN E 156      -22.32     72.45                                   
REMARK 500    ASN E 158     -115.46     49.97                                   
REMARK 500    VAL E 248       78.28   -110.69                                   
REMARK 500    ASP E 249       27.01   -147.85                                   
REMARK 500    ASN F   6       -4.14     76.60                                   
REMARK 500    ARG F  40      -61.62    -97.15                                   
REMARK 500    ARG F 103       71.83   -101.42                                   
REMARK 500    ARG F 105      134.04    -22.77                                   
REMARK 500    SER F 122      -55.90   -129.83                                   
REMARK 500    ASN F 156      -11.78     73.07                                   
REMARK 500    ASN F 158     -122.65     42.98                                   
REMARK 500    VAL F 248       71.76   -105.78                                   
REMARK 500    ASP F 249       29.11   -140.16                                   
REMARK 500    SER G 122      -58.22   -125.21                                   
REMARK 500    LEU G 148      -36.31    -39.05                                   
REMARK 500    ASN G 156      -24.47     75.98                                   
REMARK 500    ASN G 158     -117.75     43.77                                   
REMARK 500    VAL G 248       78.89   -108.16                                   
REMARK 500    ASP G 249       26.50   -150.59                                   
REMARK 500    LYS H  46      -22.99    -35.09                                   
REMARK 500    SER H 122      -63.62   -131.31                                   
REMARK 500                                                                      
REMARK 500 THIS ENTRY HAS      55 RAMACHANDRAN OUTLIERS.                        
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 800                                                                      
REMARK 800 SITE                                                                 
REMARK 800 SITE_IDENTIFIER: AC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NAP A1257                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC2                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MJ5 A1258                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC3                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MJ5 B1257                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC4                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MJ5 C1257                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC5                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MJ5 D1257                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC6                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MJ5 E1257                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC7                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MJ5 F1257                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC8                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MJ5 G1257                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: AC9                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MJ5 H1257                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: BC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GLU G1258                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: BC2                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NAP B1258                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: BC3                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GLU F1258                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: BC4                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NAP C1258                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: BC5                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GLU E1258                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: BC6                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NAP D1258                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: BC7                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GLU C1259                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: BC8                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NAP E1259                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: BC9                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GLU B1259                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: CC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NAP F1259                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: CC2                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GLU A1259                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: CC3                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NAP G1259                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: CC4                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GLU G1260                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: CC5                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NAP H1258                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: CC6                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GLU B1260                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: CC7                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GLU A1260                 
REMARK 800                                                                      
REMARK 800 SITE_IDENTIFIER: CC8                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GLU E1260                 
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 4BNF   RELATED DB: PDB                                   
REMARK 900  CRYSTAL STRUCTURE OF S. AUREUS FABI IN COMPLEX WITH                 
REMARK 900  NADP AND 2-PHENOXY-5-PROPYLPHENOL                                   
REMARK 900 RELATED ID: 4BNG   RELATED DB: PDB                                   
REMARK 900  CRYSTAL STRUCTURE OF S. AUREUS FABI IN COMPLEX WITH                 
REMARK 900  NADP AND 5-PENTYL-2-PHENOXYPHENOL                                   
REMARK 900 RELATED ID: 4BNH   RELATED DB: PDB                                   
REMARK 900  CRYSTAL STRUCTURE OF S. AUREUS FABI IN COMPLEX WITH                 
REMARK 900  NADP AND 5-HEXYL-2-PHENOXYPHENOL                                    
REMARK 900 RELATED ID: 4BNI   RELATED DB: PDB                                   
REMARK 900  CRYSTAL STRUCTURE OF S. AUREUS FABI IN COMPLEX WITH                 
REMARK 900  NADP AND 2-(2-AMINOPHENOXY)-5-HEXYLPHENOL                           
REMARK 900 RELATED ID: 4BNK   RELATED DB: PDB                                   
REMARK 900  CRYSTAL STRUCTURE OF S. AUREUS FABI IN COMPLEX WITH                 
REMARK 900  NADP AND 5-FLUORO-2-PHENOXYPHENOL                                   
REMARK 900 RELATED ID: 4BNL   RELATED DB: PDB                                   
REMARK 900  CRYSTAL STRUCTURE OF S. AUREUS FABI IN COMPLEX WITH                 
REMARK 900  NADP AND 2-PHENOXY-5-(2-PROPENYL)PHENOL                             
REMARK 900 RELATED ID: 4BNM   RELATED DB: PDB                                   
REMARK 900  CRYSTAL STRUCTURE OF S. AUREUS FABI IN COMPLEX WITH                 
REMARK 900  NADP AND 5-HEXYL-2-(2-METHYLPHENOXY)PHENOL                          
REMARK 900 RELATED ID: 4BNN   RELATED DB: PDB                                   
REMARK 900  CRYSTAL STRUCTURE OF S. AUREUS FABI IN COMPLEX WITH                 
