HEADER    DNA                                     28-MAR-02   1LAE              
TITLE     SOLUTION STRUCTURE OF THE DNA 13-MER HAIRPIN CGCGGTXTCCGCG (X=PDG)    
TITLE    2 CONTAINING THE 1,N2-PROPANODEOXYGUANOSINE ADDUCT AT THE SEVENTH      
TITLE    3 POSITION                                                             
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: 5'-D(*CP*GP*CP*GP*GP*TP*(P)P*TP*CP*CP*GP*CP*G)-3';         
COMPND   3 CHAIN: A;                                                            
COMPND   4 ENGINEERED: YES                                                      
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 SYNTHETIC: YES;                                                      
SOURCE   3 OTHER_DETAILS: THIS SYNTHETIC DNA SEQUENCE WAS DERIVED FROM THE      
SOURCE   4 HISD3052 GENE OF SALMONELLA TYPHIMURIUM.                             
KEYWDS    DNA, HAIRPIN, PROPANPODEOXYGUANOSINE                                  
EXPDTA    SOLUTION NMR                                                          
MDLTYP    MINIMIZED AVERAGE                                                     
AUTHOR    J.P.WEISENSEEL,G.R.REDDY,L.J.MARNETT,M.P.STONE                        
REVDAT   3   23-FEB-22 1LAE    1       REMARK SEQRES LINK                       
REVDAT   2   24-FEB-09 1LAE    1       VERSN                                    
REVDAT   1   17-APR-02 1LAE    0                                                
JRNL        AUTH   J.P.WEISENSEEL,G.R.REDDY,L.J.MARNETT,M.P.STONE               
JRNL        TITL   STRUCTURE OF THE 1,N(2)-PROPANODEOXYGUANOSINE ADDUCT IN A    
JRNL        TITL 2 THREE-BASE DNA HAIRPIN LOOP DERIVED FROM A PALINDROME IN THE 
JRNL        TITL 3 SALMONELLA TYPHIMURIUM HISD3052 GENE.                        
JRNL        REF    CHEM.RES.TOXICOL.             V.  15   140 2002              
JRNL        REFN                   ISSN 0893-228X                               
JRNL        PMID   11849039                                                     
JRNL        DOI    10.1021/TX010107F                                            
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : UXNMR 3.0, X-PLOR 3.8                                
REMARK   3   AUTHORS     : BRUKER (UXNMR), BRUNGER, A. (X-PLOR)                 
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: NULL                                      
REMARK   4                                                                      
REMARK   4 1LAE COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 29-MAR-02.                  
REMARK 100 THE DEPOSITION ID IS D_1000015792.                                   
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 303; 278                           
REMARK 210  PH                             : 6.8; 6.8                           
REMARK 210  IONIC STRENGTH                 : 100 MM NACL; 100 MM NACL           
REMARK 210  PRESSURE                       : AMBIENT; AMBIENT                   
REMARK 210  SAMPLE CONTENTS                : 1.8 MM DNA, 10 MM SODIUM           
REMARK 210                                   PHOSPHATE, 100 MM NACL, 50 UM      
REMARK 210                                   EDTA; 1.8 MM DNA, 1 MM SODIUM      
REMARK 210                                   PHOSPHATE, 100 MM NACL, 50 UM      
REMARK 210                                   EDTA                               
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : 2D NOESY; 31P-1H COSY; DQF-COSY    
REMARK 210  SPECTROMETER FIELD STRENGTH    : 500 MHZ                            
REMARK 210  SPECTROMETER MODEL             : DRX                                
REMARK 210  SPECTROMETER MANUFACTURER      : BRUKER                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : FELIX 97.0, 2000, MARDIGRAS 3.2    
REMARK 210   METHOD USED                   : MOLECULAR DYNAMICS USING A         
REMARK 210                                   SIMULATED ANNEALING PROTOCOL.      
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : NULL                               
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 1                                  
REMARK 210 CONFORMERS, SELECTION CRITERIA  : NULL                               
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1                   
REMARK 210                                                                      
REMARK 210 REMARK: NULL                                                         
REMARK 215                                                                      
REMARK 215 NMR STUDY                                                            
REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION           
REMARK 215 NMR DATA.  PROTEIN DATA BANK CONVENTIONS REQUIRE THAT                
REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON              
REMARK 215 THESE RECORDS ARE MEANINGLESS.                                       
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: MONOMERIC                         
REMARK 350 APPLY THE FOLLOWING TO CHAINS: A                                     
REMARK 350   BIOMT1   1  1.000000  0.000000  0.000000        0.00000            
REMARK 350   BIOMT2   1  0.000000  1.000000  0.000000        0.00000            
REMARK 350   BIOMT3   1  0.000000  0.000000  1.000000        0.00000            
REMARK 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   O4' -  C1' -  N1  ANGL. DEV. =   3.0 DEGREES          
REMARK 500     DG A   2   O4' -  C1' -  N9  ANGL. DEV. =   3.6 DEGREES          
REMARK 500     DG A   2   N7  -  C8  -  N9  ANGL. DEV. =   4.6 DEGREES          
REMARK 500     DG A   2   C8  -  N9  -  C4  ANGL. DEV. =  -2.9 DEGREES          
REMARK 500     DC A   3   O4' -  C1' -  N1  ANGL. DEV. =   2.8 DEGREES          
REMARK 500     DG A   4   O4' -  C1' -  N9  ANGL. DEV. =   3.7 DEGREES          
REMARK 500     DG A   4   N7  -  C8  -  N9  ANGL. DEV. =   4.5 DEGREES          
REMARK 500     DG A   4   C8  -  N9  -  C4  ANGL. DEV. =  -2.8 DEGREES          
REMARK 500     DG A   5   N7  -  C8  -  N9  ANGL. DEV. =   4.8 DEGREES          
REMARK 500     DG A   5   C8  -  N9  -  C4  ANGL. DEV. =  -3.2 DEGREES          
REMARK 500     DT A   6   O4' -  C1' -  N1  ANGL. DEV. =   3.8 DEGREES          
REMARK 500     DT A   6   C6  -  C5  -  C7  ANGL. DEV. =  -3.8 DEGREES          
REMARK 500     DT A   8   O4' -  C1' -  N1  ANGL. DEV. =   2.8 DEGREES          
REMARK 500     DC A   9   O4' -  C1' -  N1  ANGL. DEV. =   3.2 DEGREES          
REMARK 500     DC A  10   O4' -  C1' -  N1  ANGL. DEV. =   3.8 DEGREES          
REMARK 500     DG A  11   O4' -  C1' -  N9  ANGL. DEV. =   3.2 DEGREES          
REMARK 500     DG A  11   N7  -  C8  -  N9  ANGL. DEV. =   4.6 DEGREES          
REMARK 500     DG A  11   C8  -  N9  -  C4  ANGL. DEV. =  -2.6 DEGREES          
REMARK 500     DC A  12   O4' -  C1' -  N1  ANGL. DEV. =   3.2 DEGREES          
REMARK 500     DG A  13   O4' -  C1' -  N9  ANGL. DEV. =   2.5 DEGREES          
REMARK 500     DG A  13   N7  -  C8  -  N9  ANGL. DEV. =   4.4 DEGREES          
REMARK 500     DG A  13   C8  -  N9  -  C4  ANGL. DEV. =  -3.1 DEGREES          
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 1LA8   RELATED DB: PDB                                   
REMARK 900 1LA8 IS THE SOLUTION STRUCTURE OF THE DNA 13-MER HAIRPIN             
REMARK 900 CGCGGTGTCCGCG.                                                       
REMARK 900 RELATED ID: 1LAI   RELATED DB: PDB                                   
REMARK 900 1LAI IS THE SOLUTION STRUCTURE OF THE B-DNA DUPLEX CGCGGTGTCCGCG.    
