*HEADER    RNA                                     24-SEP-02   1MV1              
*TITLE     THE TANDEM, SHEARED PA PAIRS IN 5'(RGGCPAGCCU)2                       
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: 5'-R(*GP*GP*CP*(P5P)P*AP*GP*CP*CP*U)-3';                   
*COMPND   3 CHAIN: A, B;                                                         
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES                                                       
*KEYWDS    RIBONUCLEIC ACID, DUPLEX, TANDEM MISMATCH, PURINE                     
*EXPDTA    NMR                                                                   
*AUTHOR    B.M.ZNOSKO, M.E.BURKARD, T.R.KRUGH, D.H.TURNER                        
*REVDAT   1   18-DEC-02 1MV1    0                                                
!BIOSYM restraint 1
!
!   The format and some of the numbers in this file were taken from MEB's 
!    G7syn.rstrnt file.  Any numbers taken from MEB's file will be noted.
!
!
#distance
!
!HYDROGEN-BONDING DISTANCES (based on theoretical # and taken from MEB)
!
1:G5'_1:H1         1:C_8B:N3            1.800    2.500    25.000   25.000 1000.000    !Hbond
1:G5'_1:O6         1:C_8B:H42           1.800    2.500    25.000   25.000 1000.000    !Hbond
1:G5'_1:H22        1:C_8B:O2            1.800    2.500    25.000   25.000 1000.000    !Hbond
1:G_2:H1           1:C_7B:N3            1.800    2.500    25.000   25.000 1000.000    !Hbond
1:G_2:O6           1:C_7B:H42           1.800    2.500    25.000   25.000 1000.000    !Hbond
1:G_2:H22          1:C_7B:O2            1.800    2.500    25.000   25.000 1000.000    !Hbond
1:C_3:N3           1:G_6B:H1            1.800    2.500    25.000   25.000 1000.000    !Hbond
1:C_3:H42          1:G_6B:O6            1.800    2.500    25.000   25.000 1000.000    !Hbond
1:C_3:O2           1:G_6B:H22           1.800    2.500    25.000   25.000 1000.000    !Hbond
1:G_6:H1           1:C_3B:N3            1.800    2.500    25.000   25.000 1000.000    !Hbond
1:G_6:O6           1:C_3B:H42           1.800    2.500    25.000   25.000 1000.000    !Hbond
1:G_6:H22          1:C_3B:O2            1.800    2.500    25.000   25.000 1000.000    !Hbond
1:C_7:N3           1:G_2B:H1            1.800    2.500    25.000   25.000 1000.000    !Hbond
1:C_7:H42          1:G_2B:O6            1.800    2.500    25.000   25.000 1000.000    !Hbond
1:C_7:O2           1:G_2B:H22           1.800    2.500    25.000   25.000 1000.000    !Hbond
1:C_8:N3           1:G5'_1B:H1          1.800    2.500    25.000   25.000 1000.000    !Hbond
1:C_8:H42          1:G5'_1B:O6          1.800    2.500    25.000   25.000 1000.000    !Hbond
1:C_8:O2           1:G5'_1B:H22         1.800    2.500    25.000   25.000 1000.000    !Hbond
!
!***************************************************
!strand 1:
!
#distance
!
1:G5'_1:H8        1:G5'_1:H1'         2.673    4.964    25.000   25.000 1000.000 !  3.818  0.30/0.30:      
1:G5'_1:H8        1:G5'_1:H4'         2.647    4.916    25.000   25.000 1000.000 !  3.782  0.30/0.30:            
1:G5'_1:H1'       1:G5'_1:H4'         2.179    4.047    25.000   25.000 1000.000 !  3.113  0.30/0.30:           
1:G5'_1:H1'       1:G_2:H8            2.642    4.907    25.000   25.000 1000.000 !  3.775  0.30/0.30:      
1:G5'_1:H2'       1:G5'_1:H8          2.877    5.343    25.000   25.000 1000.000 !  4.110  0.30/0.30:           
1:G5'_1:H2'       1:G5'_1:H1'         1.908    3.543    25.000   25.000 1000.000 !  2.725  0.30/0.30:      
1:G5'_1:H2'       1:G5'_1:H3'         1.575    2.925    25.000   25.000 1000.000 !  2.250  0.30/0.30:            
1:G_2:H8          1:G5'_1:H2'         1.692    3.141    25.000   25.000 1000.000 !  2.417  0.30/0.30:      
1:G_2:H8          1:G_2:H1'           2.441    4.534    25.000   25.000 1000.000 !  3.488  0.30/0.30:      
1:G_2:H8          1:G5'_1:H3'         1.720    3.195    25.000   25.000 1000.000 !  2.457  0.30/0.30:                      
1:G5'_1:H3'       1:G5'_1:H8          2.456    4.562    25.000   25.000 1000.000 !  3.509  0.30/0.30:      
1:G_2:H2'         1:G_2:H1'           1.842    3.420    25.000   25.000 1000.000 !  2.631  0.30/0.30:      
1:G_2:H2'         1:C_3:H6            1.645    3.055    25.000   25.000 1000.000 !  2.350  0.30/0.30:      
1:G_2:H3'         1:G_2:H8            2.195    4.076    25.000   25.000 1000.000 !  3.136  0.30/0.30:      
1:G_2:H4'         1:G_2:H1'           2.370    4.402    25.000   25.000 1000.000 !  3.386  0.30/0.30:            
1:C_3:H5          1:G_2:H2'           2.050    3.807    25.000   25.000 1000.000 !  2.928  0.30/0.30:        
1:C_3:H6          1:C_3:H5            1.825    3.390    25.000   25.000 1000.000 !  2.608  0.30/0.30:      
1:C_3:H6          1:C_3:H1'           3.065    5.691    25.000   25.000 1000.000 !  4.378  0.30/0.30:      
1:C_3:H6          1:C_3:H3'           1.815    3.371    25.000   25.000 1000.000 !  2.593  0.30/0.30:            
1:C_3:H1'         1:G_2:H2'           2.652    4.925    25.000   25.000 1000.000 !  3.788  0.30/0.30:      
1:C_3:H1'         1:C_3:H2'           1.782    3.310    25.000   25.000 1000.000 !  2.546  0.30/0.30:           
1:C_3:H1'         1:PUR_4:H8          2.822    5.240    25.000   25.000 1000.000 !  4.031  0.30/0.30:      
1:C_3:H3'         1:C_3:H1'           2.594    4.818    25.000   25.000 1000.000 !  3.706  0.30/0.30:      
1:C_3:H3'         1:PUR_4:H8          2.834    5.263    25.000   25.000 1000.000 !  4.049  0.30/0.30:                       
1:PUR_4:H8        1:C_3:H6            3.151    5.852    25.000   25.000 1000.000 !  4.501  0.30/0.30:      
1:PUR_4:H8        1:C_3:H2'           1.876    3.483    25.000   25.000 1000.000 !  2.679  0.30/0.30:      
1:PUR_4:H8        1:PUR_4:H1'         2.687    4.990    25.000   25.000 1000.000 !  3.839  0.30/0.30:      
1:PUR_4:H8        1:PUR_4:H3'         2.229    4.140    25.000   25.000 1000.000 !  3.185  0.30/0.30:            
1:PUR_4:H1'       1:C_3:H2'           2.272    4.219    25.000   25.000 1000.000 !  3.246  0.30/0.30:      