REMARK 900  NADP AND 2-(2-CYANOPHENOXY)-5-HEXYLPHENOL                           
DBREF  4BNJ A    1   256  UNP    Q7A6D8   Q7A6D8_STAAN     1    256             
DBREF  4BNJ B    1   256  UNP    Q7A6D8   Q7A6D8_STAAN     1    256             
DBREF  4BNJ C    1   256  UNP    Q7A6D8   Q7A6D8_STAAN     1    256             
DBREF  4BNJ D    1   256  UNP    Q7A6D8   Q7A6D8_STAAN     1    256             
DBREF  4BNJ E    1   256  UNP    Q7A6D8   Q7A6D8_STAAN     1    256             
DBREF  4BNJ F    1   256  UNP    Q7A6D8   Q7A6D8_STAAN     1    256             
DBREF  4BNJ G    1   256  UNP    Q7A6D8   Q7A6D8_STAAN     1    256             
DBREF  4BNJ H    1   256  UNP    Q7A6D8   Q7A6D8_STAAN     1    256             
SEQADV 4BNJ MET A  -25  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LYS A  -24  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS A  -23  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS A  -22  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS A  -21  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS A  -20  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS A  -19  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS A  -18  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO A  -17  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ MET A  -16  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ SER A  -15  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP A  -14  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR A  -13  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP A  -12  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ILE A  -11  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO A  -10  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR A   -9  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR A   -8  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLU A   -7  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASN A   -6  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LEU A   -5  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR A   -4  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PHE A   -3  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLN A   -2  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLY A   -1  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ALA A    0  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ VAL A    2  UNP  Q7A6D8    LEU     2 ENGINEERED MUTATION            
SEQADV 4BNJ MET B  -25  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LYS B  -24  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS B  -23  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS B  -22  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS B  -21  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS B  -20  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS B  -19  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS B  -18  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO B  -17  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ MET B  -16  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ SER B  -15  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP B  -14  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR B  -13  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP B  -12  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ILE B  -11  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO B  -10  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR B   -9  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR B   -8  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLU B   -7  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASN B   -6  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LEU B   -5  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR B   -4  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PHE B   -3  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLN B   -2  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLY B   -1  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ALA B    0  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ VAL B    2  UNP  Q7A6D8    LEU     2 ENGINEERED MUTATION            
SEQADV 4BNJ MET C  -25  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LYS C  -24  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS C  -23  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS C  -22  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS C  -21  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS C  -20  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS C  -19  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS C  -18  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO C  -17  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ MET C  -16  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ SER C  -15  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP C  -14  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR C  -13  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP C  -12  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ILE C  -11  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO C  -10  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR C   -9  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR C   -8  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLU C   -7  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASN C   -6  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LEU C   -5  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR C   -4  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PHE C   -3  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLN C   -2  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLY C   -1  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ALA C    0  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ VAL C    2  UNP  Q7A6D8    LEU     2 ENGINEERED MUTATION            
SEQADV 4BNJ MET D  -25  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LYS D  -24  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS D  -23  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS D  -22  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS D  -21  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS D  -20  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS D  -19  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS D  -18  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO D  -17  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ MET D  -16  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ SER D  -15  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP D  -14  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR D  -13  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP D  -12  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ILE D  -11  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO D  -10  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR D   -9  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR D   -8  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLU D   -7  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASN D   -6  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LEU D   -5  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR D   -4  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PHE D   -3  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLN D   -2  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLY D   -1  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ALA D    0  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ VAL D    2  UNP  Q7A6D8    LEU     2 ENGINEERED MUTATION            