REMARK 900 RELATED ID: 1LAQ   RELATED DB: PDB                                   
REMARK 900 1LAQ IS THE SOLUTION STRUCTURE OF THE B-DNA DUPLEX CGCGGTXTCCGCG (X= 
REMARK 900 PDG) CONTAINING THE 1,N2-PROPANOGEOXYGUANOSINE ADDUCT WITH THE       
REMARK 900 DEOXYRIBOSE AT C20 OPPOSITE PDG IN THE C2' ENDO CONFORMATION.        
REMARK 900 RELATED ID: 1LAS   RELATED DB: PDB                                   
REMARK 900 1LAS IS THE SOLUTION STRUCTURE OF THE B-DNA DUPLEX CGCGGTXTCCGCG (X= 
REMARK 900 PDG) CONTAINING THE 1,N2-PROPANOGEOXYGUANOSINE ADDUCT WITH THE       
REMARK 900 DEOXYRIBOSE AT C20 OPPOSITE PDG IN THE C3' ENDO CONFORMATION.        
DBREF  1LAE A    1    13  PDB    1LAE     1LAE             1     13             
SEQRES   1 A   13   DC  DG  DC  DG  DG  DT   P  DT  DC  DC  DG  DC  DG          
MODRES 1LAE   P A    7   DG                                                     
HET      P  A   7      40                                                       
HETNAM       P 2'-DEOXY-N1,N2-PROPANO GUANOSINE MONOPHOSPHATE                   
FORMUL   1    P    C13 H18 N5 O7 P                                              
LINK         O3'  DT A   6                 P     P A   7     1555   1555  1.61  
LINK         O3'   P A   7                 P    DT A   8     1555   1555  1.61  
CRYST1    1.000    1.000    1.000  90.00  90.00  90.00 P 1           1          
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      1.000000  0.000000  0.000000        0.00000                         
SCALE2      0.000000  1.000000  0.000000        0.00000                         
SCALE3      0.000000  0.000000  1.000000        0.00000                         
ATOM      1  O5'  DC A   1       1.477 -17.625  15.716  1.00  0.69           O  
ATOM      2  C5'  DC A   1       2.783 -18.207  15.687  1.00  0.69           C  
ATOM      3  C4'  DC A   1       3.875 -17.138  15.666  1.00  0.59           C  
ATOM      4  O4'  DC A   1       3.727 -16.259  14.515  1.00  0.53           O  
ATOM      5  C3'  DC A   1       3.793 -16.250  16.893  1.00  0.55           C  
ATOM      6  O3'  DC A   1       5.095 -15.838  17.309  1.00  0.50           O  
ATOM      7  C2'  DC A   1       2.990 -15.075  16.428  1.00  0.50           C  
ATOM      8  C1'  DC A   1       3.387 -14.921  14.972  1.00  0.46           C  
ATOM      9  N1   DC A   1       2.287 -14.338  14.161  1.00  0.45           N  
ATOM     10  C2   DC A   1       2.599 -13.276  13.317  1.00  0.38           C  
ATOM     11  O2   DC A   1       3.743 -12.824  13.280  1.00  0.32           O  
ATOM     12  N3   DC A   1       1.607 -12.752  12.545  1.00  0.39           N  
ATOM     13  C4   DC A   1       0.361 -13.240  12.597  1.00  0.46           C  
ATOM     14  N4   DC A   1      -0.584 -12.704  11.824  1.00  0.47           N  
ATOM     15  C5   DC A   1       0.032 -14.326  13.463  1.00  0.54           C  
ATOM     16  C6   DC A   1       1.015 -14.843  14.223  1.00  0.53           C  
ATOM     17  H5'  DC A   1       2.876 -18.828  14.795  1.00  0.73           H  
ATOM     18 H5''  DC A   1       2.914 -18.832  16.570  1.00  0.74           H  
ATOM     19  H4'  DC A   1       4.855 -17.618  15.627  1.00  0.59           H  
ATOM     20  H3'  DC A   1       3.275 -16.768  17.703  1.00  0.61           H  
ATOM     21  H2'  DC A   1       1.921 -15.290  16.521  1.00  0.55           H  
ATOM     22 H2''  DC A   1       3.251 -14.182  16.993  1.00  0.45           H  
ATOM     23  H1'  DC A   1       4.278 -14.279  14.907  1.00  0.40           H  
ATOM     24  H41  DC A   1      -0.359 -11.936  11.209  1.00  0.43           H  
ATOM     25  H42  DC A   1      -1.526 -13.066  11.855  1.00  0.53           H  
ATOM     26  H5   DC A   1      -0.982 -14.724  13.508  1.00  0.61           H  
ATOM     27  H6   DC A   1       0.792 -15.671  14.895  1.00  0.61           H  
ATOM     28 HO5'  DC A   1       1.408 -17.120  16.529  1.00  1.15           H  
ATOM     29  P    DG A   2       5.349 -15.262  18.787  1.00  0.51           P  
ATOM     30  OP1  DG A   2       6.454 -16.030  19.404  1.00  0.55           O  
ATOM     31  OP2  DG A   2       4.046 -15.151  19.481  1.00  0.57           O  
ATOM     32  O5'  DG A   2       5.879 -13.777  18.466  1.00  0.42           O  
ATOM     33  C5'  DG A   2       7.050 -13.583  17.665  1.00  0.36           C  
ATOM     34  C4'  DG A   2       7.122 -12.167  17.097  1.00  0.31           C  
ATOM     35  O4'  DG A   2       6.040 -11.901  16.159  1.00  0.28           O  
ATOM     36  C3'  DG A   2       7.016 -11.115  18.195  1.00  0.32           C  
ATOM     37  O3'  DG A   2       8.004 -10.099  18.010  1.00  0.30           O  
ATOM     38  C2'  DG A   2       5.633 -10.554  18.039  1.00  0.32           C  
ATOM     39  C1'  DG A   2       5.358 -10.689  16.565  1.00  0.28           C  
ATOM     40  N9   DG A   2       3.908 -10.747  16.272  1.00  0.28           N  
ATOM     41  C8   DG A   2       2.914 -11.439  16.888  1.00  0.36           C  
ATOM     42  N7   DG A   2       1.724 -11.340  16.400  1.00  0.34           N  
ATOM     43  C5   DG A   2       1.927 -10.472  15.326  1.00  0.23           C  
ATOM     44  C6   DG A   2       0.997  -9.963  14.383  1.00  0.17           C  
ATOM     45  O6   DG A   2      -0.210 -10.183  14.307  1.00  0.19           O  
ATOM     46  N1   DG A   2       1.611  -9.118  13.467  1.00  0.13           N  
ATOM     47  C2   DG A   2       2.955  -8.799  13.456  1.00  0.14           C  
ATOM     48  N2   DG A   2       3.357  -7.960  12.501  1.00  0.20           N  
