HEADER    DNA                                     12-JUN-97   1AMD              
TITLE     NMR STUDY OF DNA (5'-D(*TP*GP*TP*AP*CP*A)-3') SELF-COMPLEMENTARY      
TITLE    2 DUPLEX COMPLEXED WITH A BIS-DAUNORUBICIN WP-652, MINIMIZED AVERAGE   
TITLE    3 STRUCTURE                                                            
COMPND    MOL_ID: 1;                                                            
COMPND   2 MOLECULE: DNA (5'-D(*TP*GP*TP*AP*CP*A)-3');                          
COMPND   3 CHAIN: A, B;                                                         
COMPND   4 ENGINEERED: YES;                                                     
COMPND   5 OTHER_DETAILS: WP652 IS AN INTERCALATOR                              
SOURCE    MOL_ID: 1;                                                            
SOURCE   2 SYNTHETIC: YES                                                       
KEYWDS    COMPLEX (DEOXYRIBONUCLEIC ACID-DRUG), BIS-INTERCALATOR, DAUNORUBICIN, 
KEYWDS   2 DNA, DEOXYRIBONUCLEIC ACID                                           
EXPDTA    SOLUTION NMR                                                          
AUTHOR    H.ROBINSON,A.H.-J.WANG                                                
REVDAT   4   16-FEB-22 1AMD    1       REMARK                                   
REVDAT   3   24-FEB-09 1AMD    1       VERSN                                    
REVDAT   2   01-APR-03 1AMD    1       JRNL                                     
REVDAT   1   17-SEP-97 1AMD    0                                                
JRNL        AUTH   H.ROBINSON,W.PRIEBE,J.B.CHAIRES,A.H.WANG                     
JRNL        TITL   BINDING OF TWO NOVEL BISDAUNORUBICINS TO DNA STUDIED BY NMR  
JRNL        TITL 2 SPECTROSCOPY.                                                
JRNL        REF    BIOCHEMISTRY                  V.  36  8663 1997              
JRNL        REFN                   ISSN 0006-2960                               
JRNL        PMID   9289011                                                      
JRNL        DOI    10.1021/BI970842J                                            
REMARK   2                                                                      
REMARK   2 RESOLUTION. NOT APPLICABLE.                                          
REMARK   3                                                                      
REMARK   3 REFINEMENT.                                                          
REMARK   3   PROGRAM     : X-PLOR                                               
REMARK   3   AUTHORS     : BRUNGER                                              
REMARK   3                                                                      
REMARK   3  OTHER REFINEMENT REMARKS: REFINEMENT DETAILS CAN BE FOUND IN THE    
REMARK   3  JRNL CITATION ABOVE.                                                
REMARK   4                                                                      
REMARK   4 1AMD COMPLIES WITH FORMAT V. 3.30, 13-JUL-11                         
REMARK 100                                                                      
REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL.                                
REMARK 100 THE DEPOSITION ID IS D_1000170995.                                   
REMARK 210                                                                      
REMARK 210 EXPERIMENTAL DETAILS                                                 
REMARK 210  EXPERIMENT TYPE                : NMR                                
REMARK 210  TEMPERATURE           (KELVIN) : 288                                
REMARK 210  PH                             : 7.0                                
REMARK 210  IONIC STRENGTH                 : NULL                               
REMARK 210  PRESSURE                       : NULL                               
REMARK 210  SAMPLE CONTENTS                : NULL                               
REMARK 210                                                                      
REMARK 210  NMR EXPERIMENTS CONDUCTED      : NOESY; TOCSY                       
REMARK 210  SPECTROMETER FIELD STRENGTH    : 750 MHZ                            
REMARK 210  SPECTROMETER MODEL             : INOVA 750                          
REMARK 210  SPECTROMETER MANUFACTURER      : VARIAN                             
REMARK 210                                                                      
REMARK 210  STRUCTURE DETERMINATION.                                            
REMARK 210   SOFTWARE USED                 : X-PLOR, SPEDREF                    
REMARK 210   METHOD USED                   : NOE-RMD                            
REMARK 210                                                                      
REMARK 210 CONFORMERS, NUMBER CALCULATED   : 1                                  
REMARK 210 CONFORMERS, NUMBER SUBMITTED    : 1                                  
REMARK 210 CONFORMERS, SELECTION CRITERIA  : MINIMIZED AVERAGE                  
REMARK 210                                                                      
REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL                
REMARK 210                                                                      
REMARK 210 REMARK: IONIC_STRENGTH: 20 MM PRESSURE: NULL SOLVENT SYSTEM: H2O     
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: 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   5   C5     DC A   5   C6      0.052                       
REMARK 500     DT B   7   C5'    DT B   7   C4'     0.115                       
REMARK 500     DT B   7   C5     DT B   7   C7      0.051                       
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     DT A   1   C6  -  C5  -  C7  ANGL. DEV. =  -4.2 DEGREES          
REMARK 500     DG A   2   P   -  O5' -  C5' ANGL. DEV. =   9.7 DEGREES          
REMARK 500     DG A   2   O4' -  C4' -  C3' ANGL. DEV. =   4.0 DEGREES          
REMARK 500     DG A   2   O4' -  C1' -  N9  ANGL. DEV. = -11.4 DEGREES          
REMARK 500     DT A   3   O4' -  C1' -  N1  ANGL. DEV. =   2.5 DEGREES          
REMARK 500     DT A   3   C3' -  O3' -  P   ANGL. DEV. =   8.1 DEGREES          
REMARK 500     DC A   5   O4' -  C1' -  C2' ANGL. DEV. =  -6.0 DEGREES          
REMARK 500     DC A   5   O4' -  C1' -  N1  ANGL. DEV. =   4.4 DEGREES          
REMARK 500     DT B   7   O4' -  C1' -  N1  ANGL. DEV. =   3.2 DEGREES          
REMARK 500     DT B   7   C6  -  C5  -  C7  ANGL. DEV. =  -4.0 DEGREES          
REMARK 500     DA B  10   N1  -  C6  -  N6  ANGL. DEV. =   3.6 DEGREES          
REMARK 500     DC B  11   O4' -  C1' -  C2' ANGL. DEV. =  -5.0 DEGREES          
REMARK 500     DC B  11   O4' -  C1' -  N1  ANGL. DEV. =   6.1 DEGREES          
REMARK 500     DA B  12   C4' -  C3' -  C2' ANGL. DEV. =  -6.1 DEGREES          
REMARK 500     DA B  12   O4' -  C1' -  N9  ANGL. DEV. =   5.7 DEGREES          
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 500                                                                      
REMARK 500 GEOMETRY AND STEREOCHEMISTRY                                         
REMARK 500 SUBTOPIC: PLANAR GROUPS                                              
REMARK 500                                                                      
REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL                 
REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE                    
REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN                    
REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS                        
REMARK 500 AN RMSD GREATER THAN THIS VALUE                                      
REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER;               
REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE).                             