SEQADV 4BNJ MET E  -25  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LYS E  -24  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS E  -23  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS E  -22  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS E  -21  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS E  -20  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS E  -19  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS E  -18  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO E  -17  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ MET E  -16  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ SER E  -15  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP E  -14  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR E  -13  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP E  -12  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ILE E  -11  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO E  -10  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR E   -9  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR E   -8  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLU E   -7  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASN E   -6  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LEU E   -5  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR E   -4  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PHE E   -3  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLN E   -2  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLY E   -1  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ALA E    0  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ VAL E    2  UNP  Q7A6D8    LEU     2 ENGINEERED MUTATION            
SEQADV 4BNJ MET F  -25  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LYS F  -24  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS F  -23  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS F  -22  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS F  -21  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS F  -20  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS F  -19  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS F  -18  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO F  -17  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ MET F  -16  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ SER F  -15  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP F  -14  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR F  -13  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP F  -12  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ILE F  -11  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO F  -10  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR F   -9  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR F   -8  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLU F   -7  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASN F   -6  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LEU F   -5  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR F   -4  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PHE F   -3  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLN F   -2  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLY F   -1  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ALA F    0  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ VAL F    2  UNP  Q7A6D8    LEU     2 ENGINEERED MUTATION            
SEQADV 4BNJ MET G  -25  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LYS G  -24  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS G  -23  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS G  -22  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS G  -21  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS G  -20  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS G  -19  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS G  -18  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO G  -17  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ MET G  -16  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ SER G  -15  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP G  -14  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR G  -13  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP G  -12  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ILE G  -11  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO G  -10  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR G   -9  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR G   -8  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLU G   -7  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASN G   -6  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LEU G   -5  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR G   -4  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PHE G   -3  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLN G   -2  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLY G   -1  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ALA G    0  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ VAL G    2  UNP  Q7A6D8    LEU     2 ENGINEERED MUTATION            
SEQADV 4BNJ MET H  -25  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LYS H  -24  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS H  -23  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS H  -22  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS H  -21  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS H  -20  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS H  -19  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ HIS H  -18  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO H  -17  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ MET H  -16  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ SER H  -15  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP H  -14  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR H  -13  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASP H  -12  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ILE H  -11  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PRO H  -10  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR H   -9  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ THR H   -8  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLU H   -7  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ASN H   -6  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ LEU H   -5  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ TYR H   -4  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ PHE H   -3  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLN H   -2  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ GLY H   -1  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ ALA H    0  UNP  Q7A6D8              EXPRESSION TAG                 
SEQADV 4BNJ VAL H    2  UNP  Q7A6D8    LEU     2 ENGINEERED MUTATION            
SEQRES   1 A  282  MET LYS HIS HIS HIS HIS HIS HIS PRO MET SER ASP TYR          
SEQRES   2 A  282  ASP ILE PRO THR THR GLU ASN LEU TYR PHE GLN GLY ALA          
SEQRES   3 A  282  MET VAL ASN LEU GLU ASN LYS THR TYR VAL ILE MET GLY          
SEQRES   4 A  282  ILE ALA ASN LYS ARG SER ILE ALA PHE GLY VAL ALA LYS          
SEQRES   5 A  282  VAL LEU ASP GLN LEU GLY ALA LYS LEU VAL PHE THR TYR          
SEQRES   6 A  282  ARG LYS GLU ARG SER ARG LYS GLU LEU GLU LYS LEU LEU          
SEQRES   7 A  282  GLU GLN LEU ASN GLN PRO GLU ALA HIS LEU TYR GLN ILE          
SEQRES   8 A  282  ASP VAL GLN SER ASP GLU GLU VAL ILE ASN GLY PHE GLU          
SEQRES   9 A  282  GLN ILE GLY LYS ASP VAL GLY ASN ILE ASP GLY VAL TYR          
SEQRES  10 A  282  HIS SER ILE ALA PHE ALA ASN MET GLU ASP LEU ARG GLY          
SEQRES  11 A  282  ARG PHE SER GLU THR SER ARG GLU GLY PHE LEU LEU ALA          
SEQRES  12 A  282  GLN ASP ILE SER SER TYR SER LEU THR ILE VAL ALA HIS          
SEQRES  13 A  282  GLU ALA LYS LYS LEU MET PRO GLU GLY GLY SER ILE VAL          