ATOM     49  N3   DG A   2       3.836  -9.276  14.339  1.00  0.15           N  
ATOM     50  C4   DG A   2       3.260 -10.102  15.241  1.00  0.20           C  
ATOM     51  H5'  DG A   2       7.052 -14.302  16.841  1.00  0.37           H  
ATOM     52 H5''  DG A   2       7.925 -13.759  18.280  1.00  0.37           H  
ATOM     53  H4'  DG A   2       8.071 -12.043  16.578  1.00  0.28           H  
ATOM     54  H3'  DG A   2       7.126 -11.582  19.176  1.00  0.36           H  
ATOM     55  H2'  DG A   2       4.921 -11.142  18.616  1.00  0.36           H  
ATOM     56 H2''  DG A   2       5.602  -9.508  18.343  1.00  0.33           H  
ATOM     57  H1'  DG A   2       5.803  -9.835  16.045  1.00  0.26           H  
ATOM     58  H8   DG A   2       3.106 -12.036  17.778  1.00  0.44           H  
ATOM     59  H1   DG A   2       1.008  -8.713  12.765  1.00  0.13           H  
ATOM     60  H21  DG A   2       2.691  -7.597  11.835  1.00  0.24           H  
ATOM     61  H22  DG A   2       4.328  -7.687  12.446  1.00  0.23           H  
ATOM     62  P    DC A   3       8.266  -8.973  19.128  1.00  0.32           P  
ATOM     63  OP1  DC A   3       9.724  -8.880  19.366  1.00  0.34           O  
ATOM     64  OP2  DC A   3       7.343  -9.209  20.262  1.00  0.37           O  
ATOM     65  O5'  DC A   3       7.790  -7.643  18.356  1.00  0.29           O  
ATOM     66  C5'  DC A   3       8.380  -7.303  17.096  1.00  0.26           C  
ATOM     67  C4'  DC A   3       7.684  -6.118  16.431  1.00  0.25           C  
ATOM     68  O4'  DC A   3       6.394  -6.504  15.898  1.00  0.26           O  
ATOM     69  C3'  DC A   3       7.452  -4.981  17.421  1.00  0.26           C  
ATOM     70  O3'  DC A   3       7.865  -3.723  16.877  1.00  0.26           O  
ATOM     71  C2'  DC A   3       5.970  -4.991  17.669  1.00  0.27           C  
ATOM     72  C1'  DC A   3       5.374  -5.636  16.433  1.00  0.27           C  
ATOM     73  N1   DC A   3       4.139  -6.391  16.738  1.00  0.27           N  
ATOM     74  C2   DC A   3       3.041  -6.162  15.922  1.00  0.27           C  
ATOM     75  O2   DC A   3       3.120  -5.361  14.993  1.00  0.26           O  
ATOM     76  N3   DC A   3       1.893  -6.847  16.176  1.00  0.27           N  
ATOM     77  C4   DC A   3       1.821  -7.720  17.188  1.00  0.28           C  
ATOM     78  N4   DC A   3       0.680  -8.377  17.404  1.00  0.29           N  
ATOM     79  C5   DC A   3       2.950  -7.961  18.034  1.00  0.29           C  
ATOM     80  C6   DC A   3       4.083  -7.280  17.775  1.00  0.28           C  
ATOM     81  H5'  DC A   3       8.321  -8.165  16.432  1.00  0.26           H  
ATOM     82 H5''  DC A   3       9.425  -7.054  17.256  1.00  0.25           H  
ATOM     83  H4'  DC A   3       8.307  -5.754  15.614  1.00  0.24           H  
ATOM     84  H3'  DC A   3       7.985  -5.186  18.353  1.00  0.27           H  
ATOM     85  H2'  DC A   3       5.744  -5.579  18.556  1.00  0.28           H  
ATOM     86 H2''  DC A   3       5.596  -3.973  17.783  1.00  0.28           H  
ATOM     87  H1'  DC A   3       5.149  -4.859  15.701  1.00  0.27           H  
ATOM     88  H41  DC A   3      -0.121  -8.209  16.812  1.00  0.29           H  
ATOM     89  H42  DC A   3       0.616  -9.042  18.162  1.00  0.30           H  
ATOM     90  H5   DC A   3       2.892  -8.664  18.864  1.00  0.30           H  
ATOM     91  H6   DC A   3       4.965  -7.447  18.393  1.00  0.29           H  
ATOM     92  P    DG A   4       8.141  -2.463  17.843  1.00  0.26           P  
ATOM     93  OP1  DG A   4       9.484  -1.926  17.529  1.00  0.27           O  
ATOM     94  OP2  DG A   4       7.810  -2.855  19.232  1.00  0.27           O  
ATOM     95  O5'  DG A   4       7.043  -1.396  17.346  1.00  0.27           O  
ATOM     96  C5'  DG A   4       7.077  -0.869  16.017  1.00  0.28           C  
ATOM     97  C4'  DG A   4       5.779  -0.140  15.673  1.00  0.29           C  
ATOM     98  O4'  DG A   4       4.626  -1.010  15.843  1.00  0.29           O  
ATOM     99  C3'  DG A   4       5.573   1.073  16.574  1.00  0.27           C  
ATOM    100  O3'  DG A   4       5.242   2.230  15.795  1.00  0.29           O  
ATOM    101  C2'  DG A   4       4.436   0.684  17.474  1.00  0.24           C  
ATOM    102  C1'  DG A   4       3.662  -0.356  16.699  1.00  0.26           C  
ATOM    103  N9   DG A   4       2.984  -1.311  17.600  1.00  0.24           N  
ATOM    104  C8   DG A   4       3.491  -2.106  18.579  1.00  0.25           C  
ATOM    105  N7   DG A   4       2.667  -2.864  19.220  1.00  0.23           N  
ATOM    106  C5   DG A   4       1.452  -2.547  18.607  1.00  0.23           C  
ATOM    107  C6   DG A   4       0.149  -3.047  18.863  1.00  0.25           C  
ATOM    108  O6   DG A   4      -0.197  -3.875  19.699  1.00  0.26           O  
ATOM    109  N1   DG A   4      -0.795  -2.467  18.024  1.00  0.27           N  
ATOM    110  C2   DG A   4      -0.524  -1.520  17.058  1.00  0.26           C  
ATOM    111  N2   DG A   4      -1.566  -1.082  16.349  1.00  0.30           N  
ATOM    112  N3   DG A   4       0.700  -1.043  16.811  1.00  0.24           N  
ATOM    113  C4   DG A   4       1.637  -1.597  17.616  1.00  0.23           C  
ATOM    114  H5'  DG A   4       7.228  -1.686  15.308  1.00  0.29           H  
ATOM    115 H5''  DG A   4       7.909  -0.171  15.935  1.00  0.28           H  
ATOM    116  H4'  DG A   4       5.819   0.192  14.639  1.00  0.32           H  
ATOM    117  H3'  DG A   4       6.474   1.259  17.167  1.00  0.26           H  
