Dbfetch

HEADER    DNA                                     14-DEC-94   101D              
TITLE     REFINEMENT OF NETROPSIN BOUND TO DNA: BIAS AND FEEDBACK IN            
TITLE    2 ELECTRON DENSITY MAP INTERPRETATION                                  
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: DNA (5'-D(*CP*GP*CP*GP*AP*AP*TP*TP*(CBR)                   
COMPND   3 P*GP*CP*G)-3');                                                      
COMPND   4 CHAIN: A, B;                                                         
COMPND   5 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 SYNTHETIC: YES                                                       
KEYWDS    B-DNA, DOUBLE HELIX, COMPLEXED WITH DRUG, MODIFIED                    
EXPDTA    X-RAY DIFFRACTION                                                     
AUTHOR    D.S.GOODSELL,M.L.KOPKA,R.E.DICKERSON                                  
REVDAT   2   24-FEB-09 101D    1       VERSN                                    
REVDAT   1   27-FEB-95 101D    0                                                
JRNL        AUTH   D.S.GOODSELL,M.L.KOPKA,R.E.DICKERSON                         
JRNL        TITL   REFINEMENT OF NETROPSIN BOUND TO DNA: BIAS AND               
JRNL        TITL 2 FEEDBACK IN ELECTRON DENSITY MAP INTERPRETATION.             
JRNL        REF    BIOCHEMISTRY                  V.  34  4983 1995              
JRNL        REFN                   ISSN 0006-2960                               
JRNL        PMID   7711020                                                      
JRNL        DOI    10.1021/BI00015A009                                          
REMARK   1                                                                      
REMARK   1 REFERENCE 1                                                          
REMARK   1  AUTH   M.L.KOPKA,C.YOON,D.S.GOODSELL,P.PJURA,R.E.DICKERSON          
REMARK   1  TITL   BINDING OF AN ANTITUMOR DRUG TO DNA. NETROPSIN AND           
REMARK   1  TITL 2 C-G-C-G-A-A-T-T-BRC-G-C-G                                    
REMARK   1  REF    J.MOL.BIOL.                   V. 183   553 1985              
REMARK   1  REFN                   ISSN 0022-2836                               
REMARK   2                                                                      
REMARK   2 RESOLUTION.    2.25 ANGSTROMS.                                       
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : NUCLSQ                                               
REMARK   3   AUTHORS     : WESTHOF,DUMAS,MORAS                                  
REMARK   3                                                                      
REMARK   3  DATA USED IN REFINEMENT.                                            
REMARK   3   RESOLUTION RANGE HIGH (ANGSTROMS) : 2.25                           
REMARK   3   RESOLUTION RANGE LOW  (ANGSTROMS) : 8.00                           
REMARK   3   DATA CUTOFF            (SIGMA(F)) : 2.000                          
REMARK   3   COMPLETENESS FOR RANGE        (%) : NULL                           
REMARK   3   NUMBER OF REFLECTIONS             : 2430                           
REMARK   3                                                                      
REMARK   3  FIT TO DATA USED IN REFINEMENT.                                     
REMARK   3   CROSS-VALIDATION METHOD          : NULL                            
REMARK   3   FREE R VALUE TEST SET SELECTION  : NULL                            
REMARK   3   R VALUE     (WORKING + TEST SET) : 0.163                           
REMARK   3   R VALUE            (WORKING SET) : NULL                            
REMARK   3   FREE R VALUE                     : 0.252                           
REMARK   3   FREE R VALUE TEST SET SIZE   (%) : NULL                            
REMARK   3   FREE R VALUE TEST SET COUNT      : NULL                            
REMARK   3                                                                      
REMARK   3  FIT/AGREEMENT OF MODEL WITH ALL DATA.                               
REMARK   3   R VALUE   (WORKING + TEST SET, NO CUTOFF) : NULL                   
REMARK   3   R VALUE          (WORKING SET, NO CUTOFF) : NULL                   
REMARK   3   FREE R VALUE                  (NO CUTOFF) : NULL                   
REMARK   3   FREE R VALUE TEST SET SIZE (%, NO CUTOFF) : NULL                   
REMARK   3   FREE R VALUE TEST SET COUNT   (NO CUTOFF) : NULL                   
REMARK   3   TOTAL NUMBER OF REFLECTIONS   (NO CUTOFF) : NULL                   
REMARK   3                                                                      
REMARK   3  NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT.                    
REMARK   3   PROTEIN ATOMS            : 0                                       
REMARK   3   NUCLEIC ACID ATOMS       : 486                                     
REMARK   3   HETEROGEN ATOMS          : 37                                      
REMARK   3   SOLVENT ATOMS            : 33                                      
REMARK   3                                                                      
REMARK   3  B VALUES.                                                           
REMARK   3   FROM WILSON PLOT           (A**2) : NULL                           
REMARK   3   MEAN B VALUE      (OVERALL, A**2) : NULL                           
REMARK   3   OVERALL ANISOTROPIC B VALUE.                                       
REMARK   3    B11 (A**2) : NULL                                                 
REMARK   3    B22 (A**2) : NULL                                                 
REMARK   3    B33 (A**2) : NULL                                                 
REMARK   3    B12 (A**2) : NULL                                                 
REMARK   3    B13 (A**2) : NULL                                                 
REMARK   3    B23 (A**2) : NULL                                                 
REMARK   3                                                                      
REMARK   3  ESTIMATED COORDINATE ERROR.                                         
REMARK   3   ESD FROM LUZZATI PLOT        (A) : NULL                            
REMARK   3   ESD FROM SIGMAA              (A) : NULL                            
REMARK   3   LOW RESOLUTION CUTOFF        (A) : NULL                            
REMARK   3                                                                      
REMARK   3  RMS DEVIATIONS FROM IDEAL VALUES.                                   
REMARK   3   DISTANCE RESTRAINTS.                    RMS     SIGMA              
REMARK   3    SUGAR-BASE BOND DISTANCE        (A) : 0.024 ; 0.030               
REMARK   3    SUGAR-BASE BOND ANGLE DISTANCE  (A) : 0.040 ; 0.040               
REMARK   3    PHOSPHATE BONDS DISTANCE        (A) : 0.026 ; 0.040               
REMARK   3    PHOSPHATE BOND ANGLE, H-BOND    (A) : 0.057 ; 0.050               
REMARK   3                                                                      
REMARK   3   PLANE RESTRAINT                  (A) : 0.014 ; 0.020               
REMARK   3   CHIRAL-CENTER RESTRAINT       (A**3) : 0.161 ; 0.150               
REMARK   3                                                                      
REMARK   3   NON-BONDED CONTACT RESTRAINTS.                                     
REMARK   3    SINGLE TORSION CONTACT          (A) : 0.093 ; 0.100               
REMARK   3    MULTIPLE TORSION CONTACT        (A) : 0.097 ; 0.100               
REMARK   3                                                                      
REMARK   3  ISOTROPIC THERMAL FACTOR RESTRAINTS.    RMS    SIGMA                
REMARK   3   SUGAR-BASE BONDS             (A**2) : 4.282 ; 6.000                
REMARK   3   SUGAR-BASE ANGLES            (A**2) : 4.990 ; 6.000                
REMARK   3   PHOSPHATE BONDS              (A**2) : 5.693 ; 6.000                
REMARK   3   PHOSPHATE BOND ANGLE, H-BOND (A**2) : 5.227 ; 6.000                
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 101D COMPLIES WITH FORMAT V. 3.15, 01-DEC-08                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL.                                
REMARK 200                                                                      
REMARK 200 EXPERIMENTAL DETAILS                                                 
REMARK 200  EXPERIMENT TYPE                : X-RAY DIFFRACTION                  
REMARK 200  DATE OF DATA COLLECTION        : NULL                               
REMARK 200  TEMPERATURE           (KELVIN) : NULL                               
REMARK 200  PH                             : NULL                               
REMARK 200  NUMBER OF CRYSTALS USED        : NULL                               
REMARK 200                                                                      
REMARK 200  SYNCHROTRON              (Y/N) : NULL                               
REMARK 200  RADIATION SOURCE               : NULL                               
REMARK 200  BEAMLINE                       : NULL                               
REMARK 200  X-RAY GENERATOR MODEL          : NULL                               
REMARK 200  MONOCHROMATIC OR LAUE    (M/L) : NULL                               
REMARK 200  WAVELENGTH OR RANGE        (A) : NULL                               
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 : NULL                               
REMARK 200  DATA SCALING SOFTWARE          : NULL                               
REMARK 200                                                                      
REMARK 200  NUMBER OF UNIQUE REFLECTIONS   : NULL                               
REMARK 200  RESOLUTION RANGE HIGH      (A) : NULL                               
REMARK 200  RESOLUTION RANGE LOW       (A) : NULL                               
REMARK 200  REJECTION CRITERIA  (SIGMA(I)) : NULL                               
REMARK 200                                                                      
REMARK 200 OVERALL.                                                             
REMARK 200  COMPLETENESS FOR RANGE     (%) : NULL                               
REMARK 200  DATA REDUNDANCY                : NULL                               
REMARK 200  R MERGE                    (I) : NULL                               
REMARK 200  R SYM                      (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR THE DATA SET  : NULL                               
REMARK 200                                                                      
REMARK 200 IN THE HIGHEST RESOLUTION SHELL.                                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL                     
REMARK 200  HIGHEST RESOLUTION SHELL, RANGE LOW  (A) : NULL                     
REMARK 200  COMPLETENESS FOR SHELL     (%) : NULL                               
REMARK 200  DATA REDUNDANCY IN SHELL       : NULL                               
REMARK 200  R MERGE FOR SHELL          (I) : NULL                               
REMARK 200  R SYM FOR SHELL            (I) : NULL                               
REMARK 200  <I/SIGMA(I)> FOR SHELL         : NULL                               
REMARK 200                                                                      
REMARK 200 DIFFRACTION PROTOCOL: NULL                                           
REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL                         
REMARK 200 SOFTWARE USED: NULL                                                  
REMARK 200 STARTING MODEL: NULL                                                 
REMARK 200                                                                      
REMARK 200 REMARK: NULL                                                         
REMARK 280                                                                      
REMARK 280 CRYSTAL                                                              
REMARK 280 SOLVENT CONTENT, VS   (%): 38.45                                     
REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.00                     
REMARK 280                                                                      
REMARK 280 CRYSTALLIZATION CONDITIONS: NULL                                     
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY                                            
REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21                       
REMARK 290                                                                      
REMARK 290      SYMOP   SYMMETRY                                                
REMARK 290     NNNMMM   OPERATOR                                                
REMARK 290       1555   X,Y,Z                                                   
REMARK 290       2555   -X+1/2,-Y,Z+1/2                                         
REMARK 290       3555   -X,Y+1/2,-Z+1/2                                         
REMARK 290       4555   X+1/2,-Y+1/2,-Z                                         
REMARK 290                                                                      
REMARK 290     WHERE NNN -> OPERATOR NUMBER                                     
REMARK 290           MMM -> TRANSLATION VECTOR                                  
REMARK 290                                                                      
REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS                            
REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM             
REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY                
REMARK 290 RELATED MOLECULES.                                                   
REMARK 290   SMTRY1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 290   SMTRY1   2 -1.000000  0.000000  0.000000       12.13500            
REMARK 290   SMTRY2   2  0.000000 -1.000000  0.000000        0.00000            
REMARK 290   SMTRY3   2  0.000000  0.000000  1.000000       31.78500            
REMARK 290   SMTRY1   3 -1.000000  0.000000  0.000000        0.00000            
REMARK 290   SMTRY2   3  0.000000  1.000000  0.000000       19.81000            
REMARK 290   SMTRY3   3  0.000000  0.000000 -1.000000       31.78500            
REMARK 290   SMTRY1   4  1.000000  0.000000  0.000000       12.13500            
REMARK 290   SMTRY2   4  0.000000 -1.000000  0.000000       19.81000            
REMARK 290   SMTRY3   4  0.000000  0.000000 -1.000000        0.00000            
REMARK 290                                                                      
REMARK 290 REMARK: NULL                                                         
REMARK 300                                                                      
REMARK 300 BIOMOLECULE: 1                                                       
REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM                
REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN                  
REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON               
REMARK 300 BURIED SURFACE AREA.                                                 
REMARK 350                                                                      
REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN           
REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE                
REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS          
REMARK 350 GIVEN BELOW.  BOTH NON-CRYSTALLOGRAPHIC AND                          
REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN.                               