SEQRES  14 A  282  ALA THR THR TYR LEU GLY GLY GLU PHE ALA VAL GLN ASN          
SEQRES  15 A  282  TYR ASN VAL MET GLY VAL ALA LYS ALA SER LEU GLU ALA          
SEQRES  16 A  282  ASN VAL LYS TYR LEU ALA LEU ASP LEU GLY PRO ASP ASN          
SEQRES  17 A  282  ILE ARG VAL ASN ALA ILE SER ALA GLY PRO ILE ARG THR          
SEQRES  18 A  282  LEU SER ALA LYS GLY VAL GLY GLY PHE ASN THR ILE LEU          
SEQRES  19 A  282  LYS GLU ILE GLU GLU ARG ALA PRO LEU LYS ARG ASN VAL          
SEQRES  20 A  282  ASP GLN VAL GLU VAL GLY LYS THR ALA ALA TYR LEU LEU          
SEQRES  21 A  282  SER ASP LEU SER SER GLY VAL THR GLY GLU ASN ILE HIS          
SEQRES  22 A  282  VAL ASP SER GLY PHE HIS ALA ILE LYS                          
SEQRES   1 B  282  MET LYS HIS HIS HIS HIS HIS HIS PRO MET SER ASP TYR          
SEQRES   2 B  282  ASP ILE PRO THR THR GLU ASN LEU TYR PHE GLN GLY ALA          
SEQRES   3 B  282  MET VAL ASN LEU GLU ASN LYS THR TYR VAL ILE MET GLY          
SEQRES   4 B  282  ILE ALA ASN LYS ARG SER ILE ALA PHE GLY VAL ALA LYS          
SEQRES   5 B  282  VAL LEU ASP GLN LEU GLY ALA LYS LEU VAL PHE THR TYR          
SEQRES   6 B  282  ARG LYS GLU ARG SER ARG LYS GLU LEU GLU LYS LEU LEU          
SEQRES   7 B  282  GLU GLN LEU ASN GLN PRO GLU ALA HIS LEU TYR GLN ILE          
SEQRES   8 B  282  ASP VAL GLN SER ASP GLU GLU VAL ILE ASN GLY PHE GLU          
SEQRES   9 B  282  GLN ILE GLY LYS ASP VAL GLY ASN ILE ASP GLY VAL TYR          
SEQRES  10 B  282  HIS SER ILE ALA PHE ALA ASN MET GLU ASP LEU ARG GLY          
SEQRES  11 B  282  ARG PHE SER GLU THR SER ARG GLU GLY PHE LEU LEU ALA          
SEQRES  12 B  282  GLN ASP ILE SER SER TYR SER LEU THR ILE VAL ALA HIS          
SEQRES  13 B  282  GLU ALA LYS LYS LEU MET PRO GLU GLY GLY SER ILE VAL          
SEQRES  14 B  282  ALA THR THR TYR LEU GLY GLY GLU PHE ALA VAL GLN ASN          
SEQRES  15 B  282  TYR ASN VAL MET GLY VAL ALA LYS ALA SER LEU GLU ALA          
SEQRES  16 B  282  ASN VAL LYS TYR LEU ALA LEU ASP LEU GLY PRO ASP ASN          
SEQRES  17 B  282  ILE ARG VAL ASN ALA ILE SER ALA GLY PRO ILE ARG THR          
SEQRES  18 B  282  LEU SER ALA LYS GLY VAL GLY GLY PHE ASN THR ILE LEU          
SEQRES  19 B  282  LYS GLU ILE GLU GLU ARG ALA PRO LEU LYS ARG ASN VAL          
SEQRES  20 B  282  ASP GLN VAL GLU VAL GLY LYS THR ALA ALA TYR LEU LEU          
SEQRES  21 B  282  SER ASP LEU SER SER GLY VAL THR GLY GLU ASN ILE HIS          
SEQRES  22 B  282  VAL ASP SER GLY PHE HIS ALA ILE LYS                          
SEQRES   1 C  282  MET LYS HIS HIS HIS HIS HIS HIS PRO MET SER ASP TYR          
SEQRES   2 C  282  ASP ILE PRO THR THR GLU ASN LEU TYR PHE GLN GLY ALA          
SEQRES   3 C  282  MET VAL ASN LEU GLU ASN LYS THR TYR VAL ILE MET GLY          
SEQRES   4 C  282  ILE ALA ASN LYS ARG SER ILE ALA PHE GLY VAL ALA LYS          
SEQRES   5 C  282  VAL LEU ASP GLN LEU GLY ALA LYS LEU VAL PHE THR TYR          
SEQRES   6 C  282  ARG LYS GLU ARG SER ARG LYS GLU LEU GLU LYS LEU LEU          
SEQRES   7 C  282  GLU GLN LEU ASN GLN PRO GLU ALA HIS LEU TYR GLN ILE          
SEQRES   8 C  282  ASP VAL GLN SER ASP GLU GLU VAL ILE ASN GLY PHE GLU          
SEQRES   9 C  282  GLN ILE GLY LYS ASP VAL GLY ASN ILE ASP GLY VAL TYR          
SEQRES  10 C  282  HIS SER ILE ALA PHE ALA ASN MET GLU ASP LEU ARG GLY          
SEQRES  11 C  282  ARG PHE SER GLU THR SER ARG GLU GLY PHE LEU LEU ALA          
SEQRES  12 C  282  GLN ASP ILE SER SER TYR SER LEU THR ILE VAL ALA HIS          
SEQRES  13 C  282  GLU ALA LYS LYS LEU MET PRO GLU GLY GLY SER ILE VAL          
SEQRES  14 C  282  ALA THR THR TYR LEU GLY GLY GLU PHE ALA VAL GLN ASN          
SEQRES  15 C  282  TYR ASN VAL MET GLY VAL ALA LYS ALA SER LEU GLU ALA          
SEQRES  16 C  282  ASN VAL LYS TYR LEU ALA LEU ASP LEU GLY PRO ASP ASN          
SEQRES  17 C  282  ILE ARG VAL ASN ALA ILE SER ALA GLY PRO ILE ARG THR          
SEQRES  18 C  282  LEU SER ALA LYS GLY VAL GLY GLY PHE ASN THR ILE LEU          
SEQRES  19 C  282  LYS GLU ILE GLU GLU ARG ALA PRO LEU LYS ARG ASN VAL          
SEQRES  20 C  282  ASP GLN VAL GLU VAL GLY LYS THR ALA ALA TYR LEU LEU          
SEQRES  21 C  282  SER ASP LEU SER SER GLY VAL THR GLY GLU ASN ILE HIS          
SEQRES  22 C  282  VAL ASP SER GLY PHE HIS ALA ILE LYS                          
SEQRES   1 D  282  MET LYS HIS HIS HIS HIS HIS HIS PRO MET SER ASP TYR          
SEQRES   2 D  282  ASP ILE PRO THR THR GLU ASN LEU TYR PHE GLN GLY ALA          
SEQRES   3 D  282  MET VAL ASN LEU GLU ASN LYS THR TYR VAL ILE MET GLY          
SEQRES   4 D  282  ILE ALA ASN LYS ARG SER ILE ALA PHE GLY VAL ALA LYS          
SEQRES   5 D  282  VAL LEU ASP GLN LEU GLY ALA LYS LEU VAL PHE THR TYR          
SEQRES   6 D  282  ARG LYS GLU ARG SER ARG LYS GLU LEU GLU LYS LEU LEU          
SEQRES   7 D  282  GLU GLN LEU ASN GLN PRO GLU ALA HIS LEU TYR GLN ILE          
SEQRES   8 D  282  ASP VAL GLN SER ASP GLU GLU VAL ILE ASN GLY PHE GLU          
SEQRES   9 D  282  GLN ILE GLY LYS ASP VAL GLY ASN ILE ASP GLY VAL TYR          
SEQRES  10 D  282  HIS SER ILE ALA PHE ALA ASN MET GLU ASP LEU ARG GLY          
SEQRES  11 D  282  ARG PHE SER GLU THR SER ARG GLU GLY PHE LEU LEU ALA          
SEQRES  12 D  282  GLN ASP ILE SER SER TYR SER LEU THR ILE VAL ALA HIS          
SEQRES  13 D  282  GLU ALA LYS LYS LEU MET PRO GLU GLY GLY SER ILE VAL          
SEQRES  14 D  282  ALA THR THR TYR LEU GLY GLY GLU PHE ALA VAL GLN ASN          
SEQRES  15 D  282  TYR ASN VAL MET GLY VAL ALA LYS ALA SER LEU GLU ALA          
SEQRES  16 D  282  ASN VAL LYS TYR LEU ALA LEU ASP LEU GLY PRO ASP ASN          
SEQRES  17 D  282  ILE ARG VAL ASN ALA ILE SER ALA GLY PRO ILE ARG THR          
SEQRES  18 D  282  LEU SER ALA LYS GLY VAL GLY GLY PHE ASN THR ILE LEU          
SEQRES  19 D  282  LYS GLU ILE GLU GLU ARG ALA PRO LEU LYS ARG ASN VAL          
SEQRES  20 D  282  ASP GLN VAL GLU VAL GLY LYS THR ALA ALA TYR LEU LEU          
SEQRES  21 D  282  SER ASP LEU SER SER GLY VAL THR GLY GLU ASN ILE HIS          
SEQRES  22 D  282  VAL ASP SER GLY PHE HIS ALA ILE LYS                          
SEQRES   1 E  282  MET LYS HIS HIS HIS HIS HIS HIS PRO MET SER ASP TYR          
SEQRES   2 E  282  ASP ILE PRO THR THR GLU ASN LEU TYR PHE GLN GLY ALA          
SEQRES   3 E  282  MET VAL ASN LEU GLU ASN LYS THR TYR VAL ILE MET GLY          
SEQRES   4 E  282  ILE ALA ASN LYS ARG SER ILE ALA PHE GLY VAL ALA LYS          
SEQRES   5 E  282  VAL LEU ASP GLN LEU GLY ALA LYS LEU VAL PHE THR TYR          
SEQRES   6 E  282  ARG LYS GLU ARG SER ARG LYS GLU LEU GLU LYS LEU LEU          
SEQRES   7 E  282  GLU GLN LEU ASN GLN PRO GLU ALA HIS LEU TYR GLN ILE          
SEQRES   8 E  282  ASP VAL GLN SER ASP GLU GLU VAL ILE ASN GLY PHE GLU          
SEQRES   9 E  282  GLN ILE GLY LYS ASP VAL GLY ASN ILE ASP GLY VAL TYR          
SEQRES  10 E  282  HIS SER ILE ALA PHE ALA ASN MET GLU ASP LEU ARG GLY          
SEQRES  11 E  282  ARG PHE SER GLU THR SER ARG GLU GLY PHE LEU LEU ALA          
SEQRES  12 E  282  GLN ASP ILE SER SER TYR SER LEU THR ILE VAL ALA HIS          
SEQRES  13 E  282  GLU ALA LYS LYS LEU MET PRO GLU GLY GLY SER ILE VAL          
SEQRES  14 E  282  ALA THR THR TYR LEU GLY GLY GLU PHE ALA VAL GLN ASN          
SEQRES  15 E  282  TYR ASN VAL MET GLY VAL ALA LYS ALA SER LEU GLU ALA          
SEQRES  16 E  282  ASN VAL LYS TYR LEU ALA LEU ASP LEU GLY PRO ASP ASN          
SEQRES  17 E  282  ILE ARG VAL ASN ALA ILE SER ALA GLY PRO ILE ARG THR          
SEQRES  18 E  282  LEU SER ALA LYS GLY VAL GLY GLY PHE ASN THR ILE LEU          
SEQRES  19 E  282  LYS GLU ILE GLU GLU ARG ALA PRO LEU LYS ARG ASN VAL          
SEQRES  20 E  282  ASP GLN VAL GLU VAL GLY LYS THR ALA ALA TYR LEU LEU          
SEQRES  21 E  282  SER ASP LEU SER SER GLY VAL THR GLY GLU ASN ILE HIS          
SEQRES  22 E  282  VAL ASP SER GLY PHE HIS ALA ILE LYS                          