1:PUR_4:H1'       1:PUR_4:H3'         2.690    4.996    25.000   25.000 1000.000 !  3.843  0.30/0.30:          
1:PUR_4:H2'       1:PUR_4:H8          2.452    4.554    25.000   25.000 1000.000 !  3.503  0.30/0.30:      
1:PUR_4:H2'       1:PUR_4:H1'         1.916    3.558    25.000   25.000 1000.000 !  2.737  0.30/0.30:      
1:PUR_4:H2'       1:A_5:H8            1.966    3.651    25.000   25.000 1000.000 !  2.808  0.30/0.30:      
1:A_5:H2          1:A_5:H2'           3.021    5.611    25.000   25.000 1000.000 !  4.316  0.30/0.30:      
1:A_5:H2          1:G_6:H1'           2.168    4.026    25.000   25.000 1000.000 !  3.097  0.30/0.30:            
1:A_5:H8          1:PUR_4:H1'         2.978    5.530    25.000   25.000 1000.000 !  4.254  0.30/0.30:      
1:A_5:H8          1:G_6:H8            2.672    4.961    25.000   25.000 1000.000 !  3.816  0.30/0.30:            
1:A_5:H1'         1:A_5:H8            2.682    4.981    25.000   25.000 1000.000 !  3.832  0.30/0.30:      
1:A_5:H1'         1:A_5:H3'           2.253    4.184    25.000   25.000 1000.000 !  3.218  0.30/0.30:      
1:A_5:H1'         1:A_5:H4'           2.192    4.070    25.000   25.000 1000.000 !  3.131  0.30/0.30:           
1:A_5:H2'         1:A_5:H8            2.685    4.986    25.000   25.000 1000.000 !  3.835  0.30/0.30:      
1:A_5:H2'         1:A_5:H1'           1.966    3.651    25.000   25.000 1000.000 !  2.809  0.30/0.30:          
1:A_5:H3'         1:A_5:H8            2.266    4.209    25.000   25.000 1000.000 !  3.237  0.30/0.30:      
1:A_5:H3'         1:A_5:H2'           1.917    3.560    25.000   25.000 1000.000 !  2.738  0.30/0.30:      
1:A_5:H3'         1:G_6:H8            1.817    3.375    25.000   25.000 1000.000 !  2.596  0.30/0.30:            
1:G_6:H8          1:A_5:H2'           1.944    3.611    25.000   25.000 1000.000 !  2.778  0.30/0.30:      
1:G_6:H8          1:G_6:H2'           2.734    5.078    25.000   25.000 1000.000 !  3.906  0.30/0.30:      
1:G_6:H8          1:G_6:H3'           1.734    3.221    25.000   25.000 1000.000 !  2.478  0.30/0.30:      
1:G_6:H8          1:G_6:H4'           2.538    4.714    25.000   25.000 1000.000 !  3.626  0.30/0.30:      
1:G_6:H8          1:C_7:H5            2.809    5.216    25.000   25.000 1000.000 !  4.012  0.30/0.30:      
1:G_6:H1'         1:A_5:H2'           2.059    3.824    25.000   25.000 1000.000 !  2.941  0.30/0.30:      
1:G_6:H1'         1:G_6:H8            2.415    4.484    25.000   25.000 1000.000 !  3.449  0.30/0.30:      
1:G_6:H2'         1:C_7:H5            2.309    4.289    25.000   25.000 1000.000 !  3.299  0.30/0.30:      
1:G_6:H2'         1:C_7:H6            1.668    3.098    25.000   25.000 1000.000 !  2.383  0.30/0.30:      
1:G_6:H2'         1:C_7:H1'           2.975    5.525    25.000   25.000 1000.000 !  4.250  0.30/0.30:        
1:C_7:H5          1:G_6:H3'           2.155    4.002    25.000   25.000 1000.000 !  3.079  0.30/0.30:           
1:C_7:H6          1:C_7:H5            1.729    3.211    25.000   25.000 1000.000 !  2.470  0.30/0.30:           
1:C_7:H6          1:C_8:H5            3.180    5.907    25.000   25.000 1000.000 !  4.544  0.30/0.30:      
1:C_7:H1'         1:C_7:H6            2.800    5.200    25.000   25.000 1000.000 !  4.000  0.30/0.30:           
1:C_7:H1'         1:C_8:H6            2.962    5.501    25.000   25.000 1000.000 !  4.232  0.30/0.30:      
1:C_7:H2'         1:C_7:H1'           1.868    3.469    25.000   25.000 1000.000 !  2.669  0.30/0.30:      
1:C_7:H2'         1:C_8:H5            2.404    4.465    25.000   25.000 1000.000 !  3.434  0.30/0.30:      
1:C_7:H2'         1:C_8:H6            1.589    2.951    25.000   25.000 1000.000 !  2.270  0.30/0.30:            
1:C_7:H3'         1:C_7:H6            1.780    3.306    25.000   25.000 1000.000 !  2.543  0.30/0.30:      
1:C_7:H3'         1:C_7:H1'           2.416    4.487    25.000   25.000 1000.000 !  3.452  0.30/0.30:      
1:C_7:H3'         1:C_8:H5            3.208    5.957    25.000   25.000 1000.000 !  4.583  0.30/0.30:      
1:C_8:H5          1:U3'_9:H5          2.431    4.515    25.000   25.000 1000.000 !  3.473  0.30/0.30:            
1:C_8:H6          1:C_7:H3'           1.878    3.487    25.000   25.000 1000.000 !  2.682  0.30/0.30:      
1:C_8:H6          1:C_8:H5            1.785    3.315    25.000   25.000 1000.000 !  2.550  0.30/0.30:      
1:C_8:H6          1:C_8:H1'           2.501    4.645    25.000   25.000 1000.000 !  3.573  0.30/0.30:           
1:C_8:H2'         1:C_8:H6            2.297    4.265    25.000   25.000 1000.000 !  3.281  0.30/0.30:      
1:C_8:H2'         1:C_8:H1'           1.821    3.381    25.000   25.000 1000.000 !  2.601  0.30/0.30:      
1:C_8:H2'         1:U3'_9:H6          1.834    3.406    25.000   25.000 1000.000 !  2.620  0.30/0.30:      
1:C_8:H2'         1:U3'_9:H1'         2.952    5.483    25.000   25.000 1000.000 !  4.218  0.30/0.30:      
1:C_8:H3'         1:C_8:H1'           2.427    4.508    25.000   25.000 1000.000 !  3.468  0.30/0.30:      
1:C_8:H3'         1:U3'_9:H6          2.430    4.512    25.000   25.000 1000.000 !  3.471  0.30/0.30:      
1:U3'_9:H6        1:U3'_9:H5          1.714    3.184    25.000   25.000 1000.000 !  2.449  0.30/0.30:      
1:U3'_9:H6        1:U3'_9:H1'         2.816    5.230    25.000   25.000 1000.000 !  4.023  0.30/0.30:           
1:U3'_9:H1'       1:U3'_9:H3'         2.064    3.834    25.000   25.000 1000.000 !  2.949  0.30/0.30:      
1:U3'_9:H2'       1:U3'_9:H6          2.276    4.227    25.000   25.000 1000.000 !  3.252  0.30/0.30:      
1:U3'_9:H2'       1:U3'_9:H1'         2.050    3.807    25.000   25.000 1000.000 !  2.928  0.30/0.30:      
1:U3'_9:H3'       1:U3'_9:H5          2.943    5.466    25.000   25.000 1000.000 !  4.205  0.30/0.30:      
1:U3'_9:H3'       1:U3'_9:H6          2.143    3.981    25.000   25.000 1000.000 !  3.062  0.30/0.30:      
!
!***************************************************
!