REMARK 350                                                                      
REMARK 350 BIOMOLECULE: 1                                                       
REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC                           
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B                                  
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 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS                                      
REMARK 500                                                                      
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES              
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE               
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                 
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3)               
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999                        
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996                     
REMARK 500                                                                      
REMARK 500  M RES CSSEQI ATM1   RES CSSEQI ATM2   DEVIATION                     
REMARK 500     DC A   1   C2'    DC A   1   C1'    -0.069                       
REMARK 500     DC A   1   O4'    DC A   1   C1'     0.068                       
REMARK 500     DC A   1   O4'    DC A   1   C4'    -0.071                       
REMARK 500     DG A   2   N7     DG A   2   C8     -0.038                       
REMARK 500     DC A   3   C2'    DC A   3   C1'    -0.067                       
REMARK 500     DG A   4   C4'    DG A   4   C3'     0.061                       
REMARK 500     DA A   6   C2'    DA A   6   C1'    -0.090                       
REMARK 500     DT A   7   O4'    DT A   7   C1'     0.067                       
REMARK 500     DT A   7   O4'    DT A   7   C4'    -0.064                       
REMARK 500     DT A   8   O4'    DT A   8   C1'     0.072                       
REMARK 500     DT A   8   O3'    DT A   8   C3'    -0.038                       
REMARK 500     DC A  11   C2'    DC A  11   C1'    -0.069                       
REMARK 500     DC A  11   O4'    DC A  11   C1'     0.083                       
REMARK 500     DG B  14   C5'    DG B  14   C4'     0.050                       
REMARK 500     DG B  14   O4'    DG B  14   C1'     0.068                       
REMARK 500     DC B  15   O3'    DC B  15   C3'    -0.039                       
REMARK 500     DA B  17   N7     DA B  17   C8     -0.056                       
REMARK 500     DT B  19   O3'    DT B  19   C3'    -0.063                       
REMARK 500     DT B  20   C2'    DT B  20   C1'    -0.069                       
REMARK 500     DG B  24   O4'    DG B  24   C4'    -0.071                       
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: COVALENT BOND ANGLES                                       
REMARK 500                                                                      
REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES              
REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE               
REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN               
REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                 
REMARK 500                                                                      
REMARK 500 STANDARD TABLE:                                                      
REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1)              
REMARK 500                                                                      
REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999                        
REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996                     
REMARK 500                                                                      
REMARK 500  M RES CSSEQI ATM1   ATM2   ATM3                                     
REMARK 500     DC A   1   C5' -  C4' -  O4' ANGL. DEV. =   9.7 DEGREES          
REMARK 500     DC A   1   C2  -  N3  -  C4  ANGL. DEV. =   4.1 DEGREES          
REMARK 500     DC A   1   N3  -  C4  -  C5  ANGL. DEV. =  -5.2 DEGREES          
REMARK 500     DC A   1   C5  -  C4  -  N4  ANGL. DEV. =   7.4 DEGREES          
REMARK 500     DG A   2   OP1 -  P   -  OP2 ANGL. DEV. = -10.6 DEGREES          
REMARK 500     DG A   2   O5' -  C5' -  C4' ANGL. DEV. =  -5.5 DEGREES          
REMARK 500     DC A   3   N3  -  C4  -  C5  ANGL. DEV. =  -2.5 DEGREES          
REMARK 500     DG A   2   C3' -  O3' -  P   ANGL. DEV. =  19.2 DEGREES          
REMARK 500     DG A   4   C5' -  C4' -  O4' ANGL. DEV. =  12.2 DEGREES          
REMARK 500     DG A   4   O4' -  C1' -  N9  ANGL. DEV. =   6.8 DEGREES          
REMARK 500     DG A   4   C6  -  N1  -  C2  ANGL. DEV. =  -4.7 DEGREES          
REMARK 500     DG A   4   N1  -  C2  -  N3  ANGL. DEV. =   4.7 DEGREES          
REMARK 500     DG A   4   C5  -  C6  -  N1  ANGL. DEV. =   3.9 DEGREES          
REMARK 500     DG A   4   N3  -  C2  -  N2  ANGL. DEV. =  -5.3 DEGREES          
REMARK 500     DG A   4   C5  -  C6  -  O6  ANGL. DEV. =  -3.7 DEGREES          
REMARK 500     DA A   5   C6  -  N1  -  C2  ANGL. DEV. =   4.0 DEGREES          
REMARK 500     DA A   5   N1  -  C2  -  N3  ANGL. DEV. =  -3.1 DEGREES          
REMARK 500     DA A   6   O4' -  C1' -  N9  ANGL. DEV. =  -5.5 DEGREES          
REMARK 500     DA A   6   C6  -  N1  -  C2  ANGL. DEV. =   4.0 DEGREES          
REMARK 500     DA A   6   C5  -  C6  -  N1  ANGL. DEV. =  -3.1 DEGREES          
REMARK 500     DA A   5   C3' -  O3' -  P   ANGL. DEV. =   8.7 DEGREES          
REMARK 500     DT A   7   OP1 -  P   -  OP2 ANGL. DEV. = -13.4 DEGREES          
REMARK 500     DT A   7   O5' -  P   -  OP2 ANGL. DEV. =   8.5 DEGREES          
REMARK 500     DT A   7   O5' -  C5' -  C4' ANGL. DEV. =  -7.6 DEGREES          
REMARK 500     DT A   7   O4' -  C1' -  C2' ANGL. DEV. =  -5.9 DEGREES          
REMARK 500     DT A   7   C2  -  N3  -  C4  ANGL. DEV. =  -6.6 DEGREES          
REMARK 500     DT A   7   N3  -  C4  -  C5  ANGL. DEV. =   5.6 DEGREES          
REMARK 500     DA A   6   C3' -  O3' -  P   ANGL. DEV. =  10.1 DEGREES          
REMARK 500     DT A   8   N1  -  C2  -  N3  ANGL. DEV. =   3.9 DEGREES          
REMARK 500     DT A   8   C2  -  N3  -  C4  ANGL. DEV. =  -4.6 DEGREES          
REMARK 500     DT A   8   N3  -  C4  -  C5  ANGL. DEV. =   3.6 DEGREES          
REMARK 500     DT A   8   N3  -  C4  -  O4  ANGL. DEV. =  -3.8 DEGREES          
REMARK 500     DT A   7   C3' -  O3' -  P   ANGL. DEV. =  14.7 DEGREES          
REMARK 500     DG A  10   OP1 -  P   -  OP2 ANGL. DEV. = -10.7 DEGREES          
REMARK 500     DG A  10   P   -  O5' -  C5' ANGL. DEV. =  18.3 DEGREES          
REMARK 500     DG A  10   O4' -  C1' -  N9  ANGL. DEV. =   2.8 DEGREES          
REMARK 500     DG A  10   C6  -  N1  -  C2  ANGL. DEV. =  -4.8 DEGREES          
REMARK 500     DG A  10   N1  -  C2  -  N3  ANGL. DEV. =   4.0 DEGREES          
REMARK 500     DG A  10   C5  -  C6  -  N1  ANGL. DEV. =   3.9 DEGREES          
REMARK 500     DC A  11   OP1 -  P   -  OP2 ANGL. DEV. = -10.0 DEGREES          
REMARK 500     DC A  11   O4' -  C1' -  N1  ANGL. DEV. =  -4.8 DEGREES          
REMARK 500     DG A  10   C3' -  O3' -  P   ANGL. DEV. =  12.1 DEGREES          
REMARK 500     DG A  12   OP1 -  P   -  OP2 ANGL. DEV. = -13.0 DEGREES          
REMARK 500     DG A  12   O5' -  C5' -  C4' ANGL. DEV. =  -8.2 DEGREES          
REMARK 500     DG A  12   O4' -  C1' -  C2' ANGL. DEV. =   3.7 DEGREES          
REMARK 500     DG A  12   C2  -  N3  -  C4  ANGL. DEV. =   3.3 DEGREES          
REMARK 500     DC B  13   O5' -  C5' -  C4' ANGL. DEV. =  -4.9 DEGREES          
REMARK 500     DC B  13   N3  -  C4  -  C5  ANGL. DEV. =  -2.5 DEGREES          
REMARK 500     DC B  13   N1  -  C2  -  O2  ANGL. DEV. =   3.8 DEGREES          
REMARK 500     DG B  14   O5' -  C5' -  C4' ANGL. DEV. =  -6.3 DEGREES          
REMARK 500                                                                      
REMARK 500 THIS ENTRY HAS      92 ANGLE DEVIATIONS.                             