SEQRES   1 F  282  MET LYS HIS HIS HIS HIS HIS HIS PRO MET SER ASP TYR          
SEQRES   2 F  282  ASP ILE PRO THR THR GLU ASN LEU TYR PHE GLN GLY ALA          
SEQRES   3 F  282  MET VAL ASN LEU GLU ASN LYS THR TYR VAL ILE MET GLY          
SEQRES   4 F  282  ILE ALA ASN LYS ARG SER ILE ALA PHE GLY VAL ALA LYS          
SEQRES   5 F  282  VAL LEU ASP GLN LEU GLY ALA LYS LEU VAL PHE THR TYR          
SEQRES   6 F  282  ARG LYS GLU ARG SER ARG LYS GLU LEU GLU LYS LEU LEU          
SEQRES   7 F  282  GLU GLN LEU ASN GLN PRO GLU ALA HIS LEU TYR GLN ILE          
SEQRES   8 F  282  ASP VAL GLN SER ASP GLU GLU VAL ILE ASN GLY PHE GLU          
SEQRES   9 F  282  GLN ILE GLY LYS ASP VAL GLY ASN ILE ASP GLY VAL TYR          
SEQRES  10 F  282  HIS SER ILE ALA PHE ALA ASN MET GLU ASP LEU ARG GLY          
SEQRES  11 F  282  ARG PHE SER GLU THR SER ARG GLU GLY PHE LEU LEU ALA          
SEQRES  12 F  282  GLN ASP ILE SER SER TYR SER LEU THR ILE VAL ALA HIS          
SEQRES  13 F  282  GLU ALA LYS LYS LEU MET PRO GLU GLY GLY SER ILE VAL          
SEQRES  14 F  282  ALA THR THR TYR LEU GLY GLY GLU PHE ALA VAL GLN ASN          
SEQRES  15 F  282  TYR ASN VAL MET GLY VAL ALA LYS ALA SER LEU GLU ALA          
SEQRES  16 F  282  ASN VAL LYS TYR LEU ALA LEU ASP LEU GLY PRO ASP ASN          
SEQRES  17 F  282  ILE ARG VAL ASN ALA ILE SER ALA GLY PRO ILE ARG THR          
SEQRES  18 F  282  LEU SER ALA LYS GLY VAL GLY GLY PHE ASN THR ILE LEU          
SEQRES  19 F  282  LYS GLU ILE GLU GLU ARG ALA PRO LEU LYS ARG ASN VAL          
SEQRES  20 F  282  ASP GLN VAL GLU VAL GLY LYS THR ALA ALA TYR LEU LEU          
SEQRES  21 F  282  SER ASP LEU SER SER GLY VAL THR GLY GLU ASN ILE HIS          
SEQRES  22 F  282  VAL ASP SER GLY PHE HIS ALA ILE LYS                          
SEQRES   1 G  282  MET LYS HIS HIS HIS HIS HIS HIS PRO MET SER ASP TYR          
SEQRES   2 G  282  ASP ILE PRO THR THR GLU ASN LEU TYR PHE GLN GLY ALA          
SEQRES   3 G  282  MET VAL ASN LEU GLU ASN LYS THR TYR VAL ILE MET GLY          
SEQRES   4 G  282  ILE ALA ASN LYS ARG SER ILE ALA PHE GLY VAL ALA LYS          
SEQRES   5 G  282  VAL LEU ASP GLN LEU GLY ALA LYS LEU VAL PHE THR TYR          
SEQRES   6 G  282  ARG LYS GLU ARG SER ARG LYS GLU LEU GLU LYS LEU LEU          
SEQRES   7 G  282  GLU GLN LEU ASN GLN PRO GLU ALA HIS LEU TYR GLN ILE          
SEQRES   8 G  282  ASP VAL GLN SER ASP GLU GLU VAL ILE ASN GLY PHE GLU          
SEQRES   9 G  282  GLN ILE GLY LYS ASP VAL GLY ASN ILE ASP GLY VAL TYR          
SEQRES  10 G  282  HIS SER ILE ALA PHE ALA ASN MET GLU ASP LEU ARG GLY          
SEQRES  11 G  282  ARG PHE SER GLU THR SER ARG GLU GLY PHE LEU LEU ALA          
SEQRES  12 G  282  GLN ASP ILE SER SER TYR SER LEU THR ILE VAL ALA HIS          
SEQRES  13 G  282  GLU ALA LYS LYS LEU MET PRO GLU GLY GLY SER ILE VAL          
SEQRES  14 G  282  ALA THR THR TYR LEU GLY GLY GLU PHE ALA VAL GLN ASN          
SEQRES  15 G  282  TYR ASN VAL MET GLY VAL ALA LYS ALA SER LEU GLU ALA          
SEQRES  16 G  282  ASN VAL LYS TYR LEU ALA LEU ASP LEU GLY PRO ASP ASN          
SEQRES  17 G  282  ILE ARG VAL ASN ALA ILE SER ALA GLY PRO ILE ARG THR          
SEQRES  18 G  282  LEU SER ALA LYS GLY VAL GLY GLY PHE ASN THR ILE LEU          
SEQRES  19 G  282  LYS GLU ILE GLU GLU ARG ALA PRO LEU LYS ARG ASN VAL          
SEQRES  20 G  282  ASP GLN VAL GLU VAL GLY LYS THR ALA ALA TYR LEU LEU          
SEQRES  21 G  282  SER ASP LEU SER SER GLY VAL THR GLY GLU ASN ILE HIS          
SEQRES  22 G  282  VAL ASP SER GLY PHE HIS ALA ILE LYS                          
SEQRES   1 H  282  MET LYS HIS HIS HIS HIS HIS HIS PRO MET SER ASP TYR          
SEQRES   2 H  282  ASP ILE PRO THR THR GLU ASN LEU TYR PHE GLN GLY ALA          
SEQRES   3 H  282  MET VAL ASN LEU GLU ASN LYS THR TYR VAL ILE MET GLY          
SEQRES   4 H  282  ILE ALA ASN LYS ARG SER ILE ALA PHE GLY VAL ALA LYS          
SEQRES   5 H  282  VAL LEU ASP GLN LEU GLY ALA LYS LEU VAL PHE THR TYR          
SEQRES   6 H  282  ARG LYS GLU ARG SER ARG LYS GLU LEU GLU LYS LEU LEU          
SEQRES   7 H  282  GLU GLN LEU ASN GLN PRO GLU ALA HIS LEU TYR GLN ILE          
SEQRES   8 H  282  ASP VAL GLN SER ASP GLU GLU VAL ILE ASN GLY PHE GLU          
SEQRES   9 H  282  GLN ILE GLY LYS ASP VAL GLY ASN ILE ASP GLY VAL TYR          
SEQRES  10 H  282  HIS SER ILE ALA PHE ALA ASN MET GLU ASP LEU ARG GLY          
SEQRES  11 H  282  ARG PHE SER GLU THR SER ARG GLU GLY PHE LEU LEU ALA          
SEQRES  12 H  282  GLN ASP ILE SER SER TYR SER LEU THR ILE VAL ALA HIS          
SEQRES  13 H  282  GLU ALA LYS LYS LEU MET PRO GLU GLY GLY SER ILE VAL          
SEQRES  14 H  282  ALA THR THR TYR LEU GLY GLY GLU PHE ALA VAL GLN ASN          
SEQRES  15 H  282  TYR ASN VAL MET GLY VAL ALA LYS ALA SER LEU GLU ALA          
SEQRES  16 H  282  ASN VAL LYS TYR LEU ALA LEU ASP LEU GLY PRO ASP ASN          
SEQRES  17 H  282  ILE ARG VAL ASN ALA ILE SER ALA GLY PRO ILE ARG THR          
SEQRES  18 H  282  LEU SER ALA LYS GLY VAL GLY GLY PHE ASN THR ILE LEU          
SEQRES  19 H  282  LYS GLU ILE GLU GLU ARG ALA PRO LEU LYS ARG ASN VAL          
SEQRES  20 H  282  ASP GLN VAL GLU VAL GLY LYS THR ALA ALA TYR LEU LEU          
SEQRES  21 H  282  SER ASP LEU SER SER GLY VAL THR GLY GLU ASN ILE HIS          
SEQRES  22 H  282  VAL ASP SER GLY PHE HIS ALA ILE LYS                          
HET    NAP  A1257      48                                                       
HET    MJ5  A1258      15                                                       
HET    MJ5  B1257      15                                                       
HET    MJ5  C1257      15                                                       
HET    MJ5  D1257      15                                                       
HET    MJ5  E1257      15                                                       
HET    MJ5  F1257      15                                                       
HET    MJ5  G1257      15                                                       
HET    MJ5  H1257      15                                                       
HET    GLU  G1258      10                                                       
HET    NAP  B1258      48                                                       
HET    GLU  F1258      10                                                       
HET    NAP  C1258      48                                                       
HET    GLU  E1258      10                                                       
HET    NAP  D1258      48                                                       
HET    GLU  C1259      10                                                       
HET    NAP  E1259      48                                                       
HET    GLU  B1259      10                                                       
HET    NAP  F1259      48                                                       
HET    GLU  A1259      10                                                       
HET    NAP  G1259      48                                                       
HET    GLU  G1260      10                                                       
HET    NAP  H1258      48                                                       
HET    GLU  B1260      10                                                       
HET    GLU  A1260      10                                                       
HET    GLU  E1260       9                                                       
HETNAM     NAP NADP NICOTINAMIDE-ADENINE-DINUCLEOTIDE                           
HETNAM   2 NAP  PHOSPHATE                                                       
HETNAM     MJ5 5-METHYL-2-PHENOXYPHENOL                                         
HETNAM     GLU GLUTAMIC ACID                                                    
HETSYN     NAP 2'-MONOPHOSPHOADENOSINE 5'-DIPHOSPHORIBOSE                       