!strand 2:
!
1:G5'_1B:H8        1:G5'_1B:H1'         2.673    4.964    25.000   25.000 1000.000 !  3.818  0.30/0.30:      
1:G5'_1B:H8        1:G5'_1B:H4'         2.647    4.916    25.000   25.000 1000.000 !  3.782  0.30/0.30:            
1:G5'_1B:H1'       1:G5'_1B:H4'         2.179    4.047    25.000   25.000 1000.000 !  3.113  0.30/0.30:           
1:G5'_1B:H1'       1:G_2B:H8            2.642    4.907    25.000   25.000 1000.000 !  3.775  0.30/0.30:      
1:G5'_1B:H2'       1:G5'_1B:H8          2.877    5.343    25.000   25.000 1000.000 !  4.110  0.30/0.30:           
1:G5'_1B:H2'       1:G5'_1B:H1'         1.908    3.543    25.000   25.000 1000.000 !  2.725  0.30/0.30:      
1:G5'_1B:H2'       1:G5'_1B:H3'         1.575    2.925    25.000   25.000 1000.000 !  2.250  0.30/0.30:            
1:G_2B:H8          1:G5'_1B:H2'         1.692    3.141    25.000   25.000 1000.000 !  2.417  0.30/0.30:      
1:G_2B:H8          1:G_2B:H1'           2.441    4.534    25.000   25.000 1000.000 !  3.488  0.30/0.30:      
1:G_2B:H8          1:G5'_1B:H3'         1.720    3.195    25.000   25.000 1000.000 !  2.457  0.30/0.30:                      
1:G5'_1B:H3'       1:G5'_1B:H8          2.456    4.562    25.000   25.000 1000.000 !  3.509  0.30/0.30:      
1:G_2B:H2'         1:G_2B:H1'           1.842    3.420    25.000   25.000 1000.000 !  2.631  0.30/0.30:      
1:G_2B:H2'         1:C_3B:H6            1.645    3.055    25.000   25.000 1000.000 !  2.350  0.30/0.30:      
1:G_2B:H3'         1:G_2B:H8            2.195    4.076    25.000   25.000 1000.000 !  3.136  0.30/0.30:      
1:G_2B:H4'         1:G_2B:H1'           2.370    4.402    25.000   25.000 1000.000 !  3.386  0.30/0.30:            
1:C_3B:H5          1:G_2B:H2'           2.050    3.807    25.000   25.000 1000.000 !  2.928  0.30/0.30:        
1:C_3B:H6          1:C_3B:H5            1.825    3.390    25.000   25.000 1000.000 !  2.608  0.30/0.30:      
1:C_3B:H6          1:C_3B:H1'           3.065    5.691    25.000   25.000 1000.000 !  4.378  0.30/0.30:      
1:C_3B:H6          1:C_3B:H3'           1.815    3.371    25.000   25.000 1000.000 !  2.593  0.30/0.30:            
1:C_3B:H1'         1:G_2B:H2'           2.652    4.925    25.000   25.000 1000.000 !  3.788  0.30/0.30:      
1:C_3B:H1'         1:C_3B:H2'           1.782    3.310    25.000   25.000 1000.000 !  2.546  0.30/0.30:           
1:C_3B:H1'         1:PUR_4B:H8          2.822    5.240    25.000   25.000 1000.000 !  4.031  0.30/0.30:      
1:C_3B:H3'         1:C_3B:H1'           2.594    4.818    25.000   25.000 1000.000 !  3.706  0.30/0.30:      
1:C_3B:H3'         1:PUR_4B:H8          2.834    5.263    25.000   25.000 1000.000 !  4.049  0.30/0.30:                          
1:PUR_4B:H8        1:C_3B:H6            3.151    5.852    25.000   25.000 1000.000 !  4.501  0.30/0.30:      
1:PUR_4B:H8        1:C_3B:H2'           1.876    3.483    25.000   25.000 1000.000 !  2.679  0.30/0.30:      
1:PUR_4B:H8        1:PUR_4B:H1'         2.687    4.990    25.000   25.000 1000.000 !  3.839  0.30/0.30:      
1:PUR_4B:H8        1:PUR_4B:H3'         2.229    4.140    25.000   25.000 1000.000 !  3.185  0.30/0.30:            
1:PUR_4B:H1'       1:C_3B:H2'           2.272    4.219    25.000   25.000 1000.000 !  3.246  0.30/0.30:      
1:PUR_4B:H1'       1:PUR_4B:H3'         2.690    4.996    25.000   25.000 1000.000 !  3.843  0.30/0.30:          
1:PUR_4B:H2'       1:PUR_4B:H8          2.452    4.554    25.000   25.000 1000.000 !  3.503  0.30/0.30:      
1:PUR_4B:H2'       1:PUR_4B:H1'         1.916    3.558    25.000   25.000 1000.000 !  2.737  0.30/0.30:      
1:PUR_4B:H2'       1:A_5B:H8            1.966    3.651    25.000   25.000 1000.000 !  2.808  0.30/0.30:      
1:A_5B:H2          1:A_5B:H2'           3.021    5.611    25.000   25.000 1000.000 !  4.316  0.30/0.30:      
1:A_5B:H2          1:G_6B:H1'           2.168    4.026    25.000   25.000 1000.000 !  3.097  0.30/0.30:            
1:A_5B:H8          1:PUR_4B:H1'         2.978    5.530    25.000   25.000 1000.000 !  4.254  0.30/0.30:      
1:A_5B:H8          1:G_6B:H8            2.672    4.961    25.000   25.000 1000.000 !  3.816  0.30/0.30:          
1:A_5B:H1'         1:A_5B:H8            2.682    4.981    25.000   25.000 1000.000 !  3.832  0.30/0.30:      
1:A_5B:H1'         1:A_5B:H3'           2.253    4.184    25.000   25.000 1000.000 !  3.218  0.30/0.30:      
1:A_5B:H1'         1:A_5B:H4'           2.192    4.070    25.000   25.000 1000.000 !  3.131  0.30/0.30:           
1:A_5B:H2'         1:A_5B:H8            2.685    4.986    25.000   25.000 1000.000 !  3.835  0.30/0.30:      
1:A_5B:H2'         1:A_5B:H1'           1.966    3.651    25.000   25.000 1000.000 !  2.809  0.30/0.30:          
1:A_5B:H3'         1:A_5B:H8            2.266    4.209    25.000   25.000 1000.000 !  3.237  0.30/0.30:      
1:A_5B:H3'         1:A_5B:H2'           1.917    3.560    25.000   25.000 1000.000 !  2.738  0.30/0.30:      
1:A_5B:H3'         1:G_6B:H8            1.817    3.375    25.000   25.000 1000.000 !  2.596  0.30/0.30:            
1:G_6B:H8          1:A_5B:H2'           1.944    3.611    25.000   25.000 1000.000 !  2.778  0.30/0.30:      
1:G_6B:H8          1:G_6B:H2'           2.734    5.078    25.000   25.000 1000.000 !  3.906  0.30/0.30:      
1:G_6B:H8          1:G_6B:H3'           1.734    3.221    25.000   25.000 1000.000 !  2.478  0.30/0.30:      
1:G_6B:H8          1:G_6B:H4'           2.538    4.714    25.000   25.000 1000.000 !  3.626  0.30/0.30:      
1:G_6B:H8          1:C_7B:H5            2.809    5.216    25.000   25.000 1000.000 !  4.012  0.30/0.30:      