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 525                                                                      
REMARK 525 SOLVENT                                                              
REMARK 525                                                                      
REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT                    
REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST                  
REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT                 
REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE                       
REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER;                             
REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE                  
REMARK 525 NUMBER; I=INSERTION CODE):                                           
REMARK 525                                                                      
REMARK 525  M RES CSSEQI                                                        
REMARK 525    HOH A  46        DISTANCE =  5.16 ANGSTROMS                       
REMARK 525    HOH B  57        DISTANCE =  6.18 ANGSTROMS                       
REMARK 620                                                                      
REMARK 620 METAL COORDINATION                                                   
REMARK 620  (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;              
REMARK 620  SSEQ=SEQUENCE NUMBER; I=INSERTION CODE):                            
REMARK 620                                                                      
REMARK 620 COORDINATION ANGLES FOR:  M RES CSSEQI METAL                         
REMARK 620                              MG A  26  MG                            
REMARK 620 N RES CSSEQI ATOM                                                    
REMARK 620 1 HOH B  62   O                                                      
REMARK 620 2 HOH A  61   O    76.9                                              
REMARK 620 3 HOH B  60   O    80.2  88.3                                        
REMARK 620 N                    1     2                                         
REMARK 800                                                                      
REMARK 800 SITE                                                                 
REMARK 800 SITE_IDENTIFIER: AC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NT B 25                   
REMARK 800 SITE_IDENTIFIER: AC2                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MG A 26                   
DBREF  101D A    1    12  PDB    101D     101D             1     12             
DBREF  101D B   13    24  PDB    101D     101D            13     24             
SEQRES   1 A   12   DC  DG  DC  DG  DA  DA  DT  DT CBR  DG  DC  DG              
SEQRES   1 B   12   DC  DG  DC  DG  DA  DA  DT  DT CBR  DG  DC  DG              
MODRES 101D CBR A    9   DC                                                     
MODRES 101D CBR B   21   DC                                                     
HET    CBR  A   9      20                                                       
HET    CBR  B  21      20                                                       
HET     NT  B  25      31                                                       
HET     MG  A  26       1                                                       
HETNAM     CBR 5-BROMO-2'-DEOXY-CYTIDINE-5'-MONOPHOSPHATE                       
HETNAM      NT NETROPSIN                                                        
HETNAM      MG MAGNESIUM ION                                                    
FORMUL   1  CBR    2(C9 H13 BR N3 O7 P)                                         
FORMUL   3   NT    C18 H26 N10 O3                                               
FORMUL   4   MG    MG 2+                                                        
FORMUL   5  HOH   *36(H2 O)                                                     
LINK        MG    MG A  26                 O   HOH B  62     1555   1555  2.11  
LINK        MG    MG A  26                 O   HOH A  61     1555   1555  2.16  
LINK        MG    MG A  26                 O   HOH B  60     1555   1555  2.10  
LINK         O3'  DT A   8                 P   CBR A   9     1555   1555  1.62  
LINK         O3' CBR A   9                 P    DG A  10     1555   1555  1.55  
LINK         O3'  DT B  20                 P   CBR B  21     1555   1555  1.58  
LINK         O3' CBR B  21                 P    DG B  22     1555   1555  1.60  
SITE     1 AC1  9  DA A   6   DT A   7   DT A   8   DA B  17                    
SITE     2 AC1  9  DA B  18   DT B  19   DT B  20  CBR B  21                    
SITE     3 AC1  9  DG B  22                                                     
SITE     1 AC2  3 HOH A  61  HOH B  60  HOH B  62                               
CRYST1   24.270   39.620   63.570  90.00  90.00  90.00 P 21 21 21    8          
ORIGX1      1.000000  0.000000  0.000000        0.00000                         
ORIGX2      0.000000  1.000000  0.000000        0.00000                         
ORIGX3      0.000000  0.000000  1.000000        0.00000                         
SCALE1      0.041203  0.000000  0.000000        0.00000                         
SCALE2      0.000000  0.025240  0.000000        0.00000                         
SCALE3      0.000000  0.000000  0.015731        0.00000                         
ATOM      1  O5'  DC A   1      18.598  34.469  24.672  1.00 23.24           O  
ATOM      2  C5'  DC A   1      19.853  34.632  23.883  1.00  8.00           C  
ATOM      3  C4'  DC A   1      20.375  33.233  23.597  1.00  8.78           C  
ATOM      4  O4'  DC A   1      19.588  32.144  23.890  1.00  4.39           O  
ATOM      5  C3'  DC A   1      20.724  33.087  22.103  1.00  7.95           C  
ATOM      6  O3'  DC A   1      22.134  32.896  22.052  1.00  9.69           O  
ATOM      7  C2'  DC A   1      19.831  31.942  21.627  1.00  6.58           C  
ATOM      8  C1'  DC A   1      19.540  31.137  22.796  1.00  1.06           C  
ATOM      9  N1   DC A   1      18.224  30.436  22.936  1.00  0.29           N  
ATOM     10  C2   DC A   1      18.312  29.192  23.521  1.00  0.00           C  
ATOM     11  O2   DC A   1      19.377  28.685  23.820  1.00  3.13           O  
ATOM     12  N3   DC A   1      17.176  28.507  23.712  1.00  0.88           N  
ATOM     13  C4   DC A   1      15.928  28.994  23.419  1.00  0.48           C  
ATOM     14  N4   DC A   1      14.909  28.182  23.705  1.00  0.00           N  
ATOM     15  C5   DC A   1      15.868  30.262  22.879  1.00  0.82           C  
ATOM     16  C6   DC A   1      17.011  30.931  22.644  1.00  0.00           C  
ATOM     17  P    DG A   2      22.882  32.793  20.648  1.00 16.46           P  
ATOM     18  OP1  DG A   2      24.263  33.416  20.654  1.00 19.66           O  
ATOM     19  OP2  DG A   2      22.030  33.499  19.624  1.00 15.08           O  
ATOM     20  O5'  DG A   2      22.828  31.228  20.393  1.00 11.47           O  
ATOM     21  C5'  DG A   2      23.183  30.250  21.391  1.00 12.48           C  
ATOM     22  C4'  DG A   2      23.275  28.946  20.609  1.00  9.02           C  
ATOM     23  O4'  DG A   2      22.061  28.249  20.845  1.00  8.75           O  
ATOM     24  C3'  DG A   2      23.445  28.994  19.090  1.00  6.66           C  
ATOM     25  O3'  DG A   2      24.357  27.995  18.651  1.00 12.59           O  
ATOM     26  C2'  DG A   2      22.047  28.780  18.562  1.00  4.95           C  
ATOM     27  C1'  DG A   2      21.484  27.881  19.630  1.00  1.69           C  
ATOM     28  N9   DG A   2      20.028  27.995  19.745  1.00  0.00           N  
ATOM     29  C8   DG A   2      19.202  29.057  19.465  1.00  0.00           C  
ATOM     30  N7   DG A   2      17.972  28.812  19.643  1.00  0.00           N  
ATOM     31  C5   DG A   2      17.933  27.484  20.094  1.00  0.00           C  
ATOM     32  C6   DG A   2      16.841  26.656  20.495  1.00  0.00           C  
ATOM     33  O6   DG A   2      15.678  26.926  20.476  1.00  0.00           O  
ATOM     34  N1   DG A   2      17.234  25.412  20.895  1.00  0.00           N  
ATOM     35  C2   DG A   2      18.574  25.000  20.857  1.00  0.90           C  
ATOM     36  N2   DG A   2      18.763  23.709  21.226  1.00  0.00           N  
ATOM     37  N3   DG A   2      19.613  25.749  20.533  1.00  0.00           N  
ATOM     38  C4   DG A   2      19.215  26.965  20.152  1.00  0.00           C  
ATOM     39  P    DC A   3      25.149  27.599  17.342  1.00 13.81           P  
ATOM     40  OP1  DC A   3      26.588  27.904  17.704  1.00 10.74           O  
ATOM     41  OP2  DC A   3      24.552  28.451  16.261  1.00  1.67           O  
ATOM     42  O5'  DC A   3      24.787  26.062  16.967  1.00  0.28           O  
ATOM     43  C5'  DC A   3      24.867  24.929  17.736  1.00  8.45           C  
ATOM     44  C4'  DC A   3      23.617  24.125  17.711  1.00  2.36           C  
ATOM     45  O4'  DC A   3      22.438  24.794  18.086  1.00  5.43           O  
ATOM     46  C3'  DC A   3      23.294  23.602  16.299  1.00 11.82           C  
ATOM     47  O3'  DC A   3      24.069  22.393  16.026  1.00  9.10           O  
ATOM     48  C2'  DC A   3      21.799  23.304  16.382  1.00  3.92           C  
ATOM     49  C1'  DC A   3      21.326  23.942  17.596  1.00  0.00           C  
ATOM     50  N1   DC A   3      20.207  24.794  17.215  1.00  0.00           N  
ATOM     51  C2   DC A   3      18.931  24.434  17.558  1.00  0.68           C  