REMARK 500                                                                      
REMARK 500  M RES CSSEQI        RMS     TYPE                                    
REMARK 500     DT A   1         0.08    SIDE CHAIN                              
REMARK 500     DT B   7         0.09    SIDE CHAIN                              
REMARK 500                                                                      
REMARK 500 REMARK: NULL                                                         
REMARK 800                                                                      
REMARK 800 SITE                                                                 
REMARK 800 SITE_IDENTIFIER: AC1                                                 
REMARK 800 EVIDENCE_CODE: SOFTWARE                                              
REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE BNR B 13                  
REMARK 900                                                                      
REMARK 900 RELATED ENTRIES                                                      
REMARK 900 RELATED ID: 1AL9   RELATED DB: PDB                                   
REMARK 900 MINIMIZED AVERAGE STRUCTURE                                          
DBREF  1AMD A    1     6  PDB    1AMD     1AMD             1      6             
DBREF  1AMD B    7    12  PDB    1AMD     1AMD             7     12             
SEQRES   1 A    6   DT  DG  DT  DA  DC  DA                                      
SEQRES   1 B    6   DT  DG  DT  DA  DC  DA                                      
HET    BNR  B  13     150                                                       
HETNAM     BNR BIS-DAUNORUBICIN                                                 
HETSYN     BNR WP652                                                            
FORMUL   3  BNR    C62 H66 N2 O20 2+                                            
SITE     1 AC1  8  DT A   1   DG A   2   DT A   3   DA A   4                    
SITE     2 AC1  8  DT B   9   DA B  10   DC B  11   DA B  12                    
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'  DT A   1      30.742  21.350  17.515  1.00 23.97           O  
ATOM      2  C5'  DT A   1      31.166  20.901  16.230  1.00 23.64           C  
ATOM      3  C4'  DT A   1      31.575  19.410  16.330  1.00 23.10           C  
ATOM      4  O4'  DT A   1      30.576  18.613  16.981  1.00 22.32           O  
ATOM      5  C3'  DT A   1      31.989  18.679  15.051  1.00 23.29           C  
ATOM      6  O3'  DT A   1      33.407  18.521  15.211  1.00 24.92           O  
ATOM      7  C2'  DT A   1      31.073  17.415  15.038  1.00 21.79           C  
ATOM      8  C1'  DT A   1      30.553  17.265  16.466  1.00 20.16           C  
ATOM      9  N1   DT A   1      29.157  16.799  16.638  1.00  0.00           N  
ATOM     10  C2   DT A   1      28.889  15.524  17.123  1.00  0.00           C  
ATOM     11  O2   DT A   1      29.765  14.674  17.269  1.00  0.00           O  
ATOM     12  N3   DT A   1      27.558  15.268  17.426  1.00  0.00           N  
ATOM     13  C4   DT A   1      26.509  16.158  17.276  1.00  0.00           C  
ATOM     14  O4   DT A   1      25.374  15.857  17.633  1.00  0.00           O  
ATOM     15  C5   DT A   1      26.888  17.416  16.686  1.00  0.00           C  
ATOM     16  C7   DT A   1      25.845  18.490  16.436  1.00  0.00           C  
ATOM     17  C6   DT A   1      28.158  17.667  16.360  1.00  0.00           C  
ATOM     18  H5'  DT A   1      31.967  21.582  15.926  1.00  0.00           H  
ATOM     19 H5''  DT A   1      30.356  21.066  15.524  1.00  0.00           H  
ATOM     20  H4'  DT A   1      32.453  19.343  16.971  1.00  0.00           H  
ATOM     21  H3'  DT A   1      31.818  19.261  14.145  1.00  0.00           H  
ATOM     22  H2'  DT A   1      30.250  17.601  14.340  1.00  0.00           H  
ATOM     23 H2''  DT A   1      31.548  16.474  14.743  1.00  0.00           H  
ATOM     24  H1'  DT A   1      31.156  16.557  17.020  1.00  0.00           H  
ATOM     25  H3   DT A   1      27.304  14.360  17.788  1.00  0.00           H  
ATOM     26  H71  DT A   1      25.832  18.721  15.371  1.00  0.00           H  
ATOM     27  H72  DT A   1      26.124  19.375  17.008  1.00  0.00           H  
ATOM     28  H73  DT A   1      24.871  18.128  16.760  1.00  0.00           H  
ATOM     29  H6   DT A   1      28.460  18.562  15.863  1.00  0.00           H  
ATOM     30 HO5'  DT A   1      30.014  20.785  17.792  1.00  0.00           H  
ATOM     31  P    DG A   2      34.308  17.473  14.403  1.00 26.16           P  
ATOM     32  OP1  DG A   2      35.734  17.701  14.729  1.00 25.67           O  
ATOM     33  OP2  DG A   2      33.847  17.458  12.998  1.00 24.85           O  
ATOM     34  O5'  DG A   2      33.795  16.163  15.177  1.00 24.78           O  
ATOM     35  C5'  DG A   2      34.083  14.780  14.958  1.00 24.00           C  
ATOM     36  C4'  DG A   2      33.860  14.259  13.567  1.00 23.09           C  
ATOM     37  O4'  DG A   2      32.566  14.718  13.271  1.00 22.41           O  
ATOM     38  C3'  DG A   2      34.822  14.675  12.467  1.00 23.30           C  
ATOM     39  O3'  DG A   2      35.753  13.649  12.062  1.00 24.09           O  
ATOM     40  C2'  DG A   2      33.835  15.072  11.369  1.00 22.43           C  
ATOM     41  C1'  DG A   2      32.443  14.656  11.873  1.00 21.17           C  
ATOM     42  N9   DG A   2      31.307  15.576  11.764  1.00 20.29           N  
ATOM     43  C8   DG A   2      31.269  16.943  11.799  1.00 20.06           C  
ATOM     44  N7   DG A   2      30.056  17.439  11.752  1.00 19.69           N  
ATOM     45  C5   DG A   2      29.239  16.307  11.658  1.00 19.82           C  
ATOM     46  C6   DG A   2      27.819  16.180  11.563  1.00 19.70           C  
ATOM     47  O6   DG A   2      26.950  17.045  11.537  1.00 19.95           O  
ATOM     48  N1   DG A   2      27.427  14.853  11.498  1.00 19.43           N  
ATOM     49  C2   DG A   2      28.282  13.779  11.497  1.00 19.39           C  
ATOM     50  N2   DG A   2      27.748  12.571  11.410  1.00 19.44           N  
ATOM     51  N3   DG A   2      29.601  13.885  11.576  1.00 19.52           N  
ATOM     52  C4   DG A   2      30.006  15.173  11.657  1.00 19.73           C  
ATOM     53  H5'  DG A   2      33.286  14.277  15.494  1.00  0.00           H  
ATOM     54 H5''  DG A   2      35.067  14.519  15.312  1.00  0.00           H  
ATOM     55  H4'  DG A   2      33.766  13.198  13.530  1.00  0.00           H  
ATOM     56  H3'  DG A   2      35.383  15.513  12.864  1.00  0.00           H  
ATOM     57  H2'  DG A   2      33.956  16.150  11.291  1.00  0.00           H  
ATOM     58 H2''  DG A   2      34.061  14.571  10.424  1.00  0.00           H  
ATOM     59  H1'  DG A   2      32.180  13.649  11.546  1.00  0.00           H  
ATOM     60  H8   DG A   2      32.216  17.507  11.853  1.00  0.00           H  
ATOM     61  H1   DG A   2      26.436  14.664  11.455  1.00  0.00           H  
ATOM     62  H21  DG A   2      26.760  12.418  11.555  1.00  0.00           H  
ATOM     63  H22  DG A   2      28.352  11.771  11.289  1.00  0.00           H  
ATOM     64  P    DT A   3      36.681  13.798  10.735  1.00 24.59           P  
ATOM     65  OP1  DT A   3      37.853  12.902  10.878  1.00 23.88           O  
ATOM     66  OP2  DT A   3      36.886  15.239  10.462  1.00 24.52           O  
ATOM     67  O5'  DT A   3      35.708  13.200   9.589  1.00 23.90           O  
ATOM     68  C5'  DT A   3      35.562  11.778   9.486  1.00 23.57           C  
ATOM     69  C4'  DT A   3      34.304  11.338   8.687  1.00 22.88           C  
ATOM     70  O4'  DT A   3      33.157  12.024   9.210  1.00 22.53           O  
ATOM     71  C3'  DT A   3      34.346  11.675   7.195  1.00 22.47           C  
ATOM     72  O3'  DT A   3      34.936  10.574   6.474  1.00 22.35           O  
ATOM     73  C2'  DT A   3      32.871  11.964   6.895  1.00 22.08           C  
ATOM     74  C1'  DT A   3      32.132  11.847   8.225  1.00 21.28           C  
ATOM     75  N1   DT A   3      31.133  12.927   8.310  1.00  0.00           N  
ATOM     76  C2   DT A   3      29.786  12.610   8.245  1.00  0.00           C  
