NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id cing stage position program type
20990 2gvo cing 1-original 2 AMBER dihedral angle


 
 
 # eps 
 &rst iat= 2, 2, 2, 3, atnam= "C4'", "C3'", "O3'", "P", iresid= 1,
    r1 = 130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end
# zeta 
 &rst iat= 2, 2, 3, 3, atnam= "C3'", "O3'", "P", "O5'", iresid= 1,
   r1 =  240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end  
#alpha
 &rst iat= 2, 3, 3, 3, atnam= "O3'", "P", "O5'", "C5'", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 = 50, rk3 =  50,                             &end  
#gamma 
 &rst iat= 3, 3, 3, 3, atnam= "O5'", "C5'", "C4'", "C3'", iresid= 1,
    r1 = 0.0, r2 = 30.0, r3 = 90.0, r4 = 120.0,
    rk2 =  50, rk3 =  50,                             &end
#beta 
 &rst iat= 3, 3, 3, 3, atnam= "P", "O5'", "C5'", "C4'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end    
  
# eps 
 &rst iat= 3, 3, 3, 4, atnam= "C4'", "C3'", "O3'", "P", iresid= 1,
    r1 = 130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end
# zeta 
 &rst iat= 3, 3, 4, 4, atnam= "C3'", "O3'", "P", "O5'", iresid= 1