FORMUL   2  NAP    8(C21 H28 N7 O17 P3)                                         
FORMUL   3  MJ5    8(C13 H12 O2)                                                
FORMUL   4  GLU    10(C5 H9 N O4)                                               
FORMUL   5  HOH   *781(H2 O)                                                    
HELIX    1   1 SER A   19  LEU A   31  1                                  13    
HELIX    2   2 LYS A   41  LEU A   52  1                                  12    
HELIX    3   3 GLU A   53  LEU A   55  5                                   3    
HELIX    4   4 SER A   69  GLY A   85  1                                  17    
HELIX    5   5 ASN A   98  LEU A  102  5                                   5    
HELIX    6   6 ARG A  105  THR A  109  5                                   5    
HELIX    7   7 SER A  110  SER A  122  1                                  13    
HELIX    8   8 SER A  122  LYS A  133  1                                  12    
HELIX    9   9 LYS A  134  MET A  136  5                                   3    
HELIX   10  10 TYR A  147  GLU A  151  5                                   5    
HELIX   11  11 ASN A  158  GLY A  179  1                                  22    
HELIX   12  12 LEU A  196  VAL A  201  5                                   6    
HELIX   13  13 GLY A  203  ALA A  215  1                                  13    
HELIX   14  14 ASP A  222  SER A  235  1                                  14    
HELIX   15  15 ASP A  236  SER A  239  5                                   4    
HELIX   16  16 GLY A  251  ALA A  254  5                                   4    
HELIX   17  17 SER B   19  LEU B   31  1                                  13    
HELIX   18  18 LYS B   41  GLU B   53  1                                  13    
HELIX   19  19 SER B   69  GLY B   85  1                                  17    
HELIX   20  20 ASN B   98  ARG B  103  1                                   6    
HELIX   21  21 ARG B  105  THR B  109  5                                   5    
HELIX   22  22 SER B  110  SER B  122  1                                  13    
HELIX   23  23 SER B  122  LYS B  134  1                                  13    
HELIX   24  24 TYR B  147  GLU B  151  5                                   5    
HELIX   25  25 TYR B  157  GLY B  179  1                                  23    
HELIX   26  26 LEU B  196  VAL B  201  5                                   6    
HELIX   27  27 GLY B  203  ALA B  215  1                                  13    
HELIX   28  28 ASP B  222  SER B  235  1                                  14    
HELIX   29  29 ASP B  236  SER B  239  5                                   4    
HELIX   30  30 GLY B  251  ALA B  254  5                                   4    
HELIX   31  31 SER C   19  LEU C   31  1                                  13    
HELIX   32  32 LYS C   41  LEU C   52  1                                  12    
HELIX   33  33 GLU C   53  LEU C   55  5                                   3    
HELIX   34  34 SER C   69  GLY C   85  1                                  17    
HELIX   35  35 ASN C   98  ARG C  103  5                                   6    
HELIX   36  36 ARG C  105  THR C  109  5                                   5    
HELIX   37  37 SER C  110  SER C  122  1                                  13    
HELIX   38  38 SER C  122  LYS C  134  1                                  13    
HELIX   39  39 TYR C  147  GLU C  151  5                                   5    
HELIX   40  40 TYR C  157  GLY C  179  1                                  23    
HELIX   41  41 LEU C  196  VAL C  201  5                                   6    
HELIX   42  42 GLY C  203  ALA C  215  1                                  13    
HELIX   43  43 ASP C  222  SER C  235  1                                  14    
HELIX   44  44 ASP C  236  SER C  239  5                                   4    
HELIX   45  45 GLY C  251  ALA C  254  5                                   4    
HELIX   46  46 SER D   19  LEU D   31  1                                  13    
HELIX   47  47 LYS D   41  LEU D   52  1                                  12    
HELIX   48  48 GLU D   53  LEU D   55  5                                   3    
HELIX   49  49 SER D   69  GLY D   85  1                                  17    
HELIX   50  50 ASN D   98  ARG D  103  5                                   6    
HELIX   51  51 ARG D  105  THR D  109  5                                   5    
HELIX   52  52 SER D  110  SER D  122  1                                  13    
HELIX   53  53 SER D  122  LYS D  134  1                                  13    
HELIX   54  54 TYR D  147  GLU D  151  5                                   5    
HELIX   55  55 TYR D  157  GLY D  179  1                                  23    
HELIX   56  56 SER D  197  VAL D  201  5                                   5    
HELIX   57  57 GLY D  203  ALA D  215  1                                  13    
HELIX   58  58 ASP D  222  SER D  235  1                                  14    
HELIX   59  59 ASP D  236  SER D  239  5                                   4    
HELIX   60  60 GLY D  251  ALA D  254  5                                   4    
HELIX   61  61 SER E   19  LEU E   31  1                                  13    
HELIX   62  62 LYS E   41  LEU E   52  1                                  12    
HELIX   63  63 GLU E   53  LEU E   55  5                                   3    
HELIX   64  64 SER E   69  GLY E   85  1                                  17    
HELIX   65  65 ASN E   98  LEU E  102  5                                   5    
HELIX   66  66 ARG E  105  THR E  109  5                                   5    
HELIX   67  67 SER E  110  SER E  122  1                                  13    
HELIX   68  68 SER E  122  LYS E  134  1                                  13    
HELIX   69  69 TYR E  147  GLU E  151  5                                   5    
HELIX   70  70 TYR E  157  GLY E  179  1                                  23    
HELIX   71  71 LEU E  196  VAL E  201  5                                   6    
HELIX   72  72 GLY E  203  ALA E  215  1                                  13    
HELIX   73  73 ASP E  222  SER E  235  1                                  14    
HELIX   74  74 ASP E  236  SER E  239  5                                   4    
HELIX   75  75 GLY E  251  ALA E  254  5                                   4    
HELIX   76  76 SER F   19  LEU F   31  1                                  13    
HELIX   77  77 LYS F   41  LEU F   52  1                                  12    
HELIX   78  78 GLU F   53  LEU F   55  5                                   3    
HELIX   79  79 SER F   69  GLY F   85  1                                  17    
HELIX   80  80 ASN F   98  ARG F  103  1                                   6    
HELIX   81  81 ARG F  105  THR F  109  5                                   5    
HELIX   82  82 SER F  110  SER F  122  1                                  13    
HELIX   83  83 SER F  122  LYS F  133  1                                  12    
HELIX   84  84 LYS F  134  MET F  136  5                                   3    
HELIX   85  85 TYR F  147  GLU F  151  5                                   5    
HELIX   86  86 TYR F  157  GLY F  179  1                                  23    
HELIX   87  87 LEU F  196  VAL F  201  5                                   6    
HELIX   88  88 GLY F  203  ALA F  215  1                                  13    
HELIX   89  89 ASP F  222  SER F  235  1                                  14    
HELIX   90  90 ASP F  236  SER F  239  5                                   4    
HELIX   91  91 GLY F  251  HIS F  253  5                                   3    
HELIX   92  92 SER G   19  LEU G   31  1                                  13    
HELIX   93  93 LYS G   41  LEU G   52  1                                  12    