ATOM     77  O2   DT A   3      29.356  11.473   8.048  1.00  0.00           O  
ATOM     78  N3   DT A   3      28.921  13.665   8.406  1.00  0.00           N  
ATOM     79  C4   DT A   3      29.266  14.994   8.543  1.00  0.00           C  
ATOM     80  O4   DT A   3      28.407  15.868   8.590  1.00  0.00           O  
ATOM     81  C5   DT A   3      30.686  15.228   8.606  1.00  0.00           C  
ATOM     82  C7   DT A   3      31.176  16.651   8.857  1.00  0.00           C  
ATOM     83  C6   DT A   3      31.557  14.210   8.458  1.00  0.00           C  
ATOM     84  H5'  DT A   3      35.591  11.375  10.504  1.00  0.00           H  
ATOM     85 H5''  DT A   3      36.458  11.433   8.983  1.00  0.00           H  
ATOM     86  H4'  DT A   3      34.111  10.265   8.705  1.00  0.00           H  
ATOM     87  H3'  DT A   3      34.903  12.592   7.056  1.00  0.00           H  
ATOM     88  H2'  DT A   3      32.819  13.007   6.561  1.00  0.00           H  
ATOM     89 H2''  DT A   3      32.383  11.339   6.155  1.00  0.00           H  
ATOM     90  H1'  DT A   3      31.636  10.888   8.369  1.00  0.00           H  
ATOM     91  H3   DT A   3      27.944  13.417   8.440  1.00  0.00           H  
ATOM     92  H71  DT A   3      31.498  17.132   7.943  1.00  0.00           H  
ATOM     93  H72  DT A   3      32.009  16.621   9.556  1.00  0.00           H  
ATOM     94  H73  DT A   3      30.358  17.230   9.297  1.00  0.00           H  
ATOM     95  H6   DT A   3      32.628  14.314   8.436  1.00  0.00           H  
ATOM     96  P    DA A   4      35.308  10.505   4.893  1.00 21.15           P  
ATOM     97  OP1  DA A   4      36.483   9.617   4.734  1.00 21.65           O  
ATOM     98  OP2  DA A   4      35.352  11.881   4.353  1.00 21.86           O  
ATOM     99  O5'  DA A   4      34.024   9.756   4.253  1.00 20.60           O  
ATOM    100  C5'  DA A   4      33.456   8.650   4.967  1.00 18.64           C  
ATOM    101  C4'  DA A   4      32.368   7.835   4.233  1.00 18.18           C  
ATOM    102  O4'  DA A   4      31.179   8.593   3.947  1.00 17.31           O  
ATOM    103  C3'  DA A   4      32.837   7.199   2.928  1.00 18.25           C  
ATOM    104  O3'  DA A   4      32.300   5.878   2.723  1.00 19.53           O  
ATOM    105  C2'  DA A   4      32.326   8.204   1.898  1.00 17.60           C  
ATOM    106  C1'  DA A   4      31.120   8.977   2.560  1.00 16.41           C  
ATOM    107  N9   DA A   4      31.200  10.475   2.512  1.00  0.00           N  
ATOM    108  C8   DA A   4      32.299  11.300   2.617  1.00  0.00           C  
ATOM    109  N7   DA A   4      32.038  12.574   2.581  1.00  0.00           N  
ATOM    110  C5   DA A   4      30.659  12.621   2.426  1.00  0.00           C  
ATOM    111  C6   DA A   4      29.756  13.694   2.323  1.00  0.00           C  
ATOM    112  N6   DA A   4      30.099  14.981   2.381  1.00  0.00           N  
ATOM    113  N1   DA A   4      28.462  13.399   2.159  1.00  0.00           N  
ATOM    114  C2   DA A   4      28.080  12.133   2.113  1.00  0.00           C  
ATOM    115  N3   DA A   4      28.824  11.038   2.226  1.00  0.00           N  
ATOM    116  C4   DA A   4      30.134  11.355   2.374  1.00  0.00           C  
ATOM    117  H5'  DA A   4      33.033   9.092   5.867  1.00  0.00           H  
ATOM    118 H5''  DA A   4      34.270   7.986   5.243  1.00  0.00           H  
ATOM    119  H4'  DA A   4      32.064   7.007   4.881  1.00  0.00           H  
ATOM    120  H3'  DA A   4      33.927   7.068   2.976  1.00  0.00           H  
ATOM    121  H2'  DA A   4      33.167   8.855   1.661  1.00  0.00           H  
ATOM    122 H2''  DA A   4      32.083   7.602   1.012  1.00  0.00           H  
ATOM    123  H1'  DA A   4      30.114   8.685   2.211  1.00  0.00           H  
ATOM    124  H8   DA A   4      33.328  10.960   2.724  1.00  0.00           H  
ATOM    125  H61  DA A   4      29.362  15.674   2.371  1.00  0.00           H  
ATOM    126  H62  DA A   4      31.068  15.261   2.469  1.00  0.00           H  
ATOM    127  H2   DA A   4      27.010  12.007   1.958  1.00  0.00           H  
ATOM    128  P    DC A   5      32.463   5.050   1.329  1.00  0.00           P  
ATOM    129  OP1  DC A   5      32.191   3.622   1.613  1.00  0.00           O  
ATOM    130  OP2  DC A   5      33.737   5.445   0.686  1.00  0.00           O  
ATOM    131  O5'  DC A   5      31.251   5.652   0.445  1.00  0.00           O  
ATOM    132  C5'  DC A   5      29.922   5.316   0.839  1.00  0.00           C  
ATOM    133  C4'  DC A   5      28.800   6.098   0.112  1.00  0.00           C  
ATOM    134  O4'  DC A   5      28.961   7.513   0.338  1.00  0.00           O  
ATOM    135  C3'  DC A   5      28.654   5.897  -1.436  1.00  0.00           C  
ATOM    136  O3'  DC A   5      27.254   5.762  -1.742  1.00  0.00           O  
ATOM    137  C2'  DC A   5      29.149   7.268  -1.925  1.00  0.00           C  
ATOM    138  C1'  DC A   5      28.574   8.221  -0.846  1.00  0.00           C  
ATOM    139  N1   DC A   5      29.097   9.618  -0.879  1.00  0.00           N  
ATOM    140  C2   DC A   5      28.166  10.655  -0.855  1.00  0.00           C  
ATOM    141  O2   DC A   5      26.960  10.425  -0.796  1.00  0.00           O  
ATOM    142  N3   DC A   5      28.610  11.938  -0.897  1.00  0.00           N  
ATOM    143  C4   DC A   5      29.913  12.231  -0.935  1.00  0.00           C  
ATOM    144  N4   DC A   5      30.291  13.509  -0.965  1.00  0.00           N  
ATOM    145  C5   DC A   5      30.901  11.196  -0.948  1.00  0.00           C  
ATOM    146  C6   DC A   5      30.438   9.885  -0.926  1.00  0.00           C  
ATOM    147  H5'  DC A   5      29.864   5.485   1.916  1.00  0.00           H  
ATOM    148 H5''  DC A   5      29.838   4.248   0.684  1.00  0.00           H  
ATOM    149  H4'  DC A   5      27.845   5.870   0.598  1.00  0.00           H  
ATOM    150  H3'  DC A   5      29.189   5.014  -1.835  1.00  0.00           H  
ATOM    151  H2'  DC A   5      30.251   7.226  -1.910  1.00  0.00           H  
ATOM    152 H2''  DC A   5      28.842   7.580  -2.934  1.00  0.00           H  
ATOM    153  H1'  DC A   5      27.465   8.291  -0.837  1.00  0.00           H  
ATOM    154  H41  DC A   5      29.606  14.256  -0.916  1.00  0.00           H  
ATOM    155  H42  DC A   5      31.271  13.744  -0.999  1.00  0.00           H  
ATOM    156  H5   DC A   5      31.943  11.470  -0.973  1.00  0.00           H  
ATOM    157  H6   DC A   5      31.111   9.050  -0.950  1.00  0.00           H  
ATOM    158  P    DA A   6      26.612   4.788  -2.873  1.00  0.00           P  
ATOM    159  OP1  DA A   6      26.566   3.413  -2.328  1.00  0.00           O  
ATOM    160  OP2  DA A   6      27.290   5.050  -4.163  1.00  0.00           O  
ATOM    161  O5'  DA A   6      25.092   5.339  -2.999  1.00  0.00           O  
ATOM    162  C5'  DA A   6      24.194   5.323  -1.880  1.00  0.00           C  
ATOM    163  C4'  DA A   6      23.141   6.462  -1.910  1.00  0.00           C  
ATOM    164  O4'  DA A   6      23.889   7.684  -2.022  1.00  0.00           O  
ATOM    165  C3'  DA A   6      22.152   6.434  -3.099  1.00  0.00           C  
ATOM    166  O3'  DA A   6      21.076   7.325  -2.796  1.00  0.00           O  
ATOM    167  C2'  DA A   6      23.029   7.113  -4.155  1.00  0.00           C  
ATOM    168  C1'  DA A   6      23.700   8.254  -3.327  1.00  0.00           C  
ATOM    169  N9   DA A   6      25.021   8.726  -3.815  1.00  0.00           N  
ATOM    170  C8   DA A   6      26.091   7.990  -4.263  1.00  0.00           C  
ATOM    171  N7   DA A   6      27.158   8.690  -4.520  1.00  0.00           N  
ATOM    172  C5   DA A   6      26.759  10.000  -4.274  1.00  0.00           C  
ATOM    173  C6   DA A   6      27.432  11.229  -4.367  1.00  0.00           C  
ATOM    174  N6   DA A   6      28.707  11.343  -4.728  1.00  0.00           N  
ATOM    175  N1   DA A   6      26.744  12.341  -4.069  1.00  0.00           N  
ATOM    176  C2   DA A   6      25.474  12.249  -3.700  1.00  0.00           C  
ATOM    177  N3   DA A   6      24.736  11.152  -3.561  1.00  0.00           N  