ATOM     52  O2   DC A   3      18.717  23.419  18.187  1.00  4.99           O  
ATOM     53  N3   DC A   3      17.899  25.285  17.240  1.00  0.00           N  
ATOM     54  C4   DC A   3      18.115  26.446  16.611  1.00  3.09           C  
ATOM     55  N4   DC A   3      17.108  27.290  16.312  1.00  0.11           N  
ATOM     56  C5   DC A   3      19.462  26.811  16.242  1.00  3.95           C  
ATOM     57  C6   DC A   3      20.445  25.983  16.554  1.00  3.17           C  
ATOM     58  P    DG A   4      23.981  21.716  14.596  1.00  6.01           P  
ATOM     59  OP1  DG A   4      25.377  21.426  14.195  1.00 20.32           O  
ATOM     60  OP2  DG A   4      23.253  22.659  13.674  1.00  9.28           O  
ATOM     61  O5'  DG A   4      22.991  20.464  14.818  1.00 12.36           O  
ATOM     62  C5'  DG A   4      23.013  19.497  15.854  1.00  0.00           C  
ATOM     63  C4'  DG A   4      21.695  18.816  15.981  1.00  6.13           C  
ATOM     64  O4'  DG A   4      20.513  19.525  16.179  1.00  0.00           O  
ATOM     65  C3'  DG A   4      21.353  17.932  14.704  1.00  3.17           C  
ATOM     66  O3'  DG A   4      20.646  16.842  15.193  1.00  0.00           O  
ATOM     67  C2'  DG A   4      20.540  18.891  13.877  1.00  2.97           C  
ATOM     68  C1'  DG A   4      19.741  19.560  15.009  1.00  0.00           C  
ATOM     69  N9   DG A   4      19.421  20.896  14.519  1.00  0.00           N  
ATOM     70  C8   DG A   4      20.103  21.815  13.782  1.00  0.00           C  
ATOM     71  N7   DG A   4      19.452  22.912  13.585  1.00  0.00           N  
ATOM     72  C5   DG A   4      18.222  22.706  14.163  1.00  0.00           C  
ATOM     73  C6   DG A   4      17.059  23.518  14.278  1.00  0.95           C  
ATOM     74  O6   DG A   4      16.938  24.695  13.795  1.00  5.42           O  
ATOM     75  N1   DG A   4      16.018  22.960  14.983  1.00  0.00           N  
ATOM     76  C2   DG A   4      16.149  21.724  15.543  1.00  0.00           C  
ATOM     77  N2   DG A   4      15.084  21.244  16.204  1.00  0.46           N  
ATOM     78  N3   DG A   4      17.181  20.892  15.479  1.00  0.00           N  
ATOM     79  C4   DG A   4      18.181  21.466  14.755  1.00  2.17           C  
ATOM     80  P    DA A   5      20.047  15.713  14.291  1.00  7.55           P  
ATOM     81  OP1  DA A   5      20.156  14.338  14.856  1.00 14.37           O  
ATOM     82  OP2  DA A   5      20.785  15.872  13.045  1.00 10.20           O  
ATOM     83  O5'  DA A   5      18.501  16.280  14.284  1.00 10.75           O  
ATOM     84  C5'  DA A   5      17.887  16.387  15.594  1.00  9.60           C  
ATOM     85  C4'  DA A   5      16.397  16.256  15.556  1.00  6.17           C  
ATOM     86  O4'  DA A   5      15.819  17.508  15.136  1.00  5.26           O  
ATOM     87  C3'  DA A   5      15.836  15.214  14.621  1.00  6.94           C  
ATOM     88  O3'  DA A   5      14.598  14.663  15.022  1.00  7.93           O  
ATOM     89  C2'  DA A   5      15.831  16.010  13.273  1.00  6.24           C  
ATOM     90  C1'  DA A   5      15.377  17.369  13.725  1.00  0.41           C  
ATOM     91  N9   DA A   5      16.001  18.471  12.962  1.00  0.00           N  
ATOM     92  C8   DA A   5      17.244  18.522  12.371  1.00  0.00           C  
ATOM     93  N7   DA A   5      17.516  19.640  11.830  1.00  0.00           N  
ATOM     94  C5   DA A   5      16.431  20.436  12.091  1.00  0.10           C  
ATOM     95  C6   DA A   5      16.089  21.775  11.748  1.00  0.00           C  
ATOM     96  N6   DA A   5      16.853  22.572  11.048  1.00  1.87           N  
ATOM     97  N1   DA A   5      14.873  22.187  12.186  1.00  0.00           N  
ATOM     98  C2   DA A   5      14.050  21.395  12.854  1.00  0.00           C  
ATOM     99  N3   DA A   5      14.288  20.155  13.210  1.00  0.00           N  
ATOM    100  C4   DA A   5      15.475  19.711  12.784  1.00  0.00           C  
ATOM    101  P    DA A   6      13.535  13.819  14.132  1.00  4.64           P  
ATOM    102  OP1  DA A   6      12.528  13.384  15.130  1.00 10.89           O  
ATOM    103  OP2  DA A   6      14.203  12.766  13.413  1.00  7.71           O  
ATOM    104  O5'  DA A   6      12.810  14.964  13.242  1.00 13.07           O  
ATOM    105  C5'  DA A   6      11.951  15.816  14.062  1.00  2.46           C  
ATOM    106  C4'  DA A   6      10.849  16.450  13.235  1.00  0.77           C  
ATOM    107  O4'  DA A   6      11.407  17.484  12.498  1.00  0.40           O  
ATOM    108  C3'  DA A   6      10.121  15.602  12.212  1.00  3.83           C  
ATOM    109  O3'  DA A   6       8.769  15.967  12.161  1.00  8.17           O  
ATOM    110  C2'  DA A   6      10.868  15.943  10.902  1.00  3.45           C  
ATOM    111  C1'  DA A   6      11.232  17.310  11.099  1.00  0.00           C  
ATOM    112  N9   DA A   6      12.531  17.746  10.559  1.00  3.73           N  
ATOM    113  C8   DA A   6      13.766  17.203  10.419  1.00  0.00           C  
ATOM    114  N7   DA A   6      14.635  17.987   9.866  1.00  0.00           N  
ATOM    115  C5   DA A   6      13.950  19.164   9.637  1.00  1.08           C  
ATOM    116  C6   DA A   6      14.322  20.412   9.046  1.00  0.00           C  
ATOM    117  N6   DA A   6      15.533  20.733   8.588  1.00  0.00           N  
ATOM    118  N1   DA A   6      13.327  21.316   8.970  1.00  0.00           N  
ATOM    119  C2   DA A   6      12.057  21.062   9.440  1.00  2.98           C  
ATOM    120  N3   DA A   6      11.637  19.957  10.006  1.00  0.00           N  
ATOM    121  C4   DA A   6      12.647  19.057  10.076  1.00  0.08           C  
ATOM    122  P    DT A   7       7.606  15.436  11.214  1.00  1.53           P  
ATOM    123  OP1  DT A   7       6.439  14.854  12.072  1.00  8.02           O  
ATOM    124  OP2  DT A   7       8.145  14.319  10.451  1.00  3.15           O  
ATOM    125  O5'  DT A   7       7.077  16.688  10.457  1.00  5.18           O  
ATOM    126  C5'  DT A   7       7.203  18.094  10.781  1.00  2.59           C  
ATOM    127  C4'  DT A   7       7.373  18.716   9.402  1.00  0.14           C  
ATOM    128  O4'  DT A   7       8.715  18.724   9.071  1.00  0.00           O  
ATOM    129  C3'  DT A   7       6.628  18.114   8.201  1.00  0.00           C  
ATOM    130  O3'  DT A   7       5.810  19.160   7.660  1.00 11.81           O  
ATOM    131  C2'  DT A   7       7.725  17.865   7.183  1.00  1.18           C  
ATOM    132  C1'  DT A   7       8.730  18.919   7.597  1.00  2.49           C  
ATOM    133  N1   DT A   7      10.104  18.653   7.209  1.00  1.91           N  
ATOM    134  C2   DT A   7      10.822  19.782   6.732  1.00  8.72           C  
ATOM    135  O2   DT A   7      10.300  20.900   6.560  1.00  0.61           O  
ATOM    136  N3   DT A   7      12.152  19.568   6.363  1.00  2.81           N  
ATOM    137  C4   DT A   7      12.727  18.344   6.522  1.00  0.00           C  
ATOM    138  O4   DT A   7      13.950  18.225   6.198  1.00  4.45           O  
ATOM    139  C5   DT A   7      11.992  17.262   7.063  1.00  0.00           C  
ATOM    140  C7   DT A   7      12.681  15.943   7.228  1.00  0.00           C  
ATOM    141  C6   DT A   7      10.701  17.453   7.380  1.00  0.00           C  
ATOM    142  P    DT A   8       4.512  19.196   6.732  1.00  4.24           P  
ATOM    143  OP1  DT A   8       3.405  19.529   7.641  1.00  8.40           O  
ATOM    144  OP2  DT A   8       4.691  17.912   6.046  1.00 10.54           O  
ATOM    145  O5'  DT A   8       4.701  20.353   5.658  1.00  4.41           O  
ATOM    146  C5'  DT A   8       5.412  21.537   5.848  1.00  0.00           C  
ATOM    147  C4'  DT A   8       6.165  21.799   4.596  1.00  5.60           C  
ATOM    148  O4'  DT A   8       7.446  21.224   4.660  1.00  0.00           O  
ATOM    149  C3'  DT A   8       5.517  21.276   3.274  1.00  0.00           C  
ATOM    150  O3'  DT A   8       4.653  22.235   2.784  1.00 12.82           O  
ATOM    151  C2'  DT A   8       6.723  21.014   2.435  1.00  0.13           C  
ATOM    152  C1'  DT A   8       7.927  21.205   3.248  1.00  0.00           C  
ATOM    153  N1   DT A   8       8.919  20.127   3.159  1.00  0.41           N  
ATOM    154  C2   DT A   8      10.174  20.468   2.721  1.00  3.05           C  
ATOM    155  O2   DT A   8      10.463  21.613   2.352  1.00  7.82           O  
ATOM    156  N3   DT A   8      11.138  19.493   2.670  1.00  0.00           N  
ATOM    157  C4   DT A   8      10.912  18.229   3.070  1.00  0.00           C  
ATOM    158  O4   DT A   8      11.878  17.429   2.950  1.00  2.32           O  
ATOM    159  C5   DT A   8       9.618  17.881   3.541  1.00  1.61           C  
ATOM    160  C7   DT A   8       9.303  16.454   3.948  1.00  0.00           C  
ATOM    161  C6   DT A   8       8.662  18.843   3.560  1.00  1.93           C  
HETATM  162 BR   CBR A   9       7.026  17.789   0.210  1.00 30.76          BR  
HETATM  163  P   CBR A   9       4.005  22.841   1.424  1.00 10.95           P  
HETATM  164  OP1 CBR A   9       3.257  24.081   1.799  1.00 13.20           O  
HETATM  165  OP2 CBR A   9       3.434  21.541   0.947  1.00 24.39           O  
HETATM  166  O5' CBR A   9       5.165  23.174   0.394  1.00 23.52           O  
HETATM  167  N1  CBR A   9       9.084  20.880  -1.297  1.00 13.10           N  
HETATM  168  C6  CBR A   9       8.084  19.984  -0.992  1.00  7.56           C  