HELIX   94  94 GLU G   53  LEU G   55  5                                   3    
HELIX   95  95 SER G   69  GLY G   85  1                                  17    
HELIX   96  96 ASN G   98  ARG G  103  5                                   6    
HELIX   97  97 ARG G  105  THR G  109  5                                   5    
HELIX   98  98 SER G  110  SER G  122  1                                  13    
HELIX   99  99 SER G  122  LYS G  134  1                                  13    
HELIX  100 100 TYR G  147  GLU G  151  5                                   5    
HELIX  101 101 TYR G  157  GLY G  179  1                                  23    
HELIX  102 102 LEU G  196  VAL G  201  5                                   6    
HELIX  103 103 GLY G  203  ALA G  215  1                                  13    
HELIX  104 104 ASP G  222  SER G  235  1                                  14    
HELIX  105 105 ASP G  236  SER G  239  5                                   4    
HELIX  106 106 GLY G  251  ALA G  254  5                                   4    
HELIX  107 107 SER H   19  LEU H   31  1                                  13    
HELIX  108 108 LYS H   41  ARG H   43  5                                   3    
HELIX  109 109 SER H   44  LEU H   52  1                                   9    
HELIX  110 110 SER H   69  GLY H   85  1                                  17    
HELIX  111 111 ASN H   98  LEU H  102  5                                   5    
HELIX  112 112 ARG H  105  THR H  109  5                                   5    
HELIX  113 113 SER H  110  SER H  122  1                                  13    
HELIX  114 114 SER H  122  LYS H  134  1                                  13    
HELIX  115 115 TYR H  147  GLU H  151  5                                   5    
HELIX  116 116 TYR H  157  GLY H  179  1                                  23    
HELIX  117 117 LEU H  196  VAL H  201  5                                   6    
HELIX  118 118 GLY H  203  ALA H  215  1                                  13    
HELIX  119 119 ASP H  222  SER H  235  1                                  14    
HELIX  120 120 ASP H  236  SER H  239  5                                   4    
HELIX  121 121 GLY H  251  ALA H  254  5                                   4    
SHEET    1  AA 7 LEU A  62  GLN A  64  0                                        
SHEET    2  AA 7 LYS A  34  TYR A  39  1  O  PHE A  37   N  TYR A  63           
SHEET    3  AA 7 THR A   8  MET A  12  1  O  TYR A   9   N  VAL A  36           
SHEET    4  AA 7 GLY A  89  HIS A  92  1  O  GLY A  89   N  VAL A  10           
SHEET    5  AA 7 GLY A 140  THR A 146  1  O  SER A 141   N  VAL A  90           
SHEET    6  AA 7 ILE A 183  ALA A 190  1  O  ARG A 184   N  ILE A 142           
SHEET    7  AA 7 ASN A 245  VAL A 248  1  O  ILE A 246   N  SER A 189           
SHEET    1  BA 7 LEU B  62  GLN B  64  0                                        
SHEET    2  BA 7 LYS B  34  TYR B  39  1  O  PHE B  37   N  TYR B  63           
SHEET    3  BA 7 THR B   8  MET B  12  1  O  TYR B   9   N  VAL B  36           
SHEET    4  BA 7 GLY B  89  HIS B  92  1  O  GLY B  89   N  VAL B  10           
SHEET    5  BA 7 GLY B 140  THR B 146  1  O  SER B 141   N  VAL B  90           
SHEET    6  BA 7 ILE B 183  ALA B 190  1  O  ARG B 184   N  ILE B 142           
SHEET    7  BA 7 ASN B 245  VAL B 248  1  O  ILE B 246   N  SER B 189           
SHEET    1  CA 7 LEU C  62  GLN C  64  0                                        
SHEET    2  CA 7 LYS C  34  TYR C  39  1  O  PHE C  37   N  TYR C  63           
SHEET    3  CA 7 THR C   8  MET C  12  1  O  TYR C   9   N  VAL C  36           
SHEET    4  CA 7 GLY C  89  HIS C  92  1  O  GLY C  89   N  VAL C  10           
SHEET    5  CA 7 GLY C 140  THR C 146  1  O  SER C 141   N  VAL C  90           
SHEET    6  CA 7 ILE C 183  ALA C 190  1  O  ARG C 184   N  ILE C 142           
SHEET    7  CA 7 ASN C 245  VAL C 248  1  O  ILE C 246   N  SER C 189           
SHEET    1  DA 7 LEU D  62  GLN D  64  0                                        
SHEET    2  DA 7 LYS D  34  TYR D  39  1  O  PHE D  37   N  TYR D  63           
SHEET    3  DA 7 THR D   8  MET D  12  1  O  TYR D   9   N  VAL D  36           
SHEET    4  DA 7 GLY D  89  HIS D  92  1  O  GLY D  89   N  VAL D  10           
SHEET    5  DA 7 GLY D 140  THR D 146  1  O  SER D 141   N  VAL D  90           
SHEET    6  DA 7 ILE D 183  ALA D 190  1  O  ARG D 184   N  ILE D 142           
SHEET    7  DA 7 ASN D 245  VAL D 248  1  O  ILE D 246   N  SER D 189           
SHEET    1  EA 7 LEU E  62  GLN E  64  0                                        
SHEET    2  EA 7 LYS E  34  TYR E  39  1  O  PHE E  37   N  TYR E  63           
SHEET    3  EA 7 THR E   8  MET E  12  1  O  TYR E   9   N  VAL E  36           
SHEET    4  EA 7 GLY E  89  HIS E  92  1  O  GLY E  89   N  VAL E  10           
SHEET    5  EA 7 GLY E 140  THR E 146  1  O  SER E 141   N  VAL E  90           
SHEET    6  EA 7 ILE E 183  ALA E 190  1  O  ARG E 184   N  ILE E 142           
SHEET    7  EA 7 ASN E 245  VAL E 248  1  O  ILE E 246   N  SER E 189           
SHEET    1  FA 7 LEU F  62  GLN F  64  0                                        
SHEET    2  FA 7 LYS F  34  TYR F  39  1  O  PHE F  37   N  TYR F  63           
SHEET    3  FA 7 THR F   8  MET F  12  1  O  TYR F   9   N  VAL F  36           
SHEET    4  FA 7 GLY F  89  HIS F  92  1  O  GLY F  89   N  VAL F  10           
SHEET    5  FA 7 GLY F 140  THR F 146  1  O  SER F 141   N  VAL F  90           
SHEET    6  FA 7 ILE F 183  ALA F 190  1  O  ARG F 184   N  ILE F 142           
SHEET    7  FA 7 ASN F 245  VAL F 248  1  O  ILE F 246   N  SER F 189           
SHEET    1  FB 2 ILE F 255  LYS F 256  0                                        
SHEET    2  FB 2 ALA H 153  VAL H 154  1  O  ALA H 153   N  LYS F 256           
SHEET    1  GA 7 LEU G  62  GLN G  64  0                                        
SHEET    2  GA 7 LYS G  34  TYR G  39  1  O  PHE G  37   N  TYR G  63           
SHEET    3  GA 7 THR G   8  MET G  12  1  O  TYR G   9   N  VAL G  36           
SHEET    4  GA 7 GLY G  89  HIS G  92  1  O  GLY G  89   N  VAL G  10           
SHEET    5  GA 7 GLY G 140  THR G 146  1  O  SER G 141   N  VAL G  90           
SHEET    6  GA 7 ILE G 183  ALA G 190  1  O  ARG G 184   N  ILE G 142           
SHEET    7  GA 7 ASN G 245  VAL G 248  1  O  ILE G 246   N  SER G 189           
SHEET    1  HA 7 HIS H  61  GLN H  64  0                                        
SHEET    2  HA 7 LYS H  34  TYR H  39  1  O  LEU H  35   N  HIS H  61           
SHEET    3  HA 7 THR H   8  MET H  12  1  O  TYR H   9   N  VAL H  36           
SHEET    4  HA 7 GLY H  89  HIS H  92  1  O  GLY H  89   N  VAL H  10           
SHEET    5  HA 7 GLY H 140  THR H 146  1  O  SER H 141   N  VAL H  90           
SHEET    6  HA 7 ILE H 183  ALA H 190  1  O  ARG H 184   N  ILE H 142           
SHEET    7  HA 7 ASN H 245  VAL H 248  1  O  ILE H 246   N  SER H 189           
SITE     1 AC1 30 GLY A  13  ILE A  14  ALA A  15  SER A  19                    
SITE     2 AC1 30 ILE A  20  ARG A  40  LYS A  41  SER A  44                    
SITE     3 AC1 30 ILE A  65  ASP A  66  VAL A  67  SER A  93                    
SITE     4 AC1 30 ILE A  94  ALA A  95  ILE A 120  THR A 145                    
SITE     5 AC1 30 THR A 146  TYR A 147  LYS A 164  ALA A 190                    
SITE     6 AC1 30 GLY A 191  PRO A 192  ILE A 193  THR A 195                    
SITE     7 AC1 30 SER A 197  MJ5 A1258  HOH A2008  HOH A2009                    
SITE     8 AC1 30 HOH A2010  HOH A2011                                          
SITE     1 AC2  6 ALA A  95  LEU A 102  TYR A 147  TYR A 157                    
SITE     2 AC2  6 SER A 197  NAP A1257                                          
SITE     1 AC3  7 ALA B  95  TYR B 147  TYR B 157  MET B 160                    