1:G_6B:H1'         1:A_5B:H2'           2.059    3.824    25.000   25.000 1000.000 !  2.941  0.30/0.30:      
1:G_6B:H1'         1:G_6B:H8            2.415    4.484    25.000   25.000 1000.000 !  3.449  0.30/0.30:      
1:G_6B:H2'         1:C_7B:H5            2.309    4.289    25.000   25.000 1000.000 !  3.299  0.30/0.30:      
1:G_6B:H2'         1:C_7B:H6            1.668    3.098    25.000   25.000 1000.000 !  2.383  0.30/0.30:      
1:G_6B:H2'         1:C_7B:H1'           2.975    5.525    25.000   25.000 1000.000 !  4.250  0.30/0.30:        
1:C_7B:H5          1:G_6B:H3'           2.155    4.002    25.000   25.000 1000.000 !  3.079  0.30/0.30:           
1:C_7B:H6          1:C_7B:H5            1.729    3.211    25.000   25.000 1000.000 !  2.470  0.30/0.30:           
1:C_7B:H6          1:C_8B:H5            3.180    5.907    25.000   25.000 1000.000 !  4.544  0.30/0.30:      
1:C_7B:H1'         1:C_7B:H6            2.800    5.200    25.000   25.000 1000.000 !  4.000  0.30/0.30:           
1:C_7B:H1'         1:C_8B:H6            2.962    5.501    25.000   25.000 1000.000 !  4.232  0.30/0.30:      
1:C_7B:H2'         1:C_7B:H1'           1.868    3.469    25.000   25.000 1000.000 !  2.669  0.30/0.30:      
1:C_7B:H2'         1:C_8B:H5            2.404    4.465    25.000   25.000 1000.000 !  3.434  0.30/0.30:      
1:C_7B:H2'         1:C_8B:H6            1.589    2.951    25.000   25.000 1000.000 !  2.270  0.30/0.30:            
1:C_7B:H3'         1:C_7B:H6            1.780    3.306    25.000   25.000 1000.000 !  2.543  0.30/0.30:      
1:C_7B:H3'         1:C_7B:H1'           2.416    4.487    25.000   25.000 1000.000 !  3.452  0.30/0.30:      
1:C_7B:H3'         1:C_8B:H5            3.208    5.957    25.000   25.000 1000.000 !  4.583  0.30/0.30:      
1:C_8B:H5          1:U3'_9B:H5          2.431    4.515    25.000   25.000 1000.000 !  3.473  0.30/0.30:           
1:C_8B:H6          1:C_7B:H3'           1.878    3.487    25.000   25.000 1000.000 !  2.682  0.30/0.30:      
1:C_8B:H6          1:C_8B:H5            1.785    3.315    25.000   25.000 1000.000 !  2.550  0.30/0.30:      
1:C_8B:H6          1:C_8B:H1'           2.501    4.645    25.000   25.000 1000.000 !  3.573  0.30/0.30:           
1:C_8B:H2'         1:C_8B:H6            2.297    4.265    25.000   25.000 1000.000 !  3.281  0.30/0.30:      
1:C_8B:H2'         1:C_8B:H1'           1.821    3.381    25.000   25.000 1000.000 !  2.601  0.30/0.30:      
1:C_8B:H2'         1:U3'_9B:H6          1.834    3.406    25.000   25.000 1000.000 !  2.620  0.30/0.30:      
1:C_8B:H2'         1:U3'_9B:H1'         2.952    5.483    25.000   25.000 1000.000 !  4.218  0.30/0.30:      
1:C_8B:H3'         1:C_8B:H1'           2.427    4.508    25.000   25.000 1000.000 !  3.468  0.30/0.30:      
1:C_8B:H3'         1:U3'_9B:H6          2.430    4.512    25.000   25.000 1000.000 !  3.471  0.30/0.30:      
1:U3'_9B:H6        1:U3'_9B:H5          1.714    3.184    25.000   25.000 1000.000 !  2.449  0.30/0.30:      
1:U3'_9B:H6        1:U3'_9B:H1'         2.816    5.230    25.000   25.000 1000.000 !  4.023  0.30/0.30:           
1:U3'_9B:H1'       1:U3'_9B:H3'         2.064    3.834    25.000   25.000 1000.000 !  2.949  0.30/0.30:      
1:U3'_9B:H2'       1:U3'_9B:H6          2.276    4.227    25.000   25.000 1000.000 !  3.252  0.30/0.30:      
1:U3'_9B:H2'       1:U3'_9B:H1'         2.050    3.807    25.000   25.000 1000.000 !  2.928  0.30/0.30:      
1:U3'_9B:H3'       1:U3'_9B:H5          2.943    5.466    25.000   25.000 1000.000 !  4.205  0.30/0.30:      
1:U3'_9B:H3'       1:U3'_9B:H6          2.143    3.981    25.000   25.000 1000.000 !  3.062  0.30/0.30:      
!
!**********************************************
!cross-strand
1:PUR_4:H2        1:PUR_4B:H2'        2.844    5.281      25.000   25.000 1000.000 !  4.063  0.30/0.30:      
1:PUR_4B:H2       1:PUR_4:H2'         2.844    5.281      25.000   25.000 1000.000 !  4.063  0.30/0.30:
1:A_5:H8          1:PUR_4B:H2         3.048    5.661      25.000   25.000 1000.000 !  4.355  0.30/0.30: 
1:A_5B:H8         1:PUR_4:H2          3.048    5.661      25.000   25.000 1000.000 !  4.355  0.30/0.30: 
1:A_5:H1'         1:A_5B:H2           2.275    4.224      25.000   25.000 1000.000 !  3.249  0.30/0.30: 
1:A_5B:H1'        1:A_5:H2            2.275    4.224      25.000   25.000 1000.000 !  3.249  0.30/0.30:
!**********************************************
!
!  DIHEDRAL RESTRAINTS
!**********************************************
!
! (From Mark who got them from Chen)
!
#NMR_dihedral
!alpha    P-O5'; first strand
!
1:G5'_1:O3'        1:G_2:P            1:G_2:O5'          1:G_2:C5'          -150.000 150.000 50.00 50.00 1000.000
1:G_2:O3'          1:C_3:P            1:C_3:O5'          1:C_3:C5'          -150.000 150.000 50.00 50.00 1000.000
1:C_3:O3'          1:PUR_4:P          1:PUR_4:O5'        1:PUR_4:C5'        -150.000 150.000 50.00 50.00 1000.000
1:PUR_4:O3'        1:A_5:P            1:A_5:O5'          1:A_5:C5'          -150.000 150.000 50.00 50.00 1000.000
1:A_5:O3'          1:G_6:P            1:G_6:O5'          1:G_6:C5'          -150.000 150.000 50.00 50.00 1000.000
1:G_6:O3'          1:C_7:P            1:C_7:O5'          1:C_7:C5'          -150.000 150.000 50.00 50.00 1000.000
1:C_7:O3'          1:C_8:P            1:C_8:O5'          1:C_8:C5'          -150.000 150.000 50.00 50.00 1000.000
1:C_8:O3'          1:U3'_9:P          1:U3'_9:O5'        1:U3'_9:C5'        -150.000 150.000 50.00 50.00 1000.000
!
!alpha     P-O5'; second strand
!