ATOM    178  C4   DA A   6      25.452  10.041  -3.871  1.00  0.00           C  
ATOM    179  H5'  DA A   6      24.833   5.371  -0.991  1.00  0.00           H  
ATOM    180 H5''  DA A   6      23.653   4.386  -1.899  1.00  0.00           H  
ATOM    181  H4'  DA A   6      22.536   6.557  -0.998  1.00  0.00           H  
ATOM    182  H3'  DA A   6      21.709   5.432  -3.291  1.00  0.00           H  
ATOM    183 HO3'  DA A   6      20.619   6.988  -2.021  1.00  0.00           H  
ATOM    184  H2'  DA A   6      23.713   6.343  -4.555  1.00  0.00           H  
ATOM    185 H2''  DA A   6      22.470   7.555  -4.987  1.00  0.00           H  
ATOM    186  H1'  DA A   6      23.047   9.117  -3.143  1.00  0.00           H  
ATOM    187  H8   DA A   6      26.062   6.908  -4.406  1.00  0.00           H  
ATOM    188  H61  DA A   6      29.130  12.256  -4.837  1.00  0.00           H  
ATOM    189  H62  DA A   6      29.246  10.510  -4.909  1.00  0.00           H  
ATOM    190  H2   DA A   6      24.990  13.205  -3.490  1.00  0.00           H  
TER     191       DA A   6                                                      
ATOM    192  O5'  DT B   7      29.716  19.599  -3.973  1.00  0.00           O  
ATOM    193  C5'  DT B   7      29.221  20.869  -4.408  1.00  0.00           C  
ATOM    194  C4'  DT B   7      27.648  20.734  -4.803  1.00  0.00           C  
ATOM    195  O4'  DT B   7      27.481  19.687  -5.800  1.00  0.00           O  
ATOM    196  C3'  DT B   7      26.683  20.310  -3.631  1.00  0.00           C  
ATOM    197  O3'  DT B   7      25.367  20.862  -3.834  1.00  0.00           O  
ATOM    198  C2'  DT B   7      26.643  18.769  -3.809  1.00  0.00           C  
ATOM    199  C1'  DT B   7      26.727  18.531  -5.328  1.00  0.00           C  
ATOM    200  N1   DT B   7      27.532  17.275  -5.427  1.00  0.00           N  
ATOM    201  C2   DT B   7      26.960  16.049  -5.128  1.00  0.00           C  
ATOM    202  O2   DT B   7      25.752  15.901  -4.955  1.00  0.00           O  
ATOM    203  N3   DT B   7      27.845  14.989  -5.029  1.00  0.00           N  
ATOM    204  C4   DT B   7      29.219  15.041  -5.218  1.00  0.00           C  
ATOM    205  O4   DT B   7      29.896  14.025  -5.068  1.00  0.00           O  
ATOM    206  C5   DT B   7      29.711  16.355  -5.582  1.00  0.00           C  
ATOM    207  C7   DT B   7      31.224  16.636  -5.743  1.00  0.00           C  
ATOM    208  C6   DT B   7      28.841  17.366  -5.754  1.00  0.00           C  
ATOM    209  H5'  DT B   7      29.934  21.204  -5.194  1.00  0.00           H  
ATOM    210 H5''  DT B   7      29.498  21.546  -3.583  1.00  0.00           H  
ATOM    211  H4'  DT B   7      27.175  21.592  -5.341  1.00  0.00           H  
ATOM    212  H3'  DT B   7      26.995  20.707  -2.640  1.00  0.00           H  
ATOM    213  H2'  DT B   7      27.532  18.312  -3.336  1.00  0.00           H  
ATOM    214 H2''  DT B   7      25.764  18.222  -3.445  1.00  0.00           H  
ATOM    215  H1'  DT B   7      25.769  18.452  -5.885  1.00  0.00           H  
ATOM    216  H3   DT B   7      27.451  14.091  -4.785  1.00  0.00           H  
ATOM    217  H71  DT B   7      31.541  17.368  -4.996  1.00  0.00           H  
ATOM    218  H72  DT B   7      31.446  17.051  -6.726  1.00  0.00           H  
ATOM    219  H73  DT B   7      31.816  15.733  -5.594  1.00  0.00           H  
ATOM    220  H6   DT B   7      29.101  18.303  -6.170  1.00  0.00           H  
ATOM    221 HO5'  DT B   7      30.618  19.743  -3.682  1.00  0.00           H  
ATOM    222  P    DG B   8      24.370  21.295  -2.623  1.00  0.00           P  
ATOM    223  OP1  DG B   8      23.422  22.288  -3.174  1.00  0.00           O  
ATOM    224  OP2  DG B   8      25.203  21.654  -1.453  1.00  0.00           O  
ATOM    225  O5'  DG B   8      23.555  19.948  -2.258  1.00  0.00           O  
ATOM    226  C5'  DG B   8      22.473  19.478  -3.074  1.00  0.00           C  
ATOM    227  C4'  DG B   8      21.583  18.430  -2.381  1.00  0.00           C  
ATOM    228  O4'  DG B   8      22.366  17.277  -2.043  1.00  0.00           O  
ATOM    229  C3'  DG B   8      20.958  18.930  -1.068  1.00  0.00           C  
ATOM    230  O3'  DG B   8      19.728  18.281  -0.722  1.00  0.00           O  
ATOM    231  C2'  DG B   8      22.094  18.609  -0.091  1.00  0.00           C  
ATOM    232  C1'  DG B   8      22.731  17.296  -0.653  1.00  0.00           C  
ATOM    233  N9   DG B   8      24.218  17.216  -0.618  1.00  0.00           N  
ATOM    234  C8   DG B   8      25.162  18.215  -0.574  1.00  0.00           C  
ATOM    235  N7   DG B   8      26.393  17.805  -0.620  1.00  0.00           N  
ATOM    236  C5   DG B   8      26.273  16.424  -0.680  1.00  0.00           C  
ATOM    237  C6   DG B   8      27.286  15.438  -0.747  1.00  0.00           C  
ATOM    238  O6   DG B   8      28.502  15.604  -0.763  1.00  0.00           O  
ATOM    239  N1   DG B   8      26.759  14.162  -0.790  1.00  0.00           N  
ATOM    240  C2   DG B   8      25.417  13.863  -0.749  1.00  0.00           C  
ATOM    241  N2   DG B   8      25.110  12.567  -0.764  1.00  0.00           N  
ATOM    242  N3   DG B   8      24.453  14.788  -0.690  1.00  0.00           N  
ATOM    243  C4   DG B   8      24.953  16.049  -0.658  1.00  0.00           C  
ATOM    244  H5'  DG B   8      22.890  18.969  -3.933  1.00  0.00           H  
ATOM    245 H5''  DG B   8      21.919  20.355  -3.405  1.00  0.00           H  
ATOM    246  H4'  DG B   8      20.827  18.053  -3.083  1.00  0.00           H  
ATOM    247  H3'  DG B   8      20.689  19.995  -1.134  1.00  0.00           H  
ATOM    248  H2'  DG B   8      22.753  19.485  -0.173  1.00  0.00           H  
ATOM    249 H2''  DG B   8      21.735  18.509   0.947  1.00  0.00           H  
ATOM    250  H1'  DG B   8      22.340  16.359  -0.235  1.00  0.00           H  
ATOM    251  H8   DG B   8      24.927  19.274  -0.505  1.00  0.00           H  
ATOM    252  H1   DG B   8      27.415  13.395  -0.860  1.00  0.00           H  
ATOM    253  H21  DG B   8      25.852  11.878  -0.777  1.00  0.00           H  
ATOM    254  H22  DG B   8      24.147  12.267  -0.757  1.00  0.00           H  
ATOM    255  P    DT B   9      19.034  18.625   0.698  1.00  0.00           P  
ATOM    256  OP1  DT B   9      17.582  18.356   0.590  1.00  0.00           O  
ATOM    257  OP2  DT B   9      19.513  19.962   1.122  1.00  0.00           O  
ATOM    258  O5'  DT B   9      19.708  17.516   1.662  1.00 16.94           O  
ATOM    259  C5'  DT B   9      19.270  16.153   1.575  1.00 16.78           C  
ATOM    260  C4'  DT B   9      20.195  15.131   2.248  1.00 16.73           C  
ATOM    261  O4'  DT B   9      21.540  15.288   1.775  1.00 16.16           O  
ATOM    262  C3'  DT B   9      20.274  15.341   3.749  1.00 17.81           C  
ATOM    263  O3'  DT B   9      19.271  14.529   4.408  1.00 20.33           O  
ATOM    264  C2'  DT B   9      21.716  14.961   4.103  1.00 16.61           C  
ATOM    265  C1'  DT B   9      22.394  14.676   2.754  1.00 14.94           C  
ATOM    266  N1   DT B   9      23.736  15.286   2.659  1.00  0.00           N  
ATOM    267  C2   DT B   9      24.849  14.472   2.499  1.00  0.00           C  
ATOM    268  O2   DT B   9      24.797  13.245   2.442  1.00  0.00           O  
ATOM    269  N3   DT B   9      26.065  15.121   2.403  1.00  0.00           N  
ATOM    270  C4   DT B   9      26.271  16.486   2.462  1.00  0.00           C  
ATOM    271  O4   DT B   9      27.412  16.939   2.355  1.00  0.00           O  
ATOM    272  C5   DT B   9      25.050  17.257   2.649  1.00  0.00           C  
ATOM    273  C7   DT B   9      25.119  18.783   2.765  1.00  0.00           C  
ATOM    274  C6   DT B   9      23.850  16.639   2.725  1.00  0.00           C  
ATOM    275  H5'  DT B   9      19.135  15.890   0.534  1.00  0.00           H  
ATOM    276 H5''  DT B   9      18.306  16.110   2.066  1.00  0.00           H  
ATOM    277  H4'  DT B   9      19.818  14.130   2.064  1.00  0.00           H  
ATOM    278  H3'  DT B   9      20.149  16.424   3.795  1.00  0.00           H  