ATOM    118  H2'  DG A   4       4.825   0.252  18.396  1.00  0.22           H  
ATOM    119 H2''  DG A   4       3.807   1.544  17.691  1.00  0.24           H  
ATOM    120  H1'  DG A   4       2.914   0.142  16.077  1.00  0.27           H  
ATOM    121  H8   DG A   4       4.551  -2.096  18.824  1.00  0.28           H  
ATOM    122  H1   DG A   4      -1.747  -2.782  18.145  1.00  0.31           H  
ATOM    123  H21  DG A   4      -2.490  -1.445  16.533  1.00  0.34           H  
ATOM    124  H22  DG A   4      -1.429  -0.389  15.627  1.00  0.30           H  
ATOM    125  P    DG A   5       5.330   3.711  16.424  1.00  0.28           P  
ATOM    126  OP1  DG A   5       6.289   4.500  15.618  1.00  0.33           O  
ATOM    127  OP2  DG A   5       5.521   3.590  17.887  1.00  0.26           O  
ATOM    128  O5'  DG A   5       3.850   4.288  16.157  1.00  0.27           O  
ATOM    129  C5'  DG A   5       3.412   4.588  14.827  1.00  0.33           C  
ATOM    130  C4'  DG A   5       1.914   4.852  14.772  1.00  0.33           C  
ATOM    131  O4'  DG A   5       1.168   3.759  15.361  1.00  0.29           O  
ATOM    132  C3'  DG A   5       1.551   6.125  15.522  1.00  0.34           C  
ATOM    133  O3'  DG A   5       0.736   6.983  14.724  1.00  0.41           O  
ATOM    134  C2'  DG A   5       0.822   5.655  16.761  1.00  0.29           C  
ATOM    135  C1'  DG A   5       0.342   4.242  16.445  1.00  0.26           C  
ATOM    136  N9   DG A   5       0.460   3.329  17.615  1.00  0.19           N  
ATOM    137  C8   DG A   5       1.513   3.123  18.454  1.00  0.17           C  
ATOM    138  N7   DG A   5       1.408   2.188  19.333  1.00  0.13           N  
ATOM    139  C5   DG A   5       0.132   1.691  19.077  1.00  0.12           C  
ATOM    140  C6   DG A   5      -0.571   0.638  19.719  1.00  0.12           C  
ATOM    141  O6   DG A   5      -0.191  -0.083  20.638  1.00  0.13           O  
ATOM    142  N1   DG A   5      -1.830   0.454  19.170  1.00  0.14           N  
ATOM    143  C2   DG A   5      -2.358   1.185  18.127  1.00  0.17           C  
ATOM    144  N2   DG A   5      -3.595   0.855  17.752  1.00  0.20           N  
ATOM    145  N3   DG A   5      -1.702   2.180  17.508  1.00  0.18           N  
ATOM    146  C4   DG A   5      -0.466   2.382  18.030  1.00  0.16           C  
ATOM    147  H5'  DG A   5       3.641   3.750  14.171  1.00  0.36           H  
ATOM    148 H5''  DG A   5       3.941   5.472  14.469  1.00  0.36           H  
ATOM    149  H4'  DG A   5       1.617   4.951  13.732  1.00  0.38           H  
ATOM    150  H3'  DG A   5       2.467   6.654  15.807  1.00  0.34           H  
ATOM    151  H2'  DG A   5       1.496   5.649  17.613  1.00  0.26           H  
ATOM    152 H2''  DG A   5      -0.035   6.307  16.963  1.00  0.33           H  
ATOM    153  H1'  DG A   5      -0.693   4.280  16.115  1.00  0.29           H  
ATOM    154  H8   DG A   5       2.410   3.733  18.397  1.00  0.20           H  
ATOM    155  H1   DG A   5      -2.391  -0.275  19.587  1.00  0.17           H  
ATOM    156  H21  DG A   5      -4.083   0.105  18.221  1.00  0.21           H  
ATOM    157  H22  DG A   5      -4.046   1.357  17.000  1.00  0.23           H  
ATOM    158  P    DT A   6       0.808   8.578  14.939  1.00  0.46           P  
ATOM    159  OP1  DT A   6       1.466   9.174  13.755  1.00  0.51           O  
ATOM    160  OP2  DT A   6       1.344   8.844  16.294  1.00  0.44           O  
ATOM    161  O5'  DT A   6      -0.740   8.997  14.916  1.00  0.50           O  
ATOM    162  C5'  DT A   6      -1.374   9.553  16.069  1.00  0.51           C  
ATOM    163  C4'  DT A   6      -2.882   9.530  15.916  1.00  0.54           C  
ATOM    164  O4'  DT A   6      -3.298   9.732  14.533  1.00  0.60           O  
ATOM    165  C3'  DT A   6      -3.417   8.209  16.335  1.00  0.47           C  
ATOM    166  O3'  DT A   6      -4.662   8.367  17.033  1.00  0.49           O  
ATOM    167  C2'  DT A   6      -3.587   7.427  15.077  1.00  0.48           C  
ATOM    168  C1'  DT A   6      -3.873   8.487  14.022  1.00  0.57           C  
ATOM    169  N1   DT A   6      -3.301   8.107  12.698  1.00  0.60           N  
ATOM    170  C2   DT A   6      -4.166   8.065  11.617  1.00  0.68           C  
ATOM    171  O2   DT A   6      -5.354   8.372  11.712  1.00  0.72           O  
ATOM    172  N3   DT A   6      -3.616   7.655  10.414  1.00  0.72           N  
ATOM    173  C4   DT A   6      -2.298   7.288  10.199  1.00  0.69           C  
ATOM    174  O4   DT A   6      -1.919   6.937   9.083  1.00  0.75           O  
ATOM    175  C5   DT A   6      -1.470   7.362  11.381  1.00  0.61           C  
ATOM    176  C7   DT A   6       0.002   6.945  11.309  1.00  0.59           C  
ATOM    177  C6   DT A   6      -1.980   7.764  12.560  1.00  0.57           C  
ATOM    178  H5'  DT A   6      -1.039  10.587  16.211  1.00  0.57           H  
ATOM    179 H5''  DT A   6      -1.112   8.964  16.954  1.00  0.45           H  
ATOM    180  H4'  DT A   6      -3.307  10.276  16.563  1.00  0.59           H  
ATOM    181  H3'  DT A   6      -2.683   7.757  16.949  1.00  0.41           H  
ATOM    182  H2'  DT A   6      -2.678   6.869  14.843  1.00  0.44           H  
ATOM    183 H2''  DT A   6      -4.424   6.740  15.188  1.00  0.47           H  
ATOM    184  H1'  DT A   6      -4.951   8.609  13.926  1.00  0.61           H  
ATOM    185  H3   DT A   6      -4.235   7.622   9.617  1.00  0.78           H  
ATOM    186  H71  DT A   6       0.172   6.094  11.972  1.00  1.10           H  