SITE     2 AC3  7 SER B 197  ALA B 198  NAP B1258                               
SITE     1 AC4  6 ALA C  95  TYR C 147  TYR C 157  MET C 160                    
SITE     2 AC4  6 SER C 197  NAP C1258                                          
SITE     1 AC5  8 ALA D  95  TYR D 147  TYR D 157  MET D 160                    
SITE     2 AC5  8 SER D 197  ALA D 198  VAL D 201  NAP D1258                    
SITE     1 AC6  8 LEU E 102  TYR E 147  TYR E 157  MET E 160                    
SITE     2 AC6  8 SER E 197  ALA E 198  VAL E 201  NAP E1259                    
SITE     1 AC7  6 ALA F  95  TYR F 147  TYR F 157  MET F 160                    
SITE     2 AC7  6 SER F 197  NAP F1259                                          
SITE     1 AC8  5 TYR G 147  TYR G 157  MET G 160  SER G 197                    
SITE     2 AC8  5 NAP G1259                                                     
SITE     1 AC9  6 TYR H 147  TYR H 157  MET H 160  SER H 197                    
SITE     2 AC9  6 VAL H 201  NAP H1258                                          
SITE     1 BC1  7 LYS B 199  ARG G 103  ALA G 198  LYS G 199                    
SITE     2 BC1  7 VAL G 201  GLY G 203  PHE G 204                               
SITE     1 BC2 31 GLY B  13  ILE B  14  ALA B  15  SER B  19                    
SITE     2 BC2 31 ILE B  20  ARG B  40  LYS B  41  SER B  44                    
SITE     3 BC2 31 ILE B  65  ASP B  66  VAL B  67  SER B  93                    
SITE     4 BC2 31 ILE B  94  ALA B  95  ILE B 120  THR B 145                    
SITE     5 BC2 31 THR B 146  LYS B 164  ALA B 190  GLY B 191                    
SITE     6 BC2 31 PRO B 192  ILE B 193  THR B 195  SER B 197                    
SITE     7 BC2 31 MJ5 B1257  HOH B2010  HOH B2011  HOH B2012                    
SITE     8 BC2 31 HOH B2013  HOH B2098  GLU G 100                               
SITE     1 BC3  4 LYS C 199  ARG F 103  VAL F 201  GLY F 203                    
SITE     1 BC4 31 GLY C  13  ILE C  14  ALA C  15  SER C  19                    
SITE     2 BC4 31 ILE C  20  ARG C  40  LYS C  41  SER C  44                    
SITE     3 BC4 31 ILE C  65  ASP C  66  VAL C  67  SER C  93                    
SITE     4 BC4 31 ILE C  94  ALA C  95  ILE C 120  THR C 145                    
SITE     5 BC4 31 THR C 146  TYR C 147  LYS C 164  ALA C 190                    
SITE     6 BC4 31 GLY C 191  PRO C 192  ILE C 193  THR C 195                    
SITE     7 BC4 31 SER C 197  MJ5 C1257  HOH C2007  HOH C2008                    
SITE     8 BC4 31 HOH C2009  HOH C2011  GLU F 100                               
SITE     1 BC5  7 LYS A 199  ARG E 103  LYS E 199  VAL E 201                    
SITE     2 BC5  7 GLY E 203  PHE E 204  HOH E2091                               
SITE     1 BC6 31 GLY D  13  ILE D  14  ALA D  15  SER D  19                    
SITE     2 BC6 31 ILE D  20  ARG D  40  LYS D  41  SER D  44                    
SITE     3 BC6 31 ILE D  65  ASP D  66  VAL D  67  SER D  93                    
SITE     4 BC6 31 ILE D  94  ALA D  95  ILE D 120  THR D 145                    
SITE     5 BC6 31 THR D 146  TYR D 147  LYS D 164  ALA D 190                    
SITE     6 BC6 31 GLY D 191  PRO D 192  ILE D 193  THR D 195                    
SITE     7 BC6 31 SER D 197  MJ5 D1257  HOH D2003  HOH D2004                    
SITE     8 BC6 31 HOH D2005  HOH D2006  HOH D2064                               
SITE     1 BC7  7 ARG C 103  ALA C 198  VAL C 201  GLY C 203                    
SITE     2 BC7  7 PHE C 204  ASN C 205  LYS F 199                               
SITE     1 BC8 30 HOH A2059  GLY E  13  ILE E  14  ALA E  15                    
SITE     2 BC8 30 SER E  19  ILE E  20  ARG E  40  LYS E  41                    
SITE     3 BC8 30 SER E  44  ILE E  65  ASP E  66  VAL E  67                    
SITE     4 BC8 30 SER E  93  ILE E  94  ALA E  95  ILE E 120                    
SITE     5 BC8 30 THR E 145  THR E 146  TYR E 147  LYS E 164                    
SITE     6 BC8 30 ALA E 190  GLY E 191  PRO E 192  ILE E 193                    
SITE     7 BC8 30 THR E 195  SER E 197  MJ5 E1257  HOH E2008                    
SITE     8 BC8 30 HOH E2009  HOH E2011                                          
SITE     1 BC9  5 ARG B 103  LYS B 199  VAL B 201  GLY B 203                    
SITE     2 BC9  5 LYS G 199                                                     
SITE     1 CC1 32 GLU C 100  GLY F  13  ILE F  14  ALA F  15                    
SITE     2 CC1 32 SER F  19  ILE F  20  ARG F  40  LYS F  41                    
SITE     3 CC1 32 SER F  44  ILE F  65  ASP F  66  VAL F  67                    
SITE     4 CC1 32 SER F  93  ILE F  94  ALA F  95  ILE F 120                    
SITE     5 CC1 32 THR F 145  THR F 146  TYR F 147  LYS F 164                    
SITE     6 CC1 32 ALA F 190  GLY F 191  PRO F 192  ILE F 193                    
SITE     7 CC1 32 THR F 195  SER F 197  MJ5 F1257  HOH F2008                    
SITE     8 CC1 32 HOH F2009  HOH F2010  HOH F2011  HOH F2105                    
SITE     1 CC2  5 VAL A 201  GLY A 203  PHE A 204  ASN A 205                    
SITE     2 CC2  5 LYS E 199                                                     
SITE     1 CC3 31 GLU B 100  GLY G  13  ILE G  14  ALA G  15                    
SITE     2 CC3 31 SER G  19  ILE G  20  ARG G  40  LYS G  41                    
SITE     3 CC3 31 SER G  44  ILE G  65  ASP G  66  VAL G  67                    
SITE     4 CC3 31 SER G  93  ILE G  94  ALA G  95  ILE G 120                    
SITE     5 CC3 31 THR G 145  THR G 146  TYR G 147  LYS G 164                    
SITE     6 CC3 31 ALA G 190  PRO G 192  ILE G 193  THR G 195                    
SITE     7 CC3 31 LEU G 196  SER G 197  MJ5 G1257  HOH G2005                    
SITE     8 CC3 31 HOH G2006  HOH G2007  HOH G2009                               
SITE     1 CC4  5 LYS G   7  ASP G  88  GLY G 140  ARG G 184                    
SITE     2 CC4  5 LEU G 234                                                     
SITE     1 CC5 31 GLY H  13  ILE H  14  ALA H  15  SER H  19                    
SITE     2 CC5 31 ILE H  20  ARG H  40  LYS H  41  SER H  44                    
SITE     3 CC5 31 ILE H  65  ASP H  66  VAL H  67  SER H  93                    
SITE     4 CC5 31 ILE H  94  ALA H  95  THR H 145  THR H 146                    
SITE     5 CC5 31 TYR H 147  LYS H 164  ALA H 190  GLY H 191                    
SITE     6 CC5 31 PRO H 192  ILE H 193  THR H 195  LEU H 196                    
SITE     7 CC5 31 SER H 197  MJ5 H1257  HOH H2003  HOH H2004                    
SITE     8 CC5 31 HOH H2005  HOH H2006  HOH H2066                               
SITE     1 CC6  8 LYS B   7  ASP B  88  GLY B 139  GLY B 140                    
SITE     2 CC6  8 ASN B 182  ARG B 184  LEU B 234  HOH B2089                    
SITE     1 CC7  7 LYS A   7  ASP A  88  GLY A 140  ASN A 182                    
SITE     2 CC7  7 ARG A 184  LEU A 234  HOH A2114                               
SITE     1 CC8  6 ASP E  88  GLY E 140  ARG E 184  LEU E 234                    
SITE     2 CC8  6 ASP E 236  SER E 239                                          
CRYST1   89.860   94.520   94.830  98.17 111.87  97.33 P 1           8          
ORIGX1      1.000000  0.000000  0.000000        0.00000                         
ORIGX2      0.000000  1.000000  0.000000        0.00000                         
ORIGX3      0.000000  0.000000  1.000000        0.00000                         
SCALE1      0.011128  0.001432  0.004866        0.00000                         
SCALE2      0.000000  0.010667  0.002246        0.00000                         
SCALE3      0.000000  0.000000  0.011612        0.00000                         
(ATOM LINES ARE NOT SHOWN.)
END                                                                             
DBGET integrated database retrieval system