HETATM  169  C2  CBR A   9      10.397  20.535  -1.221  1.00  4.96           C  
HETATM  170  O2  CBR A   9      11.256  21.339  -1.475  1.00  2.55           O  
HETATM  171  N3  CBR A   9      10.667  19.239  -0.839  1.00 11.08           N  
HETATM  172  C4  CBR A   9       9.686  18.348  -0.547  1.00 11.08           C  
HETATM  173  N4  CBR A   9      10.038  17.100  -0.197  1.00  6.34           N  
HETATM  174  C5  CBR A   9       8.312  18.744  -0.636  1.00  7.97           C  
HETATM  175  C2' CBR A   9       7.497  22.480  -2.524  1.00 18.67           C  
HETATM  176  C5' CBR A   9       6.315  23.962   0.648  1.00 18.30           C  
HETATM  177  C4' CBR A   9       7.286  23.732  -0.496  1.00 20.77           C  
HETATM  178  O4' CBR A   9       8.186  22.675  -0.286  1.00 15.26           O  
HETATM  179  C1' CBR A   9       8.694  22.270  -1.615  1.00 15.93           C  
HETATM  180  C3' CBR A   9       6.640  23.530  -1.875  1.00 18.44           C  
HETATM  181  O3' CBR A   9       6.589  24.850  -2.479  1.00 21.65           O  
ATOM    182  P    DG A  10       6.587  25.400  -3.929  1.00 22.62           P  
ATOM    183  OP1  DG A  10       6.084  26.803  -4.100  1.00 30.26           O  
ATOM    184  OP2  DG A  10       5.633  24.434  -4.666  1.00 22.30           O  
ATOM    185  O5'  DG A  10       7.982  25.182  -4.641  1.00 28.83           O  
ATOM    186  C5'  DG A  10       9.322  25.642  -4.545  1.00 28.10           C  
ATOM    187  C4'  DG A  10      10.121  24.881  -5.626  1.00 25.89           C  
ATOM    188  O4'  DG A  10      10.412  23.554  -5.187  1.00 18.36           O  
ATOM    189  C3'  DG A  10       9.366  24.766  -6.948  1.00 21.47           C  
ATOM    190  O3'  DG A  10      10.150  24.798  -8.124  1.00 30.03           O  
ATOM    191  C2'  DG A  10       8.662  23.435  -6.700  1.00 15.21           C  
ATOM    192  C1'  DG A  10       9.846  22.643  -6.147  1.00  8.62           C  
ATOM    193  N9   DG A  10       9.490  21.371  -5.518  1.00  9.05           N  
ATOM    194  C8   DG A  10       8.257  20.868  -5.168  1.00  3.14           C  
ATOM    195  N7   DG A  10       8.300  19.715  -4.602  1.00  1.53           N  
ATOM    196  C5   DG A  10       9.633  19.382  -4.533  1.00  5.72           C  
ATOM    197  C6   DG A  10      10.307  18.241  -4.024  1.00  6.26           C  
ATOM    198  O6   DG A  10       9.764  17.251  -3.503  1.00  5.15           O  
ATOM    199  N1   DG A  10      11.701  18.261  -4.151  1.00  1.86           N  
ATOM    200  C2   DG A  10      12.319  19.315  -4.730  1.00  2.15           C  
ATOM    201  N2   DG A  10      13.669  19.156  -4.755  1.00  2.64           N  
ATOM    202  N3   DG A  10      11.761  20.432  -5.213  1.00  0.00           N  
ATOM    203  C4   DG A  10      10.422  20.388  -5.105  1.00  9.17           C  
ATOM    204  P    DC A  11      10.732  26.026  -8.995  1.00 31.17           P  
ATOM    205  OP1  DC A  11      10.771  27.235  -8.124  1.00 31.75           O  
ATOM    206  OP2  DC A  11       9.791  26.260 -10.139  1.00 34.32           O  
ATOM    207  O5'  DC A  11      12.118  25.488  -9.580  1.00 26.25           O  
ATOM    208  C5'  DC A  11      13.368  25.773  -8.925  1.00 22.53           C  
ATOM    209  C4'  DC A  11      14.222  24.501  -8.944  1.00 17.06           C  
ATOM    210  O4'  DC A  11      13.463  23.491  -8.277  1.00 23.27           O  
ATOM    211  C3'  DC A  11      14.547  23.915 -10.273  1.00 13.76           C  
ATOM    212  O3'  DC A  11      15.703  24.493 -10.947  1.00 16.30           O  
ATOM    213  C2'  DC A  11      14.674  22.421  -9.968  1.00 13.52           C  
ATOM    214  C1'  DC A  11      13.953  22.148  -8.741  1.00 10.10           C  
ATOM    215  N1   DC A  11      12.744  21.323  -8.709  1.00 10.77           N  
ATOM    216  C2   DC A  11      12.815  20.079  -8.092  1.00  8.27           C  
ATOM    217  O2   DC A  11      13.851  19.644  -7.641  1.00  7.43           O  
ATOM    218  N3   DC A  11      11.667  19.319  -8.010  1.00  9.83           N  
ATOM    219  C4   DC A  11      10.489  19.755  -8.518  1.00  4.31           C  
ATOM    220  N4   DC A  11       9.434  18.982  -8.423  1.00  2.49           N  
ATOM    221  C5   DC A  11      10.419  21.038  -9.148  1.00 10.25           C  
ATOM    222  C6   DC A  11      11.545  21.779  -9.205  1.00  8.83           C  
ATOM    223  P    DG A  12      15.773  24.105 -12.542  1.00 14.43           P  
ATOM    224  OP1  DG A  12      16.300  25.139 -13.426  1.00 17.80           O  
ATOM    225  OP2  DG A  12      14.375  23.843 -12.981  1.00 26.65           O  
ATOM    226  O5'  DG A  12      16.642  22.774 -12.383  1.00 17.22           O  
ATOM    227  C5'  DG A  12      17.875  22.639 -11.633  1.00  0.00           C  
ATOM    228  C4'  DG A  12      18.115  21.121 -11.722  1.00  8.26           C  
ATOM    229  O4'  DG A  12      17.156  20.448 -10.928  1.00  0.00           O  
ATOM    230  C3'  DG A  12      18.037  20.480 -13.102  1.00  4.14           C  
ATOM    231  O3'  DG A  12      19.309  20.464 -13.826  1.00 10.39           O  
ATOM    232  C2'  DG A  12      17.564  19.073 -12.835  1.00  0.00           C  
ATOM    233  C1'  DG A  12      16.819  19.232 -11.544  1.00  1.66           C  
ATOM    234  N9   DG A  12      15.339  19.319 -11.760  1.00  0.88           N  
ATOM    235  C8   DG A  12      14.608  20.329 -12.263  1.00  0.00           C  
ATOM    236  N7   DG A  12      13.361  20.071 -12.333  1.00  0.00           N  
ATOM    237  C5   DG A  12      13.239  18.796 -11.811  1.00  0.91           C  
ATOM    238  C6   DG A  12      12.099  17.944 -11.589  1.00  0.56           C  
ATOM    239  O6   DG A  12      10.917  18.134 -11.767  1.00  0.00           O  
ATOM    240  N1   DG A  12      12.463  16.712 -11.061  1.00  6.23           N  
ATOM    241  C2   DG A  12      13.730  16.347 -10.781  1.00  0.00           C  
ATOM    242  N2   DG A  12      13.812  15.123 -10.267  1.00  1.41           N  
ATOM    243  N3   DG A  12      14.746  17.116 -10.953  1.00  0.00           N  
ATOM    244  C4   DG A  12      14.472  18.308 -11.455  1.00  0.00           C  
TER     245       DG A  12                                                      
ATOM    246  O5'  DC B  13       7.303   9.537 -10.082  1.00 17.18           O  
ATOM    247  C5'  DC B  13       8.436   8.554 -10.076  1.00 15.40           C  
ATOM    248  C4'  DC B  13       9.497   9.212  -9.256  1.00  4.79           C  
ATOM    249  O4'  DC B  13       9.948  10.396  -9.847  1.00  7.15           O  
ATOM    250  C3'  DC B  13       9.016   9.644  -7.889  1.00  8.60           C  
ATOM    251  O3'  DC B  13      10.082   9.513  -7.005  1.00 14.12           O  
ATOM    252  C2'  DC B  13       8.650  11.133  -8.086  1.00  9.40           C  
ATOM    253  C1'  DC B  13       9.776  11.553  -8.944  1.00  8.02           C  
ATOM    254  N1   DC B  13       9.560  12.766  -9.777  1.00  6.70           N  
ATOM    255  C2   DC B  13      10.703  13.502 -10.044  1.00  4.35           C  
ATOM    256  O2   DC B  13      11.827  13.174  -9.624  1.00  8.91           O  
ATOM    257  N3   DC B  13      10.574  14.608 -10.820  1.00  2.87           N  
ATOM    258  C4   DC B  13       9.385  15.000 -11.315  1.00  4.04           C  
ATOM    259  N4   DC B  13       9.368  16.090 -12.078  1.00  4.34           N  
ATOM    260  C5   DC B  13       8.220  14.232 -11.029  1.00  4.59           C  
ATOM    261  C6   DC B  13       8.346  13.146 -10.298  1.00  0.00           C  
ATOM    262  P    DG B  14      10.305   8.332  -5.937  1.00  9.45           P  
ATOM    263  OP1  DG B  14      10.089   7.044  -6.599  1.00 17.88           O  
ATOM    264  OP2  DG B  14       9.443   8.895  -4.844  1.00 17.17           O  
ATOM    265  O5'  DG B  14      11.834   8.657  -5.613  1.00 14.72           O  
ATOM    266  C5'  DG B  14      12.875   8.344  -6.535  1.00 12.72           C  
ATOM    267  C4'  DG B  14      13.810   9.592  -6.452  1.00 13.29           C  
ATOM    268  O4'  DG B  14      13.188  10.686  -7.044  1.00  3.54           O  
ATOM    269  C3'  DG B  14      14.200   9.921  -5.003  1.00  8.67           C  
ATOM    270  O3'  DG B  14      15.562   9.921  -4.736  1.00 13.04           O  
ATOM    271  C2'  DG B  14      13.630  11.308  -4.806  1.00 14.95           C  
ATOM    272  C1'  DG B  14      13.603  11.838  -6.198  1.00  9.89           C  
ATOM    273  N9   DG B  14      12.567  12.873  -6.262  1.00  8.80           N  
ATOM    274  C8   DG B  14      11.237  12.674  -6.026  1.00  2.04           C  
ATOM    275  N7   DG B  14      10.531  13.748  -6.166  1.00  7.23           N  
ATOM    276  C5   DG B  14      11.475  14.743  -6.522  1.00  6.31           C  
ATOM    277  C6   DG B  14      11.329  16.129  -6.859  1.00  5.17           C  
ATOM    278  O6   DG B  14      10.261  16.751  -6.872  1.00  6.10           O  
ATOM    279  N1   DG B  14      12.489  16.751  -7.190  1.00  0.00           N  
ATOM    280  C2   DG B  14      13.683  16.106  -7.183  1.00  0.00           C  
ATOM    281  N2   DG B  14      14.780  16.819  -7.533  1.00  3.53           N  
ATOM    282  N3   DG B  14      13.856  14.838  -6.923  1.00  5.58           N  
ATOM    283  C4   DG B  14      12.725  14.196  -6.605  1.00  4.23           C  
ATOM    284  P    DC B  15      16.421   9.806  -3.395  1.00  8.94           P  
ATOM    285  OP1  DC B  15      17.477   8.764  -3.573  1.00 14.68           O  
ATOM    286  OP2  DC B  15      15.407   9.449  -2.333  1.00 16.74           O  