ATOM    187  H72  DT A   6       0.634   7.776  11.623  1.00  1.30           H  
ATOM    188  H73  DT A   6       0.254   6.662  10.288  1.00  1.12           H  
ATOM    189  H6   DT A   6      -1.322   7.839  13.410  1.00  0.52           H  
HETATM  190  P     P A   7      -5.190   7.259  18.073  1.00  0.45           P  
HETATM  191  OP1   P A   7      -6.659   7.398  18.191  1.00  0.73           O  
HETATM  192  OP2   P A   7      -4.343   7.320  19.285  1.00  0.87           O  
HETATM  193  O5'   P A   7      -4.870   5.887  17.299  1.00  0.55           O  
HETATM  194  C5'   P A   7      -5.894   4.932  17.000  1.00  0.37           C  
HETATM  195  C4'   P A   7      -5.923   3.804  18.046  1.00  0.26           C  
HETATM  196  O4'   P A   7      -4.560   3.360  18.306  1.00  0.22           O  
HETATM  197  C3'   P A   7      -6.498   4.224  19.411  1.00  0.24           C  
HETATM  198  O3'   P A   7      -7.183   3.118  20.007  1.00  0.22           O  
HETATM  199  C2'   P A   7      -5.278   4.560  20.212  1.00  0.23           C  
HETATM  200  C1'   P A   7      -4.232   3.611  19.697  1.00  0.18           C  
HETATM  201  N9    P A   7      -2.874   4.160  19.885  1.00  0.18           N  
HETATM  202  C8    P A   7      -2.281   5.240  19.329  1.00  0.23           C  
HETATM  203  N7    P A   7      -1.076   5.513  19.695  1.00  0.24           N  
HETATM  204  C5    P A   7      -0.818   4.493  20.618  1.00  0.20           C  
HETATM  205  C6    P A   7       0.356   4.247  21.380  1.00  0.21           C  
HETATM  206  O6    P A   7       1.398   4.900  21.371  1.00  0.25           O  
HETATM  207  N1    P A   7       0.250   3.128  22.209  1.00  0.21           N  
HETATM  208  C2    P A   7      -0.990   2.302  22.260  1.00  0.19           C  
HETATM  209  N2    P A   7      -1.023   1.205  23.111  1.00  0.24           N  
HETATM  210  N3    P A   7      -2.063   2.581  21.519  1.00  0.17           N  
HETATM  211  C4    P A   7      -1.916   3.664  20.738  1.00  0.17           C  
HETATM  212  C6A   P A   7       0.190   0.746  23.814  1.00  0.32           C  
HETATM  213  C7A   P A   7       0.997   1.951  24.269  1.00  0.62           C  
HETATM  214  C8A   P A   7       1.411   2.767  23.054  1.00  0.25           C  
HETATM  215  H5'   P A   7      -5.676   4.490  16.027  1.00  0.35           H  
HETATM  216 H5''   P A   7      -6.861   5.431  16.938  1.00  0.49           H  
HETATM  217  H4'   P A   7      -6.495   2.965  17.656  1.00  0.27           H  
HETATM  218  H3'   P A   7      -7.173   5.087  19.338  1.00  0.29           H  
HETATM  219  H2'   P A   7      -4.978   5.590  20.029  1.00  0.27           H  
HETATM  220 H2''   P A   7      -5.440   4.396  21.266  1.00  0.23           H  
HETATM  221  H1'   P A   7      -4.315   2.679  20.250  1.00  0.17           H  
HETATM  222  H8    P A   7      -2.812   5.874  18.626  1.00  0.27           H  
HETATM  223  H2    P A   7      -1.862   0.645  23.147  1.00  0.25           H  
HETATM  224 H6A1   P A   7       0.793   0.137  23.139  1.00  0.74           H  
HETATM  225 H6A2   P A   7      -0.097   0.152  24.681  1.00  0.69           H  
HETATM  226 H7A1   P A   7       1.886   1.613  24.801  1.00  1.22           H  
HETATM  227 H7A2   P A   7       0.388   2.567  24.932  1.00  1.19           H  
HETATM  228 H8A1   P A   7       2.115   2.185  22.460  1.00  0.40           H  
HETATM  229 H8A2   P A   7       1.901   3.680  23.393  1.00  0.51           H  
ATOM    230  P    DT A   8      -8.154   3.316  21.275  1.00  0.25           P  
ATOM    231  OP1  DT A   8      -9.469   2.718  20.956  1.00  0.26           O  
ATOM    232  OP2  DT A   8      -8.069   4.727  21.719  1.00  0.29           O  
ATOM    233  O5'  DT A   8      -7.432   2.395  22.382  1.00  0.25           O  
ATOM    234  C5'  DT A   8      -6.950   1.095  22.024  1.00  0.23           C  
ATOM    235  C4'  DT A   8      -6.197   0.424  23.169  1.00  0.26           C  
ATOM    236  O4'  DT A   8      -4.981   1.142  23.505  1.00  0.27           O  
ATOM    237  C3'  DT A   8      -7.046   0.361  24.420  1.00  0.32           C  
ATOM    238  O3'  DT A   8      -6.908  -0.909  25.066  1.00  0.35           O  
ATOM    239  C2'  DT A   8      -6.514   1.474  25.269  1.00  0.35           C  
ATOM    240  C1'  DT A   8      -5.058   1.596  24.876  1.00  0.33           C  
ATOM    241  N1   DT A   8      -4.588   2.991  25.001  1.00  0.35           N  
ATOM    242  C2   DT A   8      -3.643   3.267  25.974  1.00  0.40           C  
ATOM    243  O2   DT A   8      -3.190   2.397  26.717  1.00  0.42           O  
ATOM    244  N3   DT A   8      -3.234   4.584  26.065  1.00  0.43           N  
ATOM    245  C4   DT A   8      -3.680   5.633  25.282  1.00  0.43           C  
ATOM    246  O4   DT A   8      -3.246   6.770  25.452  1.00  0.47           O  
ATOM    247  C5   DT A   8      -4.665   5.251  24.293  1.00  0.38           C  
ATOM    248  C7   DT A   8      -5.245   6.313  23.362  1.00  0.39           C  
ATOM    249  C6   DT A   8      -5.081   3.972  24.183  1.00  0.34           C  
ATOM    250  H5'  DT A   8      -6.280   1.190  21.169  1.00  0.19           H  
ATOM    251 H5''  DT A   8      -7.797   0.470  21.742  1.00  0.24           H  
ATOM    252  H4'  DT A   8      -5.937  -0.590  22.881  1.00  0.26           H  
ATOM    253  H3'  DT A   8      -8.094   0.552  24.170  1.00  0.31           H  
ATOM    254  H2'  DT A   8      -7.047   2.400  25.052  1.00  0.35           H  
ATOM    255 H2''  DT A   8      -6.602   1.221  26.319  1.00  0.40           H  