1:G5'_1B:O3'       1:G_2B:P           1:G_2B:O5'         1:G_2B:C5'         -150.000 150.000 50.00 50.00 1000.000
1:G_2B:O3'         1:C_3B:P           1:C_3B:O5'         1:C_3B:C5'         -150.000 150.000 50.00 50.00 1000.000
1:C_3B:O3'         1:PUR_4B:P         1:PUR_4B:O5'       1:PUR_4B:C5'       -150.000 150.000 50.00 50.00 1000.000
1:PUR_4B:O3'       1:A_5B:P           1:A_5B:O5'         1:A_5B:C5'         -150.000 150.000 50.00 50.00 1000.000
1:A_5B:O3'         1:G_6B:P           1:G_6B:O5'         1:G_6B:C5'         -150.000 150.000 50.00 50.00 1000.000
1:G_6B:O3'         1:C_7B:P           1:C_7B:O5'         1:C_7B:C5'         -150.000 150.000 50.00 50.00 1000.000
1:C_7B:O3'         1:C_8B:P           1:C_8B:O5'         1:C_8B:C5'         -150.000 150.000 50.00 50.00 1000.000
1:C_8B:O3'         1:U3'_9B:P         1:U3'_9B:O5'       1:U3'_9B:C5'       -150.000 150.000 50.00 50.00 1000.000
!
!beta      O5'-C5'; first strand
!
! **********Does not include restraints for A4 & A5**********
!
1:G_2:P            1:G_2:O5'          1:G_2:C5'          1:G_2:C4'          150.000 -150.000 50.00 50.00 1000.000
1:C_3:P            1:C_3:O5'          1:C_3:C5'          1:C_3:C4'          150.000 -150.000 50.00 50.00 1000.000
1:G_6:P            1:G_6:O5'          1:G_6:C5'          1:G_6:C4'          150.000 -150.000 50.00 50.00 1000.000
1:C_7:P            1:C_7:O5'          1:C_7:C5'          1:C_7:C4'          150.000 -150.000 50.00 50.00 1000.000
1:C_8:P            1:C_8:O5'          1:C_8:C5'          1:C_8:C4'          150.000 -150.000 50.00 50.00 1000.000
1:U3'_9:P          1:U3'_9:O5'        1:U3'_9:C5'        1:U3'_9:C4'        150.000 -150.000 50.00 50.00 1000.000
!
!beta      O5'-C5'; second strand
!
1:G_2B:P           1:G_2B:O5'         1:G_2B:C5'         1:G_2B:C4'         150.000 -150.000 50.00 50.00 1000.000
1:C_3B:P           1:C_3B:O5'         1:C_3B:C5'         1:C_3B:C4'         150.000 -150.000 50.00 50.00 1000.000
1:G_6B:P           1:G_6B:O5'         1:G_6B:C5'         1:G_6B:C4'         150.000 -150.000 50.00 50.00 1000.000
1:C_7B:P           1:C_7B:O5'         1:C_7B:C5'         1:C_7B:C4'         150.000 -150.000 50.00 50.00 1000.000
1:C_8B:P           1:C_8B:O5'         1:C_8B:C5'         1:C_8B:C4'         150.000 -150.000 50.00 50.00 1000.000
1:U3'_9B:P         1:U3'_9B:O5'       1:U3'_9B:C5'       1:U3'_9B:C4'       150.000 -150.000 50.00 50.00 1000.000
!
!gamma     C5'-C4'; first strand
!
! **********Does not include restraints for A4 & A5**********
!
1:G5'_1:O5'        1:G5'_1:C5'        1:G5'_1:C4'        1:G5'_1:C3'        30.000 90.000 50.00 50.00 1000.000
1:G_2:O5'          1:G_2:C5'          1:G_2:C4'          1:G_2:C3'          30.000 90.000 50.00 50.00 1000.000
1:C_3:O5'          1:C_3:C5'          1:C_3:C4'          1:C_3:C3'          30.000 90.000 50.00 50.00 1000.000
1:G_6:O5'          1:G_6:C5'          1:G_6:C4'          1:G_6:C3'          30.000 90.000 50.00 50.00 1000.000
1:C_7:O5'          1:C_7:C5'          1:C_7:C4'          1:C_7:C3'          30.000 90.000 50.00 50.00 1000.000
1:C_8:O5'          1:C_8:C5'          1:C_8:C4'          1:C_8:C3'          30.000 90.000 50.00 50.00 1000.000
1:U3'_9:O5'        1:U3'_9:C5'        1:U3'_9:C4'        1:U3'_9:C3'        30.000 90.000 50.00 50.00 1000.000
!
!gamma     C5'-C4'; second strand
!
1:G5'_1B:O5'       1:G5'_1B:C5'       1:G5'_1B:C4'       1:G5'_1B:C3'       30.000 90.000 50.00 50.00 1000.000
1:G_2B:O5'         1:G_2B:C5'         1:G_2B:C4'         1:G_2B:C3'         30.000 90.000 50.00 50.00 1000.000
1:C_3B:O5'         1:C_3B:C5'         1:C_3B:C4'         1:C_3B:C3'         30.000 90.000 50.00 50.00 1000.000
1:G_6B:O5'         1:G_6B:C5'         1:G_6B:C4'         1:G_6B:C3'         30.000 90.000 50.00 50.00 1000.000
1:C_7B:O5'         1:C_7B:C5'         1:C_7B:C4'         1:C_7B:C3'         30.000 90.000 50.00 50.00 1000.000
1:C_8B:O5'         1:C_8B:C5'         1:C_8B:C4'         1:C_8B:C3'         30.000 90.000 50.00 50.00 1000.000
1:U3'_9B:O5'       1:U3'_9B:C5'       1:U3'_9B:C4'       1:U3'_9B:C3'       30.000 90.000 50.00 50.00 1000.000
!
!delta     C4'-C3'; first strand
!
! **********Does not include restraints for A4 & A5**********
!
1:G5'_1:C5'        1:G5'_1:C4'        1:G5'_1:C3'        1:G5'_1:O3'        70.000 110.000 50.00 50.00 1000.000
1:G_2:C5'          1:G_2:C4'          1:G_2:C3'          1:G_2:O3'          70.000 110.000 50.00 50.00 1000.000
1:C_3:C5'          1:C_3:C4'          1:C_3:C3'          1:C_3:O3'          70.000 110.000 50.00 50.00 1000.000
1:G_6:C5'          1:G_6:C4'          1:G_6:C3'          1:G_6:O3'          70.000 110.000 50.00 50.00 1000.000
1:C_7:C5'          1:C_7:C4'          1:C_7:C3'          1:C_7:O3'          70.000 110.000 50.00 50.00 1000.000
1:C_8:C5'          1:C_8:C4'          1:C_8:C3'          1:C_8:O3'          70.000 110.000 50.00 50.00 1000.000
1:U3'_9:C5'        1:U3'_9:C4'        1:U3'_9:C3'        1:U3'_9:O3'        70.000 110.000 50.00 50.00 1000.000
!
!delta     C4'-C3'; second strand
!
1:G5'_1B:C5'       1:G5'_1B:C4'       1:G5'_1B:C3'       1:G5'_1B:O3'       70.000 110.000 50.00 50.00 1000.000
1:G_2B:C5'         1:G_2B:C4'         1:G_2B:C3'         1:G_2B:O3'         70.000 110.000 50.00 50.00 1000.000
1:C_3B:C5'         1:C_3B:C4'         1:C_3B:C3'         1:C_3B:O3'         70.000 110.000 50.00 50.00 1000.000
1:G_6B:C5'         1:G_6B:C4'         1:G_6B:C3'         1:G_6B:O3'         70.000 110.000 50.00 50.00 1000.000
1:C_7B:C5'         1:C_7B:C4'         1:C_7B:C3'         1:C_7B:O3'         70.000 110.000 50.00 50.00 1000.000
1:C_8B:C5'         1:C_8B:C4'         1:C_8B:C3'         1:C_8B:O3'         70.000 110.000 50.00 50.00 1000.000
1:U3'_9B:C5'       1:U3'_9B:C4'       1:U3'_9B:C3'       1:U3'_9B:O3'       70.000 110.000 50.00 50.00 1000.000
!