ATOM    279  H2'  DT B   9      22.162  15.821   4.618  1.00  0.00           H  
ATOM    280 H2''  DT B   9      21.808  14.105   4.777  1.00  0.00           H  
ATOM    281  H1'  DT B   9      22.470  13.610   2.574  1.00  0.00           H  
ATOM    282  H3   DT B   9      26.883  14.541   2.278  1.00  0.00           H  
ATOM    283  H71  DT B   9      24.729  19.097   3.733  1.00  0.00           H  
ATOM    284  H72  DT B   9      24.529  19.243   1.973  1.00  0.00           H  
ATOM    285  H73  DT B   9      26.155  19.115   2.677  1.00  0.00           H  
ATOM    286  H6   DT B   9      22.904  17.145   2.838  1.00  0.00           H  
ATOM    287  P    DA B  10      19.206  14.161   5.989  1.00 22.18           P  
ATOM    288  OP1  DA B  10      17.870  13.600   6.295  1.00 21.41           O  
ATOM    289  OP2  DA B  10      19.703  15.328   6.753  1.00 21.90           O  
ATOM    290  O5'  DA B  10      20.295  12.971   6.158  1.00 21.07           O  
ATOM    291  C5'  DA B  10      20.070  11.653   5.638  1.00 20.80           C  
ATOM    292  C4'  DA B  10      20.209  10.508   6.649  1.00 20.67           C  
ATOM    293  O4'  DA B  10      21.513  10.392   7.207  1.00 20.52           O  
ATOM    294  C3'  DA B  10      19.249  10.501   7.834  1.00 20.84           C  
ATOM    295  O3'  DA B  10      18.883   9.162   8.203  1.00 22.03           O  
ATOM    296  C2'  DA B  10      20.033  11.226   8.901  1.00 20.24           C  
ATOM    297  C1'  DA B  10      21.501  11.008   8.500  1.00 19.47           C  
ATOM    298  N9   DA B  10      22.345  12.212   8.419  1.00  0.00           N  
ATOM    299  C8   DA B  10      22.009  13.530   8.236  1.00  0.00           C  
ATOM    300  N7   DA B  10      23.005  14.356   8.318  1.00  0.00           N  
ATOM    301  C5   DA B  10      24.091  13.517   8.509  1.00  0.00           C  
ATOM    302  C6   DA B  10      25.437  13.783   8.672  1.00  0.00           C  
ATOM    303  N6   DA B  10      25.871  15.040   8.718  1.00  0.00           N  
ATOM    304  N1   DA B  10      26.267  12.734   8.797  1.00  0.00           N  
ATOM    305  C2   DA B  10      25.777  11.495   8.800  1.00  0.00           C  
ATOM    306  N3   DA B  10      24.509  11.125   8.688  1.00  0.00           N  
ATOM    307  C4   DA B  10      23.709  12.208   8.539  1.00  0.00           C  
ATOM    308  H5'  DA B  10      20.736  11.466   4.797  1.00  0.00           H  
ATOM    309 H5''  DA B  10      19.060  11.597   5.274  1.00  0.00           H  
ATOM    310  H4'  DA B  10      20.038   9.594   6.101  1.00  0.00           H  
ATOM    311  H3'  DA B  10      18.337  11.022   7.569  1.00  0.00           H  
ATOM    312  H2'  DA B  10      19.685  12.254   8.909  1.00  0.00           H  
ATOM    313 H2''  DA B  10      19.832  10.802   9.890  1.00  0.00           H  
ATOM    314  H1'  DA B  10      21.965  10.327   9.215  1.00  0.00           H  
ATOM    315  H8   DA B  10      20.996  13.864   8.016  1.00  0.00           H  
ATOM    316  H61  DA B  10      26.856  15.277   8.720  1.00  0.00           H  
ATOM    317  H62  DA B  10      25.191  15.787   8.699  1.00  0.00           H  
ATOM    318  H2   DA B  10      26.496  10.674   8.904  1.00  0.00           H  
ATOM    319  P    DC B  11      18.052   8.862   9.559  1.00 23.04           P  
ATOM    320  OP1  DC B  11      17.568   7.463   9.524  1.00 23.07           O  
ATOM    321  OP2  DC B  11      17.099   9.975   9.772  1.00 22.88           O  
ATOM    322  O5'  DC B  11      19.235   8.999  10.646  1.00 22.36           O  
ATOM    323  C5'  DC B  11      20.321   8.071  10.632  1.00 21.97           C  
ATOM    324  C4'  DC B  11      21.549   8.556  11.411  1.00 21.61           C  
ATOM    325  O4'  DC B  11      22.123   9.770  10.898  1.00 21.04           O  
ATOM    326  C3'  DC B  11      21.208   8.792  12.870  1.00 21.59           C  
ATOM    327  O3'  DC B  11      21.898   7.978  13.817  1.00 22.02           O  
ATOM    328  C2'  DC B  11      21.553  10.237  13.044  1.00 21.19           C  
ATOM    329  C1'  DC B  11      22.642  10.481  12.026  1.00 20.15           C  
ATOM    330  N1   DC B  11      22.968  11.902  11.757  1.00 19.24           N  
ATOM    331  C2   DC B  11      24.300  12.324  11.764  1.00 18.87           C  
ATOM    332  O2   DC B  11      25.222  11.527  11.910  1.00 18.85           O  
ATOM    333  N3   DC B  11      24.572  13.650  11.603  1.00 18.76           N  
ATOM    334  C4   DC B  11      23.593  14.545  11.432  1.00 18.72           C  
ATOM    335  N4   DC B  11      23.900  15.842  11.327  1.00 19.29           N  
ATOM    336  C5   DC B  11      22.228  14.127  11.369  1.00 18.66           C  
ATOM    337  C6   DC B  11      21.968  12.778  11.520  1.00 18.97           C  
ATOM    338  H5'  DC B  11      20.547   7.779   9.603  1.00  0.00           H  
ATOM    339 H5''  DC B  11      19.957   7.216  11.182  1.00  0.00           H  
ATOM    340  H4'  DC B  11      22.321   7.813  11.452  1.00  0.00           H  
ATOM    341  H3'  DC B  11      20.156   8.570  12.942  1.00  0.00           H  
ATOM    342  H2'  DC B  11      20.677  10.779  12.749  1.00  0.00           H  
ATOM    343 H2''  DC B  11      21.820  10.503  14.061  1.00  0.00           H  
ATOM    344  H1'  DC B  11      23.522  10.003  12.398  1.00  0.00           H  
ATOM    345  H41  DC B  11      24.858  16.159  11.378  1.00  0.00           H  
ATOM    346  H42  DC B  11      23.162  16.526  11.227  1.00  0.00           H  
ATOM    347  H5   DC B  11      21.441  14.824  11.215  1.00  0.00           H  
ATOM    348  H6   DC B  11      20.976  12.381  11.444  1.00  0.00           H  
ATOM    349  P    DA B  12      21.079   7.482  15.118  1.00 21.87           P  
ATOM    350  OP1  DA B  12      20.197   6.369  14.697  1.00 20.77           O  
ATOM    351  OP2  DA B  12      20.506   8.670  15.789  1.00 21.95           O  
ATOM    352  O5'  DA B  12      22.259   6.918  16.043  1.00 20.28           O  
ATOM    353  C5'  DA B  12      23.118   5.921  15.504  1.00 19.38           C  
ATOM    354  C4'  DA B  12      24.438   5.740  16.296  1.00 19.13           C  
ATOM    355  O4'  DA B  12      25.052   7.044  16.339  1.00 18.12           O  
ATOM    356  C3'  DA B  12      24.272   5.290  17.750  1.00 19.23           C  
ATOM    357  O3'  DA B  12      25.537   4.903  18.296  1.00 19.95           O  
ATOM    358  C2'  DA B  12      23.872   6.627  18.285  1.00 18.09           C  
ATOM    359  C1'  DA B  12      24.868   7.589  17.656  1.00 17.35           C  
ATOM    360  N9   DA B  12      24.366   8.988  17.667  1.00  0.00           N  
ATOM    361  C8   DA B  12      23.116   9.452  17.354  1.00  0.00           C  
ATOM    362  N7   DA B  12      22.969  10.741  17.426  1.00  0.00           N  
ATOM    363  C5   DA B  12      24.217  11.172  17.851  1.00  0.00           C  
ATOM    364  C6   DA B  12      24.725  12.445  18.111  1.00  0.00           C  
ATOM    365  N6   DA B  12      23.987  13.546  17.992  1.00  0.00           N  
ATOM    366  N1   DA B  12      26.005  12.533  18.498  1.00  0.00           N  
ATOM    367  C2   DA B  12      26.723  11.427  18.635  1.00  0.00           C  
ATOM    368  N3   DA B  12      26.367  10.173  18.396  1.00  0.00           N  
ATOM    369  C4   DA B  12      25.076  10.117  18.000  1.00  0.00           C  
ATOM    370  H5'  DA B  12      23.351   6.264  14.505  1.00  0.00           H  
ATOM    371 H5''  DA B  12      22.483   5.048  15.446  1.00  0.00           H  
ATOM    372  H4'  DA B  12      25.162   5.066  15.849  1.00  0.00           H  
ATOM    373  H3'  DA B  12      23.545   4.479  17.892  1.00  0.00           H  
ATOM    374 HO3'  DA B  12      25.848   4.129  17.820  1.00  0.00           H  
ATOM    375  H2'  DA B  12      22.891   6.798  17.839  1.00  0.00           H  
ATOM    376 H2''  DA B  12      23.848   6.708  19.364  1.00  0.00           H  
ATOM    377  H1'  DA B  12      25.830   7.501  18.150  1.00  0.00           H  
ATOM    378  H8   DA B  12      22.304   8.794  17.073  1.00  0.00           H  
ATOM    379  H61  DA B  12      24.449  14.446  17.949  1.00  0.00           H  