ATOM    287  O5'  DC B  15      17.072  11.236  -3.064  1.00 13.44           O  
ATOM    288  C5'  DC B  15      18.164  11.688  -3.871  1.00 10.84           C  
ATOM    289  C4'  DC B  15      18.137  13.186  -3.821  1.00  8.32           C  
ATOM    290  O4'  DC B  15      16.914  13.633  -4.310  1.00  7.97           O  
ATOM    291  C3'  DC B  15      18.275  13.701  -2.397  1.00  8.66           C  
ATOM    292  O3'  DC B  15      19.549  14.180  -2.168  1.00 15.18           O  
ATOM    293  C2'  DC B  15      17.319  14.869  -2.365  1.00 10.87           C  
ATOM    294  C1'  DC B  15      16.542  14.850  -3.623  1.00  4.19           C  
ATOM    295  N1   DC B  15      15.074  14.842  -3.312  1.00  4.74           N  
ATOM    296  C2   DC B  15      14.380  15.971  -3.636  1.00  0.00           C  
ATOM    297  O2   DC B  15      14.938  16.945  -4.138  1.00  3.08           O  
ATOM    298  N3   DC B  15      13.045  15.971  -3.388  1.00  3.43           N  
ATOM    299  C4   DC B  15      12.417  14.905  -2.791  1.00  2.11           C  
ATOM    300  N4   DC B  15      11.091  15.016  -2.600  1.00  3.92           N  
ATOM    301  C5   DC B  15      13.154  13.768  -2.454  1.00  0.00           C  
ATOM    302  C6   DC B  15      14.470  13.768  -2.702  1.00  0.04           C  
ATOM    303  P    DG B  16      20.520  14.545  -1.017  1.00 15.47           P  
ATOM    304  OP1  DG B  16      21.777  13.712  -1.201  1.00 22.75           O  
ATOM    305  OP2  DG B  16      19.821  14.239   0.292  1.00 18.60           O  
ATOM    306  O5'  DG B  16      20.979  16.086  -1.176  1.00 16.94           O  
ATOM    307  C5'  DG B  16      20.846  16.882  -2.365  1.00 13.62           C  
ATOM    308  C4'  DG B  16      20.285  18.225  -2.015  1.00 10.73           C  
ATOM    309  O4'  DG B  16      18.851  18.194  -2.022  1.00  8.74           O  
ATOM    310  C3'  DG B  16      20.697  18.748  -0.655  1.00 19.09           C  
ATOM    311  O3'  DG B  16      20.605  20.139  -0.407  1.00 24.00           O  
ATOM    312  C2'  DG B  16      19.557  18.174   0.222  1.00 15.78           C  
ATOM    313  C1'  DG B  16      18.392  18.594  -0.693  1.00  8.64           C  
ATOM    314  N9   DG B  16      17.169  17.881  -0.324  1.00 10.95           N  
ATOM    315  C8   DG B  16      17.008  16.720   0.381  1.00  0.00           C  
ATOM    316  N7   DG B  16      15.792  16.343   0.496  1.00  6.26           N  
ATOM    317  C5   DG B  16      15.030  17.322  -0.108  1.00  9.59           C  
ATOM    318  C6   DG B  16      13.623  17.464  -0.299  1.00  7.59           C  
ATOM    319  O6   DG B  16      12.742  16.712   0.127  1.00 10.70           O  
ATOM    320  N1   DG B  16      13.232  18.582  -0.979  1.00  4.54           N  
ATOM    321  C2   DG B  16      14.169  19.469  -1.443  1.00  8.14           C  
ATOM    322  N2   DG B  16      13.683  20.575  -2.085  1.00  5.87           N  
ATOM    323  N3   DG B  16      15.496  19.358  -1.316  1.00  5.07           N  
ATOM    324  C4   DG B  16      15.870  18.281  -0.655  1.00  7.45           C  
ATOM    325  P    DA B  17      21.816  21.106  -0.095  1.00 30.73           P  
ATOM    326  OP1  DA B  17      23.035  20.971  -0.960  1.00 31.02           O  
ATOM    327  OP2  DA B  17      22.188  20.741   1.290  1.00 24.67           O  
ATOM    328  O5'  DA B  17      21.115  22.520  -0.470  1.00 24.58           O  
ATOM    329  C5'  DA B  17      20.105  22.587  -1.488  1.00 20.99           C  
ATOM    330  C4'  DA B  17      18.965  23.491  -1.119  1.00 17.50           C  
ATOM    331  O4'  DA B  17      17.814  22.774  -0.731  1.00 14.23           O  
ATOM    332  C3'  DA B  17      19.195  24.537  -0.025  1.00 22.08           C  
ATOM    333  O3'  DA B  17      18.637  25.832  -0.375  1.00 27.42           O  
ATOM    334  C2'  DA B  17      18.494  23.950   1.189  1.00 19.73           C  
ATOM    335  C1'  DA B  17      17.292  23.265   0.559  1.00 10.93           C  
ATOM    336  N9   DA B  17      16.911  22.064   1.322  1.00  6.02           N  
ATOM    337  C8   DA B  17      17.780  21.145   1.913  1.00  5.42           C  
ATOM    338  N7   DA B  17      17.210  20.159   2.441  1.00  2.66           N  
ATOM    339  C5   DA B  17      15.848  20.381   2.174  1.00  3.03           C  
ATOM    340  C6   DA B  17      14.695  19.640   2.530  1.00  1.94           C  
ATOM    341  N6   DA B  17      14.729  18.495   3.223  1.00  0.00           N  
ATOM    342  N1   DA B  17      13.545  20.198   2.111  1.00  5.07           N  
ATOM    343  C2   DA B  17      13.443  21.339   1.411  1.00  4.34           C  
ATOM    344  N3   DA B  17      14.504  22.092   1.043  1.00 10.54           N  
ATOM    345  C4   DA B  17      15.683  21.530   1.488  1.00  5.89           C  
ATOM    346  P    DA B  18      18.836  27.160   0.540  1.00 29.02           P  
ATOM    347  OP1  DA B  18      20.115  27.730   0.025  1.00 32.76           O  
ATOM    348  OP2  DA B  18      18.928  26.815   2.002  1.00 28.40           O  
ATOM    349  O5'  DA B  18      17.448  27.885   0.254  1.00 28.09           O  
ATOM    350  C5'  DA B  18      16.292  27.128   0.006  1.00 15.06           C  
ATOM    351  C4'  DA B  18      15.111  27.437   0.833  1.00 11.24           C  
ATOM    352  O4'  DA B  18      14.647  26.181   1.392  1.00 19.08           O  
ATOM    353  C3'  DA B  18      15.030  28.360   1.996  1.00 11.70           C  
ATOM    354  O3'  DA B  18      13.657  28.883   2.111  1.00 23.33           O  
ATOM    355  C2'  DA B  18      15.188  27.508   3.217  1.00 12.43           C  
ATOM    356  C1'  DA B  18      14.341  26.308   2.753  1.00  3.74           C  
ATOM    357  N9   DA B  18      14.827  25.107   3.376  1.00  1.51           N  
ATOM    358  C8   DA B  18      16.191  24.774   3.573  1.00  1.17           C  
ATOM    359  N7   DA B  18      16.351  23.653   4.183  1.00  2.52           N  
ATOM    360  C5   DA B  18      15.028  23.174   4.380  1.00  0.00           C  
ATOM    361  C6   DA B  18      14.596  22.013   4.990  1.00  0.00           C  
ATOM    362  N6   DA B  18      15.479  21.145   5.454  1.00  0.00           N  
ATOM    363  N1   DA B  18      13.251  21.894   5.060  1.00  0.00           N  
ATOM    364  C2   DA B  18      12.378  22.809   4.539  1.00  3.03           C  
ATOM    365  N3   DA B  18      12.776  23.978   3.935  1.00  3.70           N  
ATOM    366  C4   DA B  18      14.103  24.081   3.897  1.00  0.00           C  
ATOM    367  P    DT B  19      13.254  30.119   3.045  1.00 24.37           P  
ATOM    368  OP1  DT B  19      12.725  31.300   2.295  1.00 15.00           O  
ATOM    369  OP2  DT B  19      14.579  30.301   3.751  1.00 20.41           O  
ATOM    370  O5'  DT B  19      12.130  29.505   3.999  1.00 18.24           O  
ATOM    371  C5'  DT B  19      11.038  28.681   3.623  1.00 10.29           C  
ATOM    372  C4'  DT B  19      10.812  27.797   4.850  1.00 13.40           C  
ATOM    373  O4'  DT B  19      11.839  26.850   5.060  1.00  5.35           O  
ATOM    374  C3'  DT B  19      10.790  28.661   6.147  1.00 13.36           C  
ATOM    375  O3'  DT B  19       9.511  28.994   6.452  1.00 11.81           O  
ATOM    376  C2'  DT B  19      11.475  27.786   7.164  1.00  8.74           C  
ATOM    377  C1'  DT B  19      11.669  26.514   6.471  1.00  3.98           C  
ATOM    378  N1   DT B  19      12.916  25.852   6.878  1.00  2.52           N  
ATOM    379  C2   DT B  19      12.720  24.600   7.457  1.00  0.00           C  
ATOM    380  O2   DT B  19      11.642  24.121   7.622  1.00  3.27           O  
ATOM    381  N3   DT B  19      13.824  23.911   7.838  1.00  0.85           N  
ATOM    382  C4   DT B  19      15.089  24.390   7.660  1.00  0.00           C  
ATOM    383  O4   DT B  19      15.987  23.602   8.048  1.00  0.23           O  
ATOM    384  C5   DT B  19      15.242  25.674   7.094  1.00  5.14           C  
ATOM    385  C7   DT B  19      16.649  26.228   6.872  1.00  6.44           C  
ATOM    386  C6   DT B  19      14.149  26.351   6.700  1.00  0.19           C  
ATOM    387  P    DT B  20       8.613  29.414   7.635  1.00 15.30           P  
ATOM    388  OP1  DT B  20       7.254  29.644   6.929  1.00 13.63           O  
ATOM    389  OP2  DT B  20       9.247  30.729   8.054  1.00 19.56           O  
ATOM    390  O5'  DT B  20       8.519  28.396   8.804  1.00 13.33           O  
ATOM    391  C5'  DT B  20       7.701  27.163   8.696  1.00  5.15           C  
ATOM    392  C4'  DT B  20       8.070  26.296   9.860  1.00  1.33           C  
ATOM    393  O4'  DT B  20       9.426  25.915   9.726  1.00  2.05           O  
ATOM    394  C3'  DT B  20       7.934  26.886  11.284  1.00  3.68           C  
ATOM    395  O3'  DT B  20       6.881  26.236  11.945  1.00 14.19           O  
ATOM    396  C2'  DT B  20       9.266  26.597  11.989  1.00  0.00           C  
ATOM    397  C1'  DT B  20       9.841  25.602  11.106  1.00  0.00           C  
ATOM    398  N1   DT B  20      11.298  25.618  11.074  1.00  2.42           N  
ATOM    399  C2   DT B  20      11.904  24.394  11.328  1.00  0.00           C  
ATOM    400  O2   DT B  20      11.261  23.411  11.589  1.00  0.00           O  
ATOM    401  N3   DT B  20      13.254  24.366  11.265  1.00  0.00           N  
ATOM    402  C4   DT B  20      13.992  25.468  10.940  1.00  0.00           C  
ATOM    403  O4   DT B  20      15.246  25.258  10.959  1.00  4.25           O  