ATOM    256  H1'  DT A   8      -4.453   0.946  25.510  1.00  0.36           H  
ATOM    257  H3   DT A   8      -2.544   4.801  26.770  1.00  0.47           H  
ATOM    258  H71  DT A   8      -6.334   6.274  23.399  1.00  1.13           H  
ATOM    259  H72  DT A   8      -4.908   6.126  22.344  1.00  0.95           H  
ATOM    260  H73  DT A   8      -4.906   7.299  23.681  1.00  1.03           H  
ATOM    261  H6   DT A   8      -5.824   3.711  23.427  1.00  0.31           H  
ATOM    262  P    DC A   9      -8.179  -1.605  25.761  1.00  0.40           P  
ATOM    263  OP1  DC A   9      -8.754  -0.654  26.738  1.00  0.43           O  
ATOM    264  OP2  DC A   9      -7.782  -2.964  26.197  1.00  0.44           O  
ATOM    265  O5'  DC A   9      -9.206  -1.746  24.526  1.00  0.36           O  
ATOM    266  C5'  DC A   9      -9.158  -2.879  23.650  1.00  0.36           C  
ATOM    267  C4'  DC A   9      -9.079  -2.455  22.178  1.00  0.30           C  
ATOM    268  O4'  DC A   9      -7.865  -1.698  21.909  1.00  0.26           O  
ATOM    269  C3'  DC A   9      -9.070  -3.656  21.245  1.00  0.31           C  
ATOM    270  O3'  DC A   9      -9.885  -3.414  20.087  1.00  0.29           O  
ATOM    271  C2'  DC A   9      -7.631  -3.796  20.871  1.00  0.30           C  
ATOM    272  C1'  DC A   9      -7.085  -2.389  20.905  1.00  0.25           C  
ATOM    273  N1   DC A   9      -5.635  -2.355  21.223  1.00  0.24           N  
ATOM    274  C2   DC A   9      -4.819  -1.563  20.415  1.00  0.20           C  
ATOM    275  O2   DC A   9      -5.292  -0.947  19.459  1.00  0.17           O  
ATOM    276  N3   DC A   9      -3.492  -1.494  20.708  1.00  0.19           N  
ATOM    277  C4   DC A   9      -2.978  -2.171  21.743  1.00  0.23           C  
ATOM    278  N4   DC A   9      -1.673  -2.079  22.002  1.00  0.23           N  
ATOM    279  C5   DC A   9      -3.808  -2.989  22.574  1.00  0.28           C  
ATOM    280  C6   DC A   9      -5.122  -3.053  22.281  1.00  0.29           C  
ATOM    281  H5'  DC A   9     -10.059  -3.474  23.806  1.00  0.39           H  
ATOM    282 H5''  DC A   9      -8.285  -3.485  23.894  1.00  0.37           H  
ATOM    283  H4'  DC A   9      -9.933  -1.840  21.938  1.00  0.28           H  
ATOM    284  H3'  DC A   9      -9.407  -4.553  21.768  1.00  0.35           H  
ATOM    285  H2'  DC A   9      -7.124  -4.418  21.600  1.00  0.33           H  
ATOM    286 H2''  DC A   9      -7.541  -4.213  19.882  1.00  0.30           H  
ATOM    287  H1'  DC A   9      -7.250  -1.925  19.933  1.00  0.23           H  
ATOM    288  H41  DC A   9      -1.082  -1.502  21.420  1.00  0.20           H  
ATOM    289  H42  DC A   9      -1.276  -2.585  22.780  1.00  0.26           H  
ATOM    290  H5   DC A   9      -3.392  -3.542  23.416  1.00  0.32           H  
ATOM    291  H6   DC A   9      -5.779  -3.672  22.892  1.00  0.33           H  
ATOM    292  P    DC A  10     -10.522  -4.634  19.242  1.00  0.33           P  
ATOM    293  OP1  DC A  10     -11.962  -4.356  19.045  1.00  0.35           O  
ATOM    294  OP2  DC A  10     -10.097  -5.906  19.870  1.00  0.37           O  
ATOM    295  O5'  DC A  10      -9.784  -4.509  17.813  1.00  0.30           O  
ATOM    296  C5'  DC A  10     -10.138  -3.474  16.886  1.00  0.27           C  
ATOM    297  C4'  DC A  10      -8.956  -3.096  15.989  1.00  0.27           C  
ATOM    298  O4'  DC A  10      -7.760  -2.811  16.769  1.00  0.28           O  
ATOM    299  C3'  DC A  10      -8.601  -4.217  15.015  1.00  0.27           C  
ATOM    300  O3'  DC A  10      -8.598  -3.735  13.669  1.00  0.26           O  
ATOM    301  C2'  DC A  10      -7.227  -4.671  15.422  1.00  0.28           C  
ATOM    302  C1'  DC A  10      -6.636  -3.498  16.171  1.00  0.28           C  
ATOM    303  N1   DC A  10      -5.632  -3.919  17.188  1.00  0.28           N  
ATOM    304  C2   DC A  10      -4.432  -3.215  17.233  1.00  0.28           C  
ATOM    305  O2   DC A  10      -4.217  -2.299  16.443  1.00  0.26           O  
ATOM    306  N3   DC A  10      -3.511  -3.569  18.172  1.00  0.28           N  
ATOM    307  C4   DC A  10      -3.750  -4.562  19.036  1.00  0.30           C  
ATOM    308  N4   DC A  10      -2.833  -4.875  19.950  1.00  0.31           N  
ATOM    309  C5   DC A  10      -4.975  -5.290  18.994  1.00  0.31           C  
ATOM    310  C6   DC A  10      -5.880  -4.943  18.061  1.00  0.30           C  
ATOM    311  H5'  DC A  10     -10.464  -2.590  17.439  1.00  0.27           H  
ATOM    312 H5''  DC A  10     -10.967  -3.819  16.259  1.00  0.27           H  
ATOM    313  H4'  DC A  10      -9.217  -2.210  15.418  1.00  0.26           H  
ATOM    314  H3'  DC A  10      -9.310  -5.041  15.122  1.00  0.27           H  
ATOM    315  H2'  DC A  10      -7.305  -5.538  16.067  1.00  0.29           H  
ATOM    316 H2''  DC A  10      -6.625  -4.903  14.545  1.00  0.28           H  
ATOM    317  H1'  DC A  10      -6.160  -2.832  15.450  1.00  0.27           H  
ATOM    318  H41  DC A  10      -1.961  -4.366  19.987  1.00  0.31           H  
ATOM    319  H42  DC A  10      -3.009  -5.622  20.607  1.00  0.32           H  
ATOM    320  H5   DC A  10      -5.173  -6.101  19.695  1.00  0.32           H  
ATOM    321  H6   DC A  10      -6.800  -5.503  17.986  1.00  0.31           H  
ATOM    322  P    DG A  11      -8.656  -4.750  12.420  1.00  0.26           P  
ATOM    323  OP1  DG A  11      -9.806  -4.374  11.568  1.00  0.29           O  
ATOM    324  OP2  DG A  11      -8.535  -6.134  12.931  1.00  0.25           O  