ATOM    380  H62  DA B  12      22.991  13.474  17.832  1.00  0.00           H  
ATOM    381  H2   DA B  12      27.735  11.573  18.999  1.00  0.00           H  
TER     382       DA B  12                                                      
HETATM  383  C1  BNR B  13      22.688  17.196  14.014  1.00 13.96           C  
HETATM  384  C2  BNR B  13      21.314  17.381  14.019  1.00 13.97           C  
HETATM  385  C3  BNR B  13      20.472  16.316  14.300  1.00 14.21           C  
HETATM  386  C4  BNR B  13      21.001  15.049  14.541  1.00 14.38           C  
HETATM  387  O4  BNR B  13      20.130  14.022  14.617  1.00 14.83           O  
HETATM  388  C5  BNR B  13      22.395  14.871  14.598  1.00 14.09           C  
HETATM  389  C6  BNR B  13      22.988  13.536  14.840  1.00 14.06           C  
HETATM  390  O6  BNR B  13      22.252  12.557  15.031  1.00 14.37           O  
HETATM  391  C7  BNR B  13      24.460  13.346  14.786  1.00 14.05           C  
HETATM  392  C8  BNR B  13      25.014  12.065  14.881  1.00 14.13           C  
HETATM  393  O8  BNR B  13      24.191  10.897  14.832  1.00 14.33           O  
HETATM  394  C9  BNR B  13      26.395  11.882  14.862  1.00 14.51           C  
HETATM  395  C10 BNR B  13      26.958  10.453  14.977  1.00 14.89           C  
HETATM  396  O10 BNR B  13      26.669   9.690  13.795  1.00 15.61           O  
HETATM  397  C11 BNR B  13      28.479  10.319  15.214  1.00 14.96           C  
HETATM  398  C12 BNR B  13      29.264  11.391  14.427  1.00 15.08           C  
HETATM  399  O12 BNR B  13      29.186  11.181  13.015  1.00 15.12           O  
HETATM  400  C13 BNR B  13      30.735  11.263  14.847  1.00 15.57           C  
HETATM  401  O13 BNR B  13      31.098  11.696  15.952  1.00 15.81           O  
HETATM  402  C14 BNR B  13      31.705  10.445  14.006  1.00 16.02           C  
HETATM  403  C15 BNR B  13      28.770  12.808  14.813  1.00 14.78           C  
HETATM  404  C16 BNR B  13      27.239  12.985  14.738  1.00 14.30           C  
HETATM  405  C17 BNR B  13      26.690  14.256  14.553  1.00 14.14           C  
HETATM  406  O17 BNR B  13      27.581  15.360  14.372  1.00 13.84           O  
HETATM  407  C18 BNR B  13      25.300  14.441  14.575  1.00 13.96           C  
HETATM  408  C19 BNR B  13      24.707  15.773  14.308  1.00 13.96           C  
HETATM  409  O19 BNR B  13      25.436  16.722  13.983  1.00 14.10           O  
HETATM  410  C20 BNR B  13      23.239  15.956  14.335  1.00 14.01           C  
HETATM  411  C21 BNR B  13      19.219  13.797  13.525  1.00 14.73           C  
HETATM  412  C1' BNR B  13      26.420   8.293  14.030  1.00 16.46           C  
HETATM  413  C2' BNR B  13      25.853   7.629  12.766  1.00 16.95           C  
HETATM  414  C3' BNR B  13      26.981   7.040  11.932  1.00 17.47           C  
HETATM  415  O3' BNR B  13      26.506   6.354  10.774  1.00 17.99           O  
HETATM  416  C4' BNR B  13      27.835   6.126  12.794  1.00 17.21           C  
HETATM  417  N4' BNR B  13      27.088   4.967  13.290  1.00 17.28           N  
HETATM  418  C5' BNR B  13      28.509   6.943  13.890  1.00 17.08           C  
HETATM  419  O5' BNR B  13      27.480   7.554  14.701  1.00 16.74           O  
HETATM  420  C6' BNR B  13      29.446   6.055  14.758  1.00 16.96           C  
HETATM  421  C7' BNR B  13      27.754   3.706  13.013  1.00 20.00           C  
HETATM  422  C8' BNR B  13      28.170   3.627  11.573  1.00 20.00           C  
HETATM  423  C1B BNR B  13      26.330  17.405   6.021  1.00 13.96           C  
HETATM  424  C2B BNR B  13      27.375  18.322   6.143  1.00 13.97           C  
HETATM  425  C3B BNR B  13      28.671  17.945   5.811  1.00 14.21           C  
HETATM  426  C4B BNR B  13      28.927  16.649   5.381  1.00 14.38           C  
HETATM  427  O4' BNR B  13      30.081  16.405   4.734  1.00 14.83           O  
HETATM  428  C5B BNR B  13      27.914  15.685   5.436  1.00 14.09           C  
HETATM  429  C6B BNR B  13      28.237  14.253   5.318  1.00 14.06           C  
HETATM  430  O6' BNR B  13      29.422  13.893   5.280  1.00 14.37           O  
HETATM  431  C7B BNR B  13      27.153  13.245   5.307  1.00 14.05           C  
HETATM  432  C8B BNR B  13      27.464  11.896   5.178  1.00 14.13           C  
HETATM  433  O8' BNR B  13      28.819  11.450   5.251  1.00 14.33           O  
HETATM  434  C9' BNR B  13      26.462  10.935   5.188  1.00 14.51           C  
HETATM  435  CA' BNR B  13      26.861   9.478   4.937  1.00 14.89           C  
HETATM  436  OA' BNR B  13      27.614   9.082   6.117  1.00 15.61           O  
HETATM  437  CB' BNR B  13      25.632   8.544   4.679  1.00 14.96           C  
HETATM  438  CC' BNR B  13      24.610   8.810   5.823  1.00 15.08           C  
HETATM  439  OC' BNR B  13      25.276   8.779   7.092  1.00 15.12           O  
HETATM  440  CD' BNR B  13      23.522   7.733   5.909  1.00 15.57           C  
HETATM  441  OD' BNR B  13      22.876   7.422   4.898  1.00 15.81           O  
HETATM  442  CE' BNR B  13      23.356   6.920   7.212  1.00 16.02           C  
HETATM  443  CF' BNR B  13      24.020  10.229   5.602  1.00 14.78           C  
HETATM  444  CG' BNR B  13      25.132  11.308   5.427  1.00 14.30           C  
HETATM  445  CH' BNR B  13      24.809  12.663   5.513  1.00 14.14           C  
HETATM  446  OH' BNR B  13      23.422  13.022   5.530  1.00 13.84           O  
HETATM  447  CI' BNR B  13      25.821  13.637   5.465  1.00 13.96           C  
HETATM  448  CJ' BNR B  13      25.512  15.069   5.683  1.00 13.96           C  
HETATM  449  OJ' BNR B  13      24.344  15.426   5.895  1.00 14.10           O  
HETATM  450  CK' BNR B  13      26.599  16.075   5.695  1.00 14.01           C  
HETATM  451  CL' BNR B  13      31.326  16.574   5.415  1.00 14.73           C  
HETATM  452  C1D BNR B  13      28.815   8.302   5.945  1.00 16.46           C  
HETATM  453  C2D BNR B  13      29.572   8.072   7.287  1.00 16.95           C  
HETATM  454  C3D BNR B  13      28.748   7.089   8.126  1.00 17.47           C  
HETATM  455  O3D BNR B  13      29.326   6.766   9.392  1.00 17.99           O  
HETATM  456  C4D BNR B  13      28.448   5.811   7.324  1.00 17.21           C  
HETATM  457  N4D BNR B  13      29.607   4.942   7.093  1.00 17.28           N  
HETATM  458  C5D BNR B  13      27.680   6.158   6.053  1.00 17.08           C  
HETATM  459  O5D BNR B  13      28.496   7.058   5.267  1.00 16.74           O  
HETATM  460  C6D BNR B  13      27.281   4.877   5.251  1.00 16.96           C  
HETATM  461  C7D BNR B  13      29.355   3.550   7.484  1.00 20.00           C  
HETATM  462  C8D BNR B  13      28.923   3.527   8.925  1.00 20.00           C  
HETATM  463  C9A BNR B  13      29.510   3.766  11.235  1.00 20.00           C  
HETATM  464  C9B BNR B  13      27.201   3.531  10.585  1.00 20.00           C  
HETATM  465  C1A BNR B  13      29.855   3.830   9.898  1.00 20.00           C  
HETATM  466  C1C BNR B  13      27.585   3.346   9.266  1.00 20.00           C  
HETATM  467  H1  BNR B  13      23.312  18.017  13.753  1.00  0.00           H  
HETATM  468  H2  BNR B  13      20.895  18.339  13.805  1.00  0.00           H  
HETATM  469  H3  BNR B  13      19.415  16.482  14.329  1.00  0.00           H  
HETATM  470  HO8 BNR B  13      23.732  10.852  15.673  1.00  0.00           H  
HETATM  471  H10 BNR B  13      26.377  10.042  15.805  1.00  0.00           H  
HETATM  472 H111 BNR B  13      28.770  10.256  16.262  1.00  0.00           H  
HETATM  473 H112 BNR B  13      28.752   9.343  14.810  1.00  0.00           H  
HETATM  474  H12 BNR B  13      29.328  12.033  12.594  1.00  0.00           H  
HETATM  475 H141 BNR B  13      31.746  10.860  13.000  1.00  0.00           H  
HETATM  476 H142 BNR B  13      31.363   9.411  13.968  1.00  0.00           H  
HETATM  477 H143 BNR B  13      32.692  10.484  14.466  1.00  0.00           H  
HETATM  478 H151 BNR B  13      29.065  12.964  15.857  1.00  0.00           H  
HETATM  479 H152 BNR B  13      29.232  13.572  14.176  1.00  0.00           H  
HETATM  480  H17 BNR B  13      27.280  15.859  13.612  1.00  0.00           H  
HETATM  481 H211 BNR B  13      19.767  13.699  12.589  1.00  0.00           H  