ATOM    404  C5   DT B  20      13.358  26.688  10.654  1.00  0.00           C  
ATOM    405  C7   DT B  20      14.174  27.916  10.336  1.00  0.00           C  
ATOM    406  C6   DT B  20      12.031  26.736  10.712  1.00  0.00           C  
HETATM  407 BR   CBR B  21      11.822  28.003  14.252  1.00 15.86          BR  
HETATM  408  P   CBR B  21       6.320  26.434  13.407  1.00 15.11           P  
HETATM  409  OP1 CBR B  21       4.859  26.252  13.191  1.00 20.90           O  
HETATM  410  OP2 CBR B  21       6.749  27.738  13.985  1.00 22.94           O  
HETATM  411  O5' CBR B  21       7.043  25.365  14.335  1.00 15.09           O  
HETATM  412  N1  CBR B  21      11.019  24.319  15.473  1.00  8.05           N  
HETATM  413  C6  CBR B  21      10.863  25.595  15.015  1.00  3.14           C  
HETATM  414  C2  CBR B  21      12.268  23.705  15.428  1.00  0.09           C  
HETATM  415  O2  CBR B  21      12.380  22.540  15.791  1.00  2.64           O  
HETATM  416  N3  CBR B  21      13.334  24.410  14.990  1.00  0.11           N  
HETATM  417  C4  CBR B  21      13.237  25.686  14.532  1.00  3.97           C  
HETATM  418  N4  CBR B  21      14.314  26.320  14.049  1.00  0.00           N  
HETATM  419  C5  CBR B  21      11.943  26.292  14.551  1.00  7.45           C  
HETATM  420  C2' CBR B  21       8.893  24.045  16.878  1.00  0.00           C  
HETATM  421  C5' CBR B  21       6.922  23.990  13.941  1.00 11.62           C  
HETATM  422  C4' CBR B  21       7.749  23.217  14.939  1.00  7.90           C  
HETATM  423  O4' CBR B  21       9.113  23.404  14.627  1.00  9.80           O  
HETATM  424  C1' CBR B  21       9.856  23.522  15.924  1.00  1.59           C  
HETATM  425  C3' CBR B  21       7.533  23.661  16.382  1.00  0.80           C  
HETATM  426  O3' CBR B  21       6.876  22.516  16.999  1.00  8.53           O  
ATOM    427  P    DG B  22       6.291  22.425  18.480  1.00 10.09           P  
ATOM    428  OP1  DG B  22       5.242  21.347  18.531  1.00 10.80           O  
ATOM    429  OP2  DG B  22       6.060  23.899  18.658  1.00  8.74           O  
ATOM    430  O5'  DG B  22       7.475  21.930  19.497  1.00  6.92           O  
ATOM    431  C5'  DG B  22       8.295  20.816  19.020  1.00  2.08           C  
ATOM    432  C4'  DG B  22       9.572  20.797  19.764  1.00  0.49           C  
ATOM    433  O4'  DG B  22      10.567  21.577  19.103  1.00  3.80           O  
ATOM    434  C3'  DG B  22       9.616  21.320  21.169  1.00  0.68           C  
ATOM    435  O3'  DG B  22      10.669  20.717  21.938  1.00  6.16           O  
ATOM    436  C2'  DG B  22      10.016  22.785  21.016  1.00  0.00           C  
ATOM    437  C1'  DG B  22      11.159  22.492  20.050  1.00  1.67           C  
ATOM    438  N9   DG B  22      11.637  23.720  19.427  1.00  0.00           N  
ATOM    439  C8   DG B  22      11.026  24.881  19.128  1.00  0.00           C  
ATOM    440  N7   DG B  22      11.781  25.769  18.601  1.00  4.35           N  
ATOM    441  C5   DG B  22      13.035  25.119  18.524  1.00  2.03           C  
ATOM    442  C6   DG B  22      14.305  25.547  18.035  1.00  0.81           C  
ATOM    443  O6   DG B  22      14.523  26.668  17.545  1.00  0.00           O  
ATOM    444  N1   DG B  22      15.300  24.636  18.200  1.00  0.00           N  
ATOM    445  C2   DG B  22      15.115  23.435  18.740  1.00  0.00           C  
ATOM    446  N2   DG B  22      16.154  22.595  18.823  1.00  5.08           N  
ATOM    447  N3   DG B  22      13.950  22.952  19.224  1.00  4.97           N  
ATOM    448  C4   DG B  22      12.953  23.883  19.058  1.00  2.36           C  
ATOM    449  P    DC B  23      10.186  19.648  23.050  1.00  9.52           P  
ATOM    450  OP1  DC B  23       9.128  18.907  22.300  1.00 13.94           O  
ATOM    451  OP2  DC B  23       9.803  20.476  24.195  1.00 14.19           O  
ATOM    452  O5'  DC B  23      11.538  18.764  23.197  1.00 17.14           O  
ATOM    453  C5'  DC B  23      12.111  18.352  21.906  1.00 14.78           C  
ATOM    454  C4'  DC B  23      13.603  18.364  22.059  1.00 14.26           C  
ATOM    455  O4'  DC B  23      14.232  19.541  21.671  1.00  9.74           O  
ATOM    456  C3'  DC B  23      14.174  18.114  23.476  1.00 14.68           C  
ATOM    457  O3'  DC B  23      15.297  17.251  23.260  1.00 18.12           O  
ATOM    458  C2'  DC B  23      14.533  19.477  24.029  1.00  0.18           C  
ATOM    459  C1'  DC B  23      14.984  20.123  22.758  1.00  3.78           C  
ATOM    460  N1   DC B  23      14.637  21.541  22.637  1.00  5.21           N  
ATOM    461  C2   DC B  23      15.618  22.342  22.078  1.00  6.76           C  
ATOM    462  O2   DC B  23      16.700  21.866  21.792  1.00  6.72           O  
ATOM    463  N3   DC B  23      15.317  23.677  21.932  1.00 10.02           N  
ATOM    464  C4   DC B  23      14.115  24.232  22.250  1.00  7.10           C  
ATOM    465  N4   DC B  23      13.904  25.543  22.033  1.00  0.00           N  
ATOM    466  C5   DC B  23      13.108  23.372  22.777  1.00  7.82           C  
ATOM    467  C6   DC B  23      13.414  22.064  22.930  1.00  4.87           C  
ATOM    468  P    DG B  24      15.967  16.347  24.405  1.00 28.28           P  
ATOM    469  OP1  DG B  24      16.200  14.964  23.832  1.00 27.79           O  
ATOM    470  OP2  DG B  24      15.043  16.312  25.587  1.00 22.79           O  
ATOM    471  O5'  DG B  24      17.290  17.159  24.722  1.00 28.58           O  
ATOM    472  C5'  DG B  24      18.246  17.920  23.998  1.00 16.71           C  
ATOM    473  C4'  DG B  24      18.914  18.907  24.951  1.00 12.60           C  
ATOM    474  O4'  DG B  24      18.372  20.147  24.710  1.00  5.80           O  
ATOM    475  C3'  DG B  24      18.654  18.701  26.432  1.00 14.53           C  
ATOM    476  O3'  DG B  24      19.678  17.873  27.024  1.00 22.51           O  
ATOM    477  C2'  DG B  24      18.593  20.091  27.036  1.00 12.59           C  
ATOM    478  C1'  DG B  24      18.681  20.995  25.860  1.00  8.49           C  
ATOM    479  N9   DG B  24      17.627  22.013  25.822  1.00 10.33           N  
ATOM    480  C8   DG B  24      16.312  21.854  26.191  1.00  7.57           C  
ATOM    481  N7   DG B  24      15.579  22.904  26.013  1.00  8.17           N  
ATOM    482  C5   DG B  24      16.467  23.824  25.441  1.00  5.92           C  
ATOM    483  C6   DG B  24      16.256  25.159  25.040  1.00  9.51           C  
ATOM    484  O6   DG B  24      15.193  25.805  25.110  1.00 11.38           O  
ATOM    485  N1   DG B  24      17.380  25.781  24.551  1.00  9.55           N  
ATOM    486  C2   DG B  24      18.598  25.147  24.436  1.00  9.22           C  
ATOM    487  N2   DG B  24      19.520  25.991  23.890  1.00  0.67           N  
ATOM    488  N3   DG B  24      18.851  23.879  24.780  1.00  1.61           N  
ATOM    489  C4   DG B  24      17.734  23.301  25.301  1.00  7.73           C  
TER     490       DG B  24                                                      
HETATM  491 MG    MG A  26      14.569  30.915  19.077  1.00 20.27          MG  
HETATM  492  C1   NT B  25      10.388  19.251  16.217  1.00 28.86           C  
HETATM  493  N1   NT B  25      11.570  18.812  16.070  1.00 26.98           N  
HETATM  494  N2   NT B  25       9.754  19.105  17.316  1.00 29.03           N  
HETATM  495  N3   NT B  25       9.861  19.846  15.231  1.00 31.99           N  
HETATM  496  C2   NT B  25      10.371  20.123  13.915  1.00 29.06           C  
HETATM  497  C3   NT B  25       9.147  20.484  13.038  1.00 27.54           C  
HETATM  498  O1   NT B  25       8.024  19.996  13.248  1.00 18.33           O  
HETATM  499  N4   NT B  25       9.465  21.339  12.110  1.00 27.55           N  
HETATM  500  C4   NT B  25       8.485  21.787  11.220  1.00 29.42           C  
HETATM  501  C5   NT B  25       8.917  22.465  10.114  1.00 31.20           C  
HETATM  502  C6   NT B  25       7.820  22.805   9.383  1.00 32.91           C  
HETATM  503  N5   NT B  25       6.732  22.369  10.025  1.00 31.39           N  
HETATM  504  C8   NT B  25       5.313  22.512   9.624  1.00 31.13           C  
HETATM  505  C7   NT B  25       7.143  21.728  11.176  1.00 28.87           C  
HETATM  506  C9   NT B  25       7.701  23.590   8.124  1.00 33.53           C  
HETATM  507  O2   NT B  25       6.822  24.469   8.042  1.00 40.41           O  
HETATM  508  N6   NT B  25       8.519  23.388   7.158  1.00 34.19           N  
HETATM  509  C10  NT B  25       8.436  24.144   5.918  1.00 35.10           C  
HETATM  510  C11  NT B  25       9.344  23.911   4.876  1.00 36.86           C  
HETATM  511  C12  NT B  25       8.980  24.790   3.865  1.00 34.66           C  
HETATM  512  N7   NT B  25       7.888  25.539   4.278  1.00 32.61           N  
HETATM  513  C14  NT B  25       7.198  26.573   3.547  1.00 32.87           C  
HETATM  514  C13  NT B  25       7.589  25.131   5.518  1.00 31.93           C  
HETATM  515  C15  NT B  25       9.623  25.004   2.587  1.00 32.56           C  
HETATM  516  O3   NT B  25       9.259  25.900   1.863  1.00 36.71           O  
HETATM  517  N8   NT B  25      10.667  24.212   2.403  1.00 35.36           N  
HETATM  518  C16  NT B  25      11.582  24.172   1.246  1.00 38.28           C  
HETATM  519  C17  NT B  25      11.951  25.511   0.737  1.00 39.05           C  
HETATM  520  C18  NT B  25      12.754  25.408  -0.572  1.00 45.66           C  
HETATM  521  N9   NT B  25      12.407  26.121  -1.627  1.00 42.63           N  