!epsilon   C3'-O3'; first strand
!
! **********Does not include restraints for A4 & A5**********
!
1:G5'_1:C4'        1:G5'_1:C3'        1:G5'_1:O3'        1:G_2:P            -170.000 -100.000 50.00 50.00 1000.000
1:G_2:C4'          1:G_2:C3'          1:G_2:O3'          1:C_3:P            -170.000 -100.000 50.00 50.00 1000.000
1:C_3:C4'          1:C_3:C3'          1:C_3:O3'          1:PUR_4:P          -170.000 -100.000 50.00 50.00 1000.000
1:G_6:C4'          1:G_6:C3'          1:G_6:O3'          1:C_7:P            -170.000 -100.000 50.00 50.00 1000.000
1:C_7:C4'          1:C_7:C3'          1:C_7:O3'          1:C_8:P            -170.000 -100.000 50.00 50.00 1000.000
1:C_8:C4'          1:C_8:C3'          1:C_8:O3'          1:U3'_9:P          -170.000 -100.000 50.00 50.00 1000.000  
!
!epsilon   C3'-O3'; second strand
!
1:G5'_1B:C4'       1:G5'_1B:C3'       1:G5'_1B:O3'       1:G_2B:P           -170.000 -100.000 50.00 50.00 1000.000
1:G_2B:C4'         1:G_2B:C3'         1:G_2B:O3'         1:C_3B:P           -170.000 -100.000 50.00 50.00 1000.000
1:C_3B:C4'         1:C_3B:C3'         1:C_3B:O3'         1:PUR_4B:P         -170.000 -100.000 50.00 50.00 1000.000
1:G_6B:C4'         1:G_6B:C3'         1:G_6B:O3'         1:C_7B:P           -170.000 -100.000 50.00 50.00 1000.000
1:C_7B:C4'         1:C_7B:C3'         1:C_7B:O3'         1:C_8B:P           -170.000 -100.000 50.00 50.00 1000.000
1:C_8B:C4'         1:C_8B:C3'         1:C_8B:O3'         1:U3'_9B:P         -170.000 -100.000 50.00 50.00 1000.000   
!
!zeta      O3'-P; first strand
!
! **********Does not include restraints for A4 & A5**********
!
1:G5'_1:C3'        1:G5'_1:O3'        1:G_2:P            1:G_2:O5'          -150.000 150.000 50.00 50.00 1000.000
1:G_2:C3'          1:G_2:O3'          1:C_3:P            1:C_3:O5'          -150.000 150.000 50.00 50.00 1000.000
1:G_6:C3'          1:G_6:O3'          1:C_7:P            1:C_7:O5'          -150.000 150.000 50.00 50.00 1000.000
1:C_7:C3'          1:C_7:O3'          1:C_8:P            1:C_8:O5'          -150.000 150.000 50.00 50.00 1000.000
1:C_8:C3'          1:C_8:O3'          1:U3'_9:P          1:U3'_9:O5'        -150.000 150.000 50.00 50.00 1000.000
!
!zeta       O3'-P; second strand
!
1:G5'_1B:C3'       1:G5'_1B:O3'       1:G_2B:P           1:G_2B:O5'         -150.000 150.000 50.00 50.00 1000.000
1:G_2B:C3'         1:G_2B:O3'         1:C_3B:P           1:C_3B:O5'         -150.000 150.000 50.00 50.00 1000.000
1:G_6B:C3'         1:G_6B:O3'         1:C_7B:P           1:C_7B:O5'         -150.000 150.000 50.00 50.00 1000.000
1:C_7B:C3'         1:C_7B:O3'         1:C_8B:P           1:C_8B:O5'         -150.000 150.000 50.00 50.00 1000.000
1:C_8B:C3'         1:C_8B:O3'         1:U3'_9B:P         1:U3'_9B:O5'       -150.000 150.000 50.00 50.00 1000.000
!
!chi        Glycosidic torsions; strand 1
!
! **********Does not include restraints for A4 & A5**********
!
1:G5'_1:O4'        1:G5'_1:C1'        1:G5'_1:N9         1:G5'_1:C4         150.000 -150.000 50.00 50.00 1000.000
1:G_2:O4'          1:G_2:C1'          1:G_2:N9           1:G_2:C4           150.000 -150.000 50.00 50.00 1000.000
1:C_3:O4'          1:C_3:C1'          1:C_3:N1           1:C_3:C2           150.000 -150.000 50.00 50.00 1000.000
1:G_6:O4'          1:G_6:C1'          1:G_6:N9           1:G_6:C4           150.000 -150.000 50.00 50.00 1000.000
1:C_7:O4'          1:C_7:C1'          1:C_7:N1           1:C_7:C2           150.000 -150.000 50.00 50.00 1000.000
1:C_8:O4'          1:C_8:C1'          1:C_8:N1           1:C_8:C2           150.000 -150.000 50.00 50.00 1000.000
1:U3'_9:O4'        1:U3'_9:C1'        1:U3'_9:N1         1:U3'_9:C2         150.000 -150.000 50.00 50.00 1000.000
!
!chi         Glycosidic torsions; strand 2
!