ATOM    325  O5'  DG A  11      -7.300  -4.382  11.633  1.00  0.25           O  
ATOM    326  C5'  DG A  11      -7.056  -3.033  11.221  1.00  0.30           C  
ATOM    327  C4'  DG A  11      -5.653  -2.853  10.646  1.00  0.34           C  
ATOM    328  O4'  DG A  11      -4.640  -3.100  11.657  1.00  0.35           O  
ATOM    329  C3'  DG A  11      -5.384  -3.823   9.511  1.00  0.31           C  
ATOM    330  O3'  DG A  11      -4.611  -3.218   8.471  1.00  0.38           O  
ATOM    331  C2'  DG A  11      -4.619  -4.918  10.157  1.00  0.28           C  
ATOM    332  C1'  DG A  11      -3.841  -4.239  11.257  1.00  0.31           C  
ATOM    333  N9   DG A  11      -3.609  -5.158  12.385  1.00  0.26           N  
ATOM    334  C8   DG A  11      -4.490  -5.929  13.066  1.00  0.23           C  
ATOM    335  N7   DG A  11      -4.029  -6.663  14.024  1.00  0.20           N  
ATOM    336  C5   DG A  11      -2.665  -6.352  13.987  1.00  0.21           C  
ATOM    337  C6   DG A  11      -1.600  -6.833  14.794  1.00  0.21           C  
ATOM    338  O6   DG A  11      -1.646  -7.647  15.716  1.00  0.20           O  
ATOM    339  N1   DG A  11      -0.386  -6.264  14.425  1.00  0.24           N  
ATOM    340  C2   DG A  11      -0.214  -5.347  13.405  1.00  0.27           C  
ATOM    341  N2   DG A  11       1.030  -4.919  13.195  1.00  0.31           N  
ATOM    342  N3   DG A  11      -1.211  -4.893  12.644  1.00  0.28           N  
ATOM    343  C4   DG A  11      -2.402  -5.431  12.985  1.00  0.24           C  
ATOM    344  H5'  DG A  11      -7.173  -2.373  12.081  1.00  0.33           H  
ATOM    345 H5''  DG A  11      -7.786  -2.760  10.467  1.00  0.28           H  
ATOM    346  H4'  DG A  11      -5.541  -1.843  10.279  1.00  0.39           H  
ATOM    347  H3'  DG A  11      -6.327  -4.206   9.114  1.00  0.28           H  
ATOM    348  H2'  DG A  11      -5.304  -5.650  10.574  1.00  0.23           H  
ATOM    349 H2''  DG A  11      -3.947  -5.378   9.442  1.00  0.29           H  
ATOM    350  H1'  DG A  11      -2.886  -3.890  10.863  1.00  0.35           H  
ATOM    351  H8   DG A  11      -5.550  -5.934  12.808  1.00  0.25           H  
ATOM    352  H1   DG A  11       0.420  -6.554  14.961  1.00  0.26           H  
ATOM    353  H21  DG A  11       1.786  -5.261  13.771  1.00  0.32           H  
ATOM    354  H22  DG A  11       1.217  -4.254  12.458  1.00  0.34           H  
ATOM    355  P    DC A  12      -4.408  -3.968   7.059  1.00  0.40           P  
ATOM    356  OP1  DC A  12      -4.623  -2.983   5.974  1.00  0.46           O  
ATOM    357  OP2  DC A  12      -5.183  -5.229   7.077  1.00  0.34           O  
ATOM    358  O5'  DC A  12      -2.838  -4.338   7.106  1.00  0.43           O  
ATOM    359  C5'  DC A  12      -1.870  -3.287   7.121  1.00  0.49           C  
ATOM    360  C4'  DC A  12      -0.441  -3.784   7.360  1.00  0.50           C  
ATOM    361  O4'  DC A  12      -0.289  -4.357   8.683  1.00  0.44           O  
ATOM    362  C3'  DC A  12      -0.016  -4.844   6.346  1.00  0.51           C  
ATOM    363  O3'  DC A  12       1.260  -4.536   5.767  1.00  0.58           O  
ATOM    364  C2'  DC A  12       0.041  -6.120   7.133  1.00  0.45           C  
ATOM    365  C1'  DC A  12       0.270  -5.683   8.570  1.00  0.41           C  
ATOM    366  N1   DC A  12      -0.355  -6.618   9.531  1.00  0.32           N  
ATOM    367  C2   DC A  12       0.438  -7.098  10.564  1.00  0.28           C  
ATOM    368  O2   DC A  12       1.620  -6.769  10.642  1.00  0.30           O  
ATOM    369  N3   DC A  12      -0.127  -7.938  11.473  1.00  0.21           N  
ATOM    370  C4   DC A  12      -1.415  -8.292  11.378  1.00  0.18           C  
ATOM    371  N4   DC A  12      -1.939  -9.113  12.290  1.00  0.14           N  
ATOM    372  C5   DC A  12      -2.234  -7.802  10.313  1.00  0.23           C  
ATOM    373  C6   DC A  12      -1.665  -6.974   9.417  1.00  0.30           C  
ATOM    374  H5'  DC A  12      -2.130  -2.583   7.912  1.00  0.49           H  
ATOM    375 H5''  DC A  12      -1.907  -2.771   6.167  1.00  0.53           H  
ATOM    376  H4'  DC A  12       0.236  -2.935   7.275  1.00  0.55           H  
ATOM    377  H3'  DC A  12      -0.775  -4.931   5.566  1.00  0.52           H  
ATOM    378  H2'  DC A  12      -0.897  -6.657   7.032  1.00  0.42           H  
ATOM    379 H2''  DC A  12       0.862  -6.743   6.796  1.00  0.47           H  
ATOM    380  H1'  DC A  12       1.341  -5.627   8.767  1.00  0.43           H  
ATOM    381  H41  DC A  12      -1.365  -9.463  13.044  1.00  0.13           H  
ATOM    382  H42  DC A  12      -2.909  -9.385  12.226  1.00  0.13           H  
ATOM    383  H5   DC A  12      -3.283  -8.087  10.231  1.00  0.21           H  
ATOM    384  H6   DC A  12      -2.248  -6.604   8.579  1.00  0.34           H  
ATOM    385  P    DG A  13       1.731  -5.235   4.390  1.00  0.63           P  
ATOM    386  OP1  DG A  13       2.137  -4.170   3.446  1.00  0.70           O  
ATOM    387  OP2  DG A  13       0.701  -6.220   3.988  1.00  0.60           O  
ATOM    388  O5'  DG A  13       3.051  -6.044   4.835  1.00  0.66           O  
ATOM    389  C5'  DG A  13       4.246  -5.343   5.192  1.00  0.73           C  
ATOM    390  C4'  DG A  13       5.292  -6.276   5.803  1.00  0.74           C  
ATOM    391  O4'  DG A  13       4.737  -7.005   6.928  1.00  0.63           O  
ATOM    392  C3'  DG A  13       5.772  -7.313   4.796  1.00  0.81           C  
ATOM    393  O3'  DG A  13       7.176  -7.555   4.942  1.00  0.88           O  