HETATM  522  N10  NT B  25      13.773  24.596  -0.566  1.00 43.85           N  
HETATM  523  O   HOH A  27      14.970  33.396  25.422  1.00 22.75           O  
HETATM  524  O   HOH A  28      19.389  21.648   9.802  1.00  4.44           O  
HETATM  525  O   HOH A  33      22.605  19.687  10.890  1.00 16.77           O  
HETATM  526  O   HOH A  34      19.251  32.219  17.615  1.00 15.09           O  
HETATM  527  O   HOH A  35      26.869  19.105  17.119  1.00  4.87           O  
HETATM  528  O   HOH A  39      26.901  24.798  14.221  1.00 27.87           O  
HETATM  529  O   HOH A  44      20.314  24.814  12.002  1.00 14.25           O  
HETATM  530  O   HOH A  46      12.533  32.679  22.834  1.00 15.73           O  
HETATM  531  O   HOH A  48      24.054  35.234  22.593  1.00 14.33           O  
HETATM  532  O   HOH A  52       1.922  19.834  10.158  1.00 22.02           O  
HETATM  533  O   HOH A  53       2.303  19.303   3.109  1.00 12.85           O  
HETATM  534  O   HOH A  54       9.157  14.762   0.572  1.00 37.05           O  
HETATM  535  O   HOH A  59      16.812  30.694  26.343  1.00 24.93           O  
HETATM  536  O   HOH A  61      14.108  29.006  19.986  1.00  5.80           O  
HETATM  537  O   HOH B  29      14.404  30.488   7.552  1.00 17.67           O  
HETATM  538  O   HOH B  30       8.536  12.777  -2.460  1.00 11.44           O  
HETATM  539  O   HOH B  31       7.191  15.535  -6.382  1.00 26.22           O  
HETATM  540  O   HOH B  32       4.026  24.053  16.878  1.00  8.17           O  
HETATM  541  O   HOH B  36      11.237  30.147  10.858  1.00  7.67           O  
HETATM  542  O   HOH B  37      23.056  12.674  -3.910  1.00 16.91           O  
HETATM  543  O   HOH B  38      14.538  18.637  26.769  1.00 27.06           O  
HETATM  544  O   HOH B  40       7.893  25.923  20.158  1.00 16.63           O  
HETATM  545  O   HOH B  41      13.043  23.190  26.947  1.00 10.69           O  
HETATM  546  O   HOH B  42       5.759  22.936  22.294  1.00 21.47           O  
HETATM  547  O   HOH B  43      10.778  28.851  18.740  1.00  6.17           O  
HETATM  548  O   HOH B  45      20.896  27.160  -3.948  1.00 20.23           O  
HETATM  549  O   HOH B  47      13.649  20.024  18.785  1.00  9.75           O  
HETATM  550  O   HOH B  49       8.677  28.332  17.138  1.00 29.29           O  
HETATM  551  O   HOH B  50       4.264  26.656  16.598  1.00 14.57           O  
HETATM  552  O   HOH B  51      16.987  28.554  12.091  1.00 19.55           O  
HETATM  553  O   HOH B  55      24.867  23.487  -2.734  1.00 24.19           O  
HETATM  554  O   HOH B  56      11.356  27.013  22.605  1.00 26.12           O  
HETATM  555  O   HOH B  57      19.836  28.594   8.518  1.00 35.67           O  
HETATM  556  O   HOH B  58      21.185  29.703  -2.034  1.00 26.63           O  
HETATM  557  O   HOH B  60      12.509  31.197  18.772  1.00 28.43           O  
HETATM  558  O   HOH B  62      14.278  29.652  17.412  1.00 40.07           O  
CONECT  150  163                                                                
CONECT  162  174                                                                
CONECT  163  150  164  165  166                                                 
CONECT  164  163                                                                
CONECT  165  163                                                                
CONECT  166  163  176                                                           
CONECT  167  168  169  179                                                      
CONECT  168  167  174                                                           
CONECT  169  167  170  171                                                      
CONECT  170  169                                                                
CONECT  171  169  172                                                           
CONECT  172  171  173  174                                                      
CONECT  173  172                                                                
CONECT  174  162  168  172                                                      
CONECT  175  179  180                                                           
CONECT  176  166  177                                                           
CONECT  177  176  178  180                                                      
CONECT  178  177  179                                                           
CONECT  179  167  175  178                                                      
CONECT  180  175  177  181                                                      
CONECT  181  180  182                                                           
CONECT  182  181                                                                
CONECT  395  408                                                                
CONECT  407  419                                                                
CONECT  408  395  409  410  411                                                 
CONECT  409  408                                                                
CONECT  410  408                                                                
CONECT  411  408  421                                                           
CONECT  412  413  414  424                                                      
CONECT  413  412  419                                                           
CONECT  414  412  415  416                                                      
CONECT  415  414                                                                
CONECT  416  414  417                                                           
CONECT  417  416  418  419                                                      
CONECT  418  417                                                                
CONECT  419  407  413  417                                                      
CONECT  420  424  425                                                           
CONECT  421  411  422                                                           
CONECT  422  421  423  425                                                      
CONECT  423  422  424                                                           
CONECT  424  412  420  423                                                      
CONECT  425  420  422  426                                                      
CONECT  426  425  427                                                           
CONECT  427  426                                                                
CONECT  491  536  557  558                                                      
CONECT  492  493  494  495                                                      
CONECT  493  492                                                                
CONECT  494  492                                                                
CONECT  495  492  496                                                           
CONECT  496  495  497                                                           
CONECT  497  496  498  499                                                      
CONECT  498  497                                                                
CONECT  499  497  500                                                           
CONECT  500  499  501  505                                                      
CONECT  501  500  502                                                           
CONECT  502  501  503  506                                                      
CONECT  503  502  504  505                                                      
CONECT  504  503                                                                
CONECT  505  500  503                                                           
CONECT  506  502  507  508                                                      
CONECT  507  506                                                                
CONECT  508  506  509                                                           
CONECT  509  508  510  514                                                      
CONECT  510  509  511                                                           
CONECT  511  510  512  515                                                      
CONECT  512  511  513  514                                                      
CONECT  513  512                                                                
CONECT  514  509  512                                                           
CONECT  515  511  516  517                                                      
CONECT  516  515                                                                
CONECT  517  515  518                                                           
CONECT  518  517  519                                                           
CONECT  519  518  520                                                           
CONECT  520  519  521  522                                                      
CONECT  521  520                                                                
CONECT  522  520                                                                
CONECT  536  491                                                                
CONECT  557  491                                                                
CONECT  558  491                                                                
MASTER      333    0    4    0    0    0    4    6  556    2   79    2          
END