1:G5'_1B:O4'       1:G5'_1B:C1'       1:G5'_1B:N9        1:G5'_1B:C4        150.000 -150.000 50.00 50.00 1000.000
1:G_2B:O4'         1:G_2B:C1'         1:G_2B:N9          1:G_2B:C4          150.000 -150.000 50.00 50.00 1000.000
1:C_3B:O4'         1:C_3B:C1'         1:C_3B:N1          1:C_3B:C2          150.000 -150.000 50.00 50.00 1000.000
1:G_6B:O4'         1:G_6B:C1'         1:G_6B:N9          1:G_6B:C4          150.000 -150.000 50.00 50.00 1000.000
1:C_7B:O4'         1:C_7B:C1'         1:C_7B:N1          1:C_7B:C2          150.000 -150.000 50.00 50.00 1000.000
1:C_8B:O4'         1:C_8B:C1'         1:C_8B:N1          1:C_8B:C2          150.000 -150.000 50.00 50.00 1000.000
1:U3'_9B:O4'       1:U3'_9B:C1'       1:U3'_9B:N1        1:U3'_9B:C2        150.000 -150.000 50.00 50.00 1000.000

  Entry H atom name         Submitted Coord H atom name
    1   1H5*    G   1          1H5'        G   1  12.294  -0.827   6.572
    2   2H5*    G   1          2H5'        G   1  12.172  -0.667   8.331
    3    H4*    G   1           H4'        G   1  12.214   1.536   7.347
    4    H3*    G   1           H3'        G   1   9.433   0.795   8.302
    5    H2*    G   1           H2'        G   1   8.839   3.094   7.854
    6   2HO*    G   1          HO2'        G   1  11.034   3.868   8.515
    7    H1*    G   1           H1'        G   1   9.958   3.079   5.373
    8    H8     G   1           H8         G   1   8.816  -0.454   5.578
    9    H1     G   1           H1         G   1   3.847   3.612   5.182
   10   1H2     G   1          1H2         G   1   6.277   6.053   5.768
   11   2H2     G   1          2H2         G   1   4.566   5.710   5.506
   12    H5T    G   1           H5'        G   1  10.019  -1.248   8.219
   13   1H5*    G   2          1H5'        G   2  10.331   4.497  10.151
   14   2H5*    G   2          2H5'        G   2   9.818   4.493  11.847
   15    H4*    G   2           H4'        G   2   8.833   6.365  10.537
   16    H3*    G   2           H3'        G   2   6.926   4.278  11.623
   17    H2*    G   2           H2'        G   2   5.144   5.749  10.916
   18   2HO*    G   2          HO2'        G   2   6.436   7.709  11.472
   19    H1*    G   2           H1'        G   2   6.223   6.203   8.454
   20    H8     G   2           H8         G   2   7.050   2.589   9.129
   21    H1     G   2           H1         G   2   0.823   3.568   7.833
   22   1H2     G   2          1H2         G   2   1.639   6.918   8.400
   23   2H2     G   2          2H2         G   2   0.351   5.761   8.062
   24   1H5*    C   3          1H5'        C   3   5.468   8.082  12.998
   25   2H5*    C   3          2H5'        C   3   4.884   7.950  14.665
   26    H4*    C   3           H4'        C   3   3.160   8.789  13.059
   27    H3*    C   3           H3'        C   3   2.634   6.156  14.460
   28    H2*    C   3           H2'        C   3   0.418   6.267  13.515
   29   2HO*    C   3          HO2'        C   3   0.471   8.700  13.811
   30    H1*    C   3           H1'        C   3   1.269   7.045  11.025
   31   1H4     C   3          1H4         C   3   2.225   0.511  11.039
   32   2H4     C   3          2H4         C   3   0.539   0.803  10.610
   33    H5     C   3           H5         C   3   3.674   2.357  11.878
   34    H6     C   3           H6         C   3   3.765   4.728  12.285
   35    H2   P5P   4           H2         P   4  -3.241  -0.160  12.751
   36    H6   P5P   4           H6         P   4   0.762  -0.107  13.743
   37    H8   P5P   4           H8         P   4   0.285   4.671  15.116
   38    H1'  P5P   4           H1'        P   4  -3.119   4.489  13.383
   39    H2'  P5P   4           H2'        P   4  -3.455   3.596  15.936
   40    H3'  P5P   4           H3'        P   4  -1.817   5.100  16.880
   41    H4'  P5P   4           H4'        P   4  -3.137   7.287  15.253
   42   1H5'  P5P   4          1H5'        P   4  -0.917   8.298  15.187
   43   2H5'  P5P   4          2H5'        P   4  -1.429   8.037  16.863
   44   'HO2  P5P   4          HO2'        P   4  -5.198   5.226  15.973
   45   1H5*    A   5          1H5'        A   5  -6.169   6.777  17.190
   46   2H5*    A   5          2H5'        A   5  -6.735   6.550  18.854
   47    H4*    A   5           H4'        A   5  -8.585   6.402  17.225
   48    H3*    A   5           H3'        A   5  -7.893   3.858  18.711
   49    H2*    A   5           H2'        A   5  -9.830   2.855  17.714
   50   2HO*    A   5          HO2'        A   5 -11.019   4.973  17.823
   51    H1*    A   5           H1'        A   5  -9.223   3.679  15.204
   52    H8     A   5           H8         A   5  -5.784   3.216  16.483
   53   1H6     A   5          1H6         A   5  -6.548  -2.861  15.861
   54   2H6     A   5          2H6         A   5  -5.403  -1.552  16.155
   55    H2     A   5           H2         A   5 -10.578  -0.981  15.649
   56   1H5*    G   6          1H5'        G   6 -10.956   3.143  19.938
   57   2H5*    G   6          2H5'        G   6 -11.065   2.721  21.658
   58    H4*    G   6           H4'        G   6 -11.155   0.744  20.125
   59    H3*    G   6           H3'        G   6  -8.754   0.913  21.965
   60    H2*    G   6           H2'        G   6  -8.202  -1.320  21.184
   61   2HO*    G   6          HO2'        G   6 -10.587  -1.850  21.000
   62    H1*    G   6           H1'        G   6  -8.558  -0.688  18.557
   63    H8     G   6           H8         G   6  -7.142   2.458  20.098
   64    H1     G   6           H1         G   6  -2.761  -2.213  19.603
   65   1H2     G   6          1H2         G   6  -5.524  -4.219  18.862
   66   2H2     G   6          2H2         G   6  -3.780  -4.150  19.128
   67   1H5*    C   7          1H5'        C   7 -10.295  -2.982  22.511
   68   2H5*    C   7          2H5'        C   7 -10.303  -3.430  24.224
   69    H4*    C   7           H4'        C   7  -9.023  -5.027  22.822
   70    H3*    C   7           H3'        C   7  -7.416  -3.426  24.831
   71    H2*    C   7           H2'        C   7  -5.598  -4.943  24.307
   72   2HO*    C   7          HO2'        C   7  -7.088  -6.801  24.029
   73    H1*    C   7           H1'        C   7  -5.982  -4.740  21.606
   74   1H4     C   7          1H4         C   7  -2.827   0.818  23.374
   75   2H4     C   7          2H4         C   7  -1.601  -0.433  23.188
   76    H5     C   7           H5         C   7  -5.241   0.278  23.329
   77    H6     C   7           H6         C   7  -6.843  -1.484  22.956
   78   1H5*    C   8          1H5'        C   8  -6.732  -7.631  25.647
   79   2H5*    C   8          2H5'        C   8  -6.597  -7.910  27.391
   80    H4*    C   8           H4'        C   8  -4.605  -8.698  26.118
   81    H3*    C   8           H3'        C   8  -4.158  -6.405  28.053
   82    H2*    C   8           H2'        C   8  -1.804  -6.743  27.645
   83   2HO*    C   8          HO2'        C   8  -2.217  -9.163  27.441
   84    H1*    C   8           H1'        C   8  -2.108  -6.967  24.926
   85   1H4     C   8          1H4         C   8  -2.216  -0.472  26.237
   86   2H4     C   8          2H4         C   8  -0.534  -0.964  26.037
   87    H5     C   8           H5         C   8  -4.044  -2.159  26.301
   88    H6     C   8           H6         C   8  -4.529  -4.520  26.139
   89   1H5*    U   9          1H5'        U   9  -1.100  -9.008  29.149
   90   2H5*    U   9          2H5'        U   9  -0.997  -9.108  30.915
   91    H4*    U   9           H4'        U   9   1.115  -8.297  29.906
   92    H3*    U   9           H3'        U   9  -0.407  -6.285  31.601
   93    H2*    U   9           H2'        U   9   1.488  -4.850  31.387