HETATM  482 H212 BNR B  13      18.524  14.631  13.429  1.00  0.00           H  
HETATM  483 H213 BNR B  13      18.658  12.882  13.706  1.00  0.00           H  
HETATM  484  H1' BNR B  13      25.608   8.279  14.736  1.00  0.00           H  
HETATM  485 H2'1 BNR B  13      25.448   8.398  12.130  1.00  0.00           H  
HETATM  486 H2'2 BNR B  13      25.035   6.940  13.008  1.00  0.00           H  
HETATM  487  H3' BNR B  13      27.641   7.824  11.566  1.00  0.00           H  
HETATM  488 HO3' BNR B  13      27.245   6.360  10.168  1.00  0.00           H  
HETATM  489  H4' BNR B  13      28.650   5.813  12.168  1.00  0.00           H  
HETATM  490 HN'1 BNR B  13      26.161   4.921  12.819  1.00  0.00           H  
HETATM  491 HN'2 BNR B  13      26.912   5.055  14.311  1.00  0.00           H  
HETATM  492  H5' BNR B  13      29.103   7.700  13.350  1.00  0.00           H  
HETATM  493 H6'1 BNR B  13      28.879   5.283  15.285  1.00  0.00           H  
HETATM  494 H6'2 BNR B  13      29.973   6.645  15.508  1.00  0.00           H  
HETATM  495 H6'3 BNR B  13      30.187   5.544  14.140  1.00  0.00           H  
HETATM  496 H7'1 BNR B  13      27.055   2.891  13.112  1.00  0.00           H  
HETATM  497 H7'2 BNR B  13      28.622   3.519  13.632  1.00  0.00           H  
HETATM  498  H1B BNR B  13      25.318  17.721   6.171  1.00  0.00           H  
HETATM  499  H2' BNR B  13      27.210  19.317   6.499  1.00  0.00           H  
HETATM  500  H3B BNR B  13      29.484  18.639   5.885  1.00  0.00           H  
HETATM  501 HO8' BNR B  13      29.046  11.445   6.185  1.00  0.00           H  
HETATM  502 H10' BNR B  13      27.540   9.516   4.077  1.00  0.00           H  
HETATM  503 HL'1 BNR B  13      25.179   8.662   3.685  1.00  0.00           H  
HETATM  504 HL'2 BNR B  13      25.953   7.508   4.654  1.00  0.00           H  
HETATM  505 H12' BNR B  13      24.989   9.545   7.596  1.00  0.00           H  
HETATM  506 HK'1 BNR B  13      23.144   7.589   8.048  1.00  0.00           H  
HETATM  507 HK'2 BNR B  13      24.289   6.398   7.437  1.00  0.00           H  
HETATM  508 HK'3 BNR B  13      22.557   6.187   7.122  1.00  0.00           H  
HETATM  509 HJ'1 BNR B  13      23.400  10.236   4.705  1.00  0.00           H  
HETATM  510 HJ'2 BNR B  13      23.360  10.481   6.443  1.00  0.00           H  
HETATM  511 H17' BNR B  13      23.266  13.466   6.365  1.00  0.00           H  
HETATM  512 HI'1 BNR B  13      31.395  15.840   6.214  1.00  0.00           H  
HETATM  513 HI'2 BNR B  13      31.403  17.584   5.819  1.00  0.00           H  
HETATM  514 HI'3 BNR B  13      32.139  16.407   4.710  1.00  0.00           H  
HETATM  515  H1D BNR B  13      29.515   8.884   5.363  1.00  0.00           H  
HETATM  516  H2B BNR B  13      29.709   9.012   7.834  1.00  0.00           H  
HETATM  517  H2D BNR B  13      30.582   7.686   7.113  1.00  0.00           H  
HETATM  518  H3D BNR B  13      27.784   7.551   8.350  1.00  0.00           H  
HETATM  519 HO3A BNR B  13      28.582   6.597   9.969  1.00  0.00           H  
HETATM  520  H4D BNR B  13      27.748   5.265   7.926  1.00  0.00           H  
HETATM  521  HNB BNR B  13      30.404   5.290   7.664  1.00  0.00           H  
HETATM  522  HND BNR B  13      29.904   4.983   6.097  1.00  0.00           H  
HETATM  523  H5D BNR B  13      26.796   6.697   6.434  1.00  0.00           H  
HETATM  524  H6B BNR B  13      28.161   4.323   4.916  1.00  0.00           H  
HETATM  525  H6D BNR B  13      26.694   5.116   4.364  1.00  0.00           H  
HETATM  526  H6E BNR B  13      26.694   4.191   5.868  1.00  0.00           H  
HETATM  527  H7B BNR B  13      30.278   2.984   7.458  1.00  0.00           H  
HETATM  528  H7D BNR B  13      28.609   3.027   6.900  1.00  0.00           H  
HETATM  529  H9A BNR B  13      30.261   3.877  11.992  1.00  0.00           H  
HETATM  530  H9B BNR B  13      26.189   3.718  10.847  1.00  0.00           H  
HETATM  531 H9A' BNR B  13      30.790   4.176   9.563  1.00  0.00           H  
HETATM  532 H9B' BNR B  13      26.854   3.090   8.524  1.00  0.00           H  
CONECT  383  384  410  467                                                      
CONECT  384  383  385  468                                                      
CONECT  385  384  386  469                                                      
CONECT  386  385  387  388                                                      
CONECT  387  386  411                                                           
CONECT  388  386  389  410                                                      
CONECT  389  388  390  391                                                      
CONECT  390  389                                                                
CONECT  391  389  392  407                                                      
CONECT  392  391  393  394                                                      
CONECT  393  392  470                                                           
CONECT  394  392  395  404                                                      
CONECT  395  394  396  397  471                                                 
CONECT  396  395  412                                                           
CONECT  397  395  398  472  473                                                 
CONECT  398  397  399  400  403                                                 
CONECT  399  398  474                                                           
CONECT  400  398  401  402                                                      
CONECT  401  400                                                                
CONECT  402  400  475  476  477                                                 
CONECT  403  398  404  478  479                                                 
CONECT  404  394  403  405                                                      
CONECT  405  404  406  407                                                      
CONECT  406  405  480                                                           
CONECT  407  391  405  408                                                      
CONECT  408  407  409  410                                                      
CONECT  409  408                                                                
CONECT  410  383  388  408                                                      
CONECT  411  387  481  482  483                                                 
CONECT  412  396  413  419  484                                                 
CONECT  413  412  414  485  486                                                 
CONECT  414  413  415  416  487                                                 
CONECT  415  414  488                                                           
CONECT  416  414  417  418  489                                                 
CONECT  417  416  421  490  491                                                 
CONECT  418  416  419  420  492                                                 
CONECT  419  412  418                                                           
CONECT  420  418  493  494  495                                                 
CONECT  421  417  422  496  497                                                 
CONECT  422  421  463  464                                                      
CONECT  423  424  450  498                                                      
CONECT  424  423  425  499                                                      
CONECT  425  424  426  500                                                      
CONECT  426  425  427  428                                                      
CONECT  427  426  451                                                           
CONECT  428  426  429  450                                                      
CONECT  429  428  430  431                                                      
CONECT  430  429                                                                
CONECT  431  429  432  447                                                      
CONECT  432  431  433  434                                                      