ATOM    394  C2'  DG A  13       4.978  -8.540   5.135  1.00  0.74           C  
ATOM    395  C1'  DG A  13       4.728  -8.422   6.629  1.00  0.63           C  
ATOM    396  N9   DG A  13       3.449  -9.045   7.063  1.00  0.54           N  
ATOM    397  C8   DG A  13       2.231  -9.120   6.447  1.00  0.54           C  
ATOM    398  N7   DG A  13       1.266  -9.675   7.101  1.00  0.48           N  
ATOM    399  C5   DG A  13       1.892 -10.024   8.300  1.00  0.43           C  
ATOM    400  C6   DG A  13       1.360 -10.674   9.446  1.00  0.40           C  
ATOM    401  O6   DG A  13       0.212 -11.064   9.637  1.00  0.41           O  
ATOM    402  N1   DG A  13       2.324 -10.841  10.433  1.00  0.38           N  
ATOM    403  C2   DG A  13       3.638 -10.434  10.336  1.00  0.38           C  
ATOM    404  N2   DG A  13       4.415 -10.690  11.390  1.00  0.37           N  
ATOM    405  N3   DG A  13       4.146  -9.819   9.263  1.00  0.43           N  
ATOM    406  C4   DG A  13       3.225  -9.646   8.285  1.00  0.46           C  
ATOM    407  H5'  DG A  13       3.997  -4.568   5.918  1.00  0.70           H  
ATOM    408 H5''  DG A  13       4.664  -4.874   4.302  1.00  0.81           H  
ATOM    409  H4'  DG A  13       6.141  -5.687   6.146  1.00  0.79           H  
ATOM    410  H3'  DG A  13       5.544  -6.985   3.779  1.00  0.86           H  
ATOM    411 HO3'  DG A  13       7.623  -6.713   4.830  1.00  1.19           H  
ATOM    412  H2'  DG A  13       4.047  -8.539   4.579  1.00  0.72           H  
ATOM    413 H2''  DG A  13       5.550  -9.441   4.914  1.00  0.79           H  
ATOM    414  H1'  DG A  13       5.553  -8.898   7.161  1.00  0.64           H  
ATOM    415  H8   DG A  13       2.072  -8.740   5.438  1.00  0.61           H  
ATOM    416  H1   DG A  13       2.020 -11.313  11.272  1.00  0.39           H  
ATOM    417  H21  DG A  13       4.031 -11.159  12.198  1.00  0.37           H  
ATOM    418  H22  DG A  13       5.388 -10.419  11.379  1.00  0.38           H  
TER     419       DG A  13                                                      
CONECT  166  190                                                                
CONECT  190  166  191  192  193                                                 
CONECT  191  190                                                                
CONECT  192  190                                                                
CONECT  193  190  194                                                           
CONECT  194  193  195  215  216                                                 
CONECT  195  194  196  197  217                                                 
CONECT  196  195  200                                                           
CONECT  197  195  198  199  218                                                 
CONECT  198  197  230                                                           
CONECT  199  197  200  219  220                                                 
CONECT  200  196  199  201  221                                                 
CONECT  201  200  202  211                                                      
CONECT  202  201  203  222                                                      
CONECT  203  202  204                                                           
CONECT  204  203  205  211                                                      
CONECT  205  204  206  207                                                      
CONECT  206  205                                                                
CONECT  207  205  208  214                                                      
CONECT  208  207  209  210                                                      
CONECT  209  208  212  223                                                      
CONECT  210  208  211                                                           
CONECT  211  201  204  210                                                      
CONECT  212  209  213  224  225                                                 
CONECT  213  212  214  226  227                                                 
CONECT  214  207  213  228  229                                                 
CONECT  215  194                                                                
CONECT  216  194                                                                
CONECT  217  195                                                                
CONECT  218  197                                                                
CONECT  219  199                                                                
CONECT  220  199                                                                
CONECT  221  200                                                                
CONECT  222  202                                                                
CONECT  223  209                                                                
CONECT  224  212                                                                
CONECT  225  212                                                                
CONECT  226  213                                                                
CONECT  227  213                                                                
CONECT  228  214                                                                
CONECT  229  214                                                                
CONECT  230  198                                                                
MASTER      123    0    1    0    0    0    0    6  267    1   42    1          
END