   94   2HO*    U   9          HO2'        U   9   3.440  -5.594  30.449
   95    H1*    U   9           H1'        U   9   1.893  -5.419  28.687
   96    H3     U   9           H3         U   9   0.631  -1.033  29.056
   97    H5     U   9           H5         U   9  -2.952  -3.183  29.492
   98    H6     U   9           H6         U   9  -1.677  -5.237  29.480
   99    H3T    U   9          HO3'        U   9   2.000  -7.583  32.215
  100   1H5*    G   1          1H5'        G   1   9.975   0.255  26.400
  101   2H5*    G   1          2H5'        G   1  10.229   0.054  24.660
  102    H4*    G   1           H4'        G   1   9.890  -2.119  25.638
  103    H3*    G   1           H3'        G   1   7.451  -1.185  24.102
  104    H2*    G   1           H2'        G   1   6.544  -3.389  24.450
  105   2HO*    G   1          HO2'        G   1   8.748  -4.387  24.285
  106    H1*    G   1           H1'        G   1   7.104  -3.412  27.109
  107    H8     G   1           H8         G   1   6.420   0.213  26.658
  108    H1     G   1           H1         G   1   1.074  -3.300  25.976
  109   1H2     G   1          1H2         G   1   3.295  -5.996  25.940
  110   2H2     G   1          2H2         G   1   1.615  -5.469  25.826
  111    H5T    G   1           H5'        G   1   8.161   0.799  24.284
  112   1H5*    G   2          1H5'        G   2   8.342  -5.009  22.540
  113   2H5*    G   2          2H5'        G   2   8.217  -5.011  20.772
  114    H4*    G   2           H4'        G   2   6.775  -6.728  21.849
  115    H3*    G   2           H3'        G   2   5.385  -4.493  20.352
  116    H2*    G   2           H2'        G   2   3.343  -5.748  20.663
  117   2HO*    G   2          HO2'        G   2   4.511  -7.847  20.421
  118    H1*    G   2           H1'        G   2   3.808  -6.235  23.305
  119    H8     G   2           H8         G   2   5.141  -2.746  22.806
  120    H1     G   2           H1         G   2  -1.287  -3.047  22.738
  121   1H2     G   2          1H2         G   2  -0.726  -6.477  22.359
  122   2H2     G   2          2H2         G   2  -1.926  -5.185  22.414
  123   1H5*    C   3          1H5'        C   3   3.846  -8.161  18.720
  124   2H5*    C   3          2H5'        C   3   3.673  -8.020  16.962
  125    H4*    C   3           H4'        C   3   1.546  -8.613  18.122
  126    H3*    C   3           H3'        C   3   1.660  -5.965  16.655
  127    H2*    C   3           H2'        C   3  -0.709  -5.800  17.069
  128   2HO*    C   3          HO2'        C   3  -0.875  -8.228  16.771
  129    H1*    C   3           H1'        C   3  -0.544  -6.632  19.680
  130   1H4     C   3          1H4         C   3   1.126  -0.242  19.913
  131   2H4     C   3          2H4         C   3  -0.635  -0.341  19.971
  132    H5     C   3           H5         C   3   2.504  -2.250  19.386
  133    H6     C   3           H6         C   3   2.415  -4.626  19.002
  134    H2   P5P   4           H2         P   4  -3.690   1.000  17.059
  135    H6   P5P   4           H6         P   4   0.402   0.488  16.975
  136    H8   P5P   4           H8         P   4  -0.292  -4.229  15.484
  137    H1'  P5P   4           H1'        P   4  -3.958  -3.635  16.407
  138    H2'  P5P   4           H2'        P   4  -3.596  -2.753  13.853
  139    H3'  P5P   4           H3'        P   4  -1.971  -4.452  13.294
  140    H4'  P5P   4           H4'        P   4  -3.872  -6.444  14.558
  141   1H5'  P5P   4          1H5'        P   4  -1.857  -7.702  15.118
  142   2H5'  P5P   4          2H5'        P   4  -1.940  -7.412  13.373
  143   'HO2  P5P   4          HO2'        P   4  -5.462  -4.171  13.403
  144   1H5*    A   5          1H5'        A   5  -6.305  -5.616  11.972
  145   2H5*    A   5          2H5'        A   5  -6.446  -5.345  10.225
  146    H4*    A   5           H4'        A   5  -8.587  -4.954  11.397
  147    H3*    A   5           H3'        A   5  -7.274  -2.540  10.131
  148    H2*    A   5           H2'        A   5  -9.244  -1.290  10.676
  149   2HO*    A   5          HO2'        A   5 -10.630  -3.248  10.278
  150    H1*    A   5           H1'        A   5  -9.331  -2.140  13.249
  151    H8     A   5           H8         A   5  -5.662  -2.113  12.793
  152   1H6     A   5          1H6         A   5  -5.814   4.019  13.317
  153   2H6     A   5          2H6         A   5  -4.798   2.579  13.272
  154    H2     A   5           H2         A   5  -9.980   2.640  12.558
  155   1H5*    G   6          1H5'        G   6  -9.883  -1.454   8.278
  156   2H5*    G   6          2H5'        G   6  -9.556  -1.053   6.580
  157    H4*    G   6           H4'        G   6  -9.724   0.957   8.069
  158    H3*    G   6           H3'        G   6  -7.016   0.424   6.828
  159    H2*    G   6           H2'        G   6  -6.349   2.567   7.713
  160   2HO*    G   6          HO2'        G   6  -7.784   3.938   8.745
  161    H1*    G   6           H1'        G   6  -7.387   2.054  10.196
  162    H8     G   6           H8         G   6  -6.050  -1.260   8.972
  163    H1     G   6           H1         G   6  -1.386   2.878  10.528
  164   1H2     G   6          1H2         G   6  -3.998   5.195  10.668
  165   2H2     G   6          2H2         G   6  -2.260   4.922  10.801
  166   1H5*    C   7          1H5'        C   7  -7.970   4.433   6.011
  167   2H5*    C   7          2H5'        C   7  -7.541   4.906   4.361
  168    H4*    C   7           H4'        C   7  -6.484   6.361   6.069
  169    H3*    C   7           H3'        C   7  -4.607   4.638   4.428
  170    H2*    C   7           H2'        C   7  -2.826   5.964   5.401
  171   2HO*    C   7          HO2'        C   7  -4.181   7.950   5.399
  172    H1*    C   7           H1'        C   7  -3.829   5.764   7.935
  173   1H4     C   7          1H4         C   7  -0.923  -0.075   6.765
  174   2H4     C   7          2H4         C   7   0.347   1.035   7.269
  175    H5     C   7           H5         C   7  -3.208   0.716   6.259
  176    H6     C   7           H6         C   7  -4.666   2.631   6.301
  177   1H5*    C   8          1H5'        C   8  -3.346   8.745   3.928
  178   2H5*    C   8          2H5'        C   8  -2.798   9.027   2.266
  179    H4*    C   8           H4'        C   8  -1.069   9.585   3.967
  180    H3*    C   8           H3'        C   8  -0.439   7.265   2.117
  181    H2*    C   8           H2'        C   8   1.788   7.354   3.045
  182   2HO*    C   8          HO2'        C   8   1.586   9.803   3.223
  183    H1*    C   8           H1'        C   8   0.907   7.588   5.632
  184   1H4     C   8          1H4         C   8   0.415   1.152   4.136
  185   2H4     C   8          2H4         C   8   2.054   1.457   4.711
  186    H5     C   8           H5         C   8  -1.169   3.027   3.727
  187    H6     C   8           H6         C   8  -1.428   5.425   3.847
  188   1H5*    U   9          1H5'        U   9   3.027   9.534   1.796
  189   2H5*    U   9          2H5'        U   9   3.536   9.632   0.103
  190    H4*    U   9           H4'        U   9   5.276   8.611   1.533
  191    H3*    U   9           H3'        U   9   3.992   6.795  -0.532
  192    H2*    U   9           H2'        U   9   5.596   5.137   0.059
  193   2HO*    U   9          HO2'        U   9   7.360   5.624   1.435
  194    H1*    U   9           H1'        U   9   5.449   5.618   2.797
  195    H3     U   9           H3         U   9   3.802   1.429   1.992
  196    H5     U   9           H5         U   9   0.671   4.004   0.889
  197    H6     U   9           H6         U   9   2.144   5.886   1.251
  198    H3T    U   9          HO3'        U   9   6.608   7.793  -0.508