CONECT  433  432  501                                                           
CONECT  434  432  435  444                                                      
CONECT  435  434  436  437  502                                                 
CONECT  436  435  452                                                           
CONECT  437  435  438  503  504                                                 
CONECT  438  437  439  440  443                                                 
CONECT  439  438  505                                                           
CONECT  440  438  441  442                                                      
CONECT  441  440                                                                
CONECT  442  440  506  507  508                                                 
CONECT  443  438  444  509  510                                                 
CONECT  444  434  443  445                                                      
CONECT  445  444  446  447                                                      
CONECT  446  445  511                                                           
CONECT  447  431  445  448                                                      
CONECT  448  447  449  450                                                      
CONECT  449  448                                                                
CONECT  450  423  428  448                                                      
CONECT  451  427  512  513  514                                                 
CONECT  452  436  453  459  515                                                 
CONECT  453  452  454  516  517                                                 
CONECT  454  453  455  456  518                                                 
CONECT  455  454  519                                                           
CONECT  456  454  457  458  520                                                 
CONECT  457  456  461  521  522                                                 
CONECT  458  456  459  460  523                                                 
CONECT  459  452  458                                                           
CONECT  460  458  524  525  526                                                 
CONECT  461  457  462  527  528                                                 
CONECT  462  461  465  466                                                      
CONECT  463  422  465  529                                                      
CONECT  464  422  466  530                                                      
CONECT  465  462  463  531                                                      
CONECT  466  462  464  532                                                      
CONECT  467  383                                                                
CONECT  468  384                                                                
CONECT  469  385                                                                
CONECT  470  393                                                                
CONECT  471  395                                                                
CONECT  472  397                                                                
CONECT  473  397                                                                
CONECT  474  399                                                                
CONECT  475  402                                                                
CONECT  476  402                                                                
CONECT  477  402                                                                
CONECT  478  403                                                                
CONECT  479  403                                                                
CONECT  480  406                                                                
CONECT  481  411                                                                
CONECT  482  411                                                                
CONECT  483  411                                                                
CONECT  484  412                                                                
CONECT  485  413                                                                
CONECT  486  413                                                                
CONECT  487  414                                                                
CONECT  488  415                                                                
CONECT  489  416                                                                
CONECT  490  417                                                                
CONECT  491  417                                                                
CONECT  492  418                                                                
CONECT  493  420                                                                
CONECT  494  420                                                                
CONECT  495  420                                                                
CONECT  496  421                                                                
CONECT  497  421                                                                
CONECT  498  423                                                                
CONECT  499  424                                                                
CONECT  500  425                                                                
CONECT  501  433                                                                
CONECT  502  435                                                                
CONECT  503  437                                                                
CONECT  504  437                                                                
CONECT  505  439                                                                
CONECT  506  442                                                                
CONECT  507  442                                                                
CONECT  508  442                                                                
CONECT  509  443                                                                
CONECT  510  443                                                                
CONECT  511  446                                                                
CONECT  512  451                                                                
CONECT  513  451                                                                
CONECT  514  451                                                                
CONECT  515  452                                                                
CONECT  516  453                                                                
CONECT  517  453                                                                
CONECT  518  454                                                                
CONECT  519  455                                                                
CONECT  520  456                                                                
CONECT  521  457                                                                
CONECT  522  457                                                                
CONECT  523  458                                                                
CONECT  524  460                                                                
CONECT  525  460                                                                
CONECT  526  460                                                                
CONECT  527  461                                                                
CONECT  528  461                                                                
CONECT  529  463                                                                
CONECT  530  464                                                                
CONECT  531  465                                                                
CONECT  532  466                                                                
MASTER      144    0    1    0    0    0    2    6  324    2  150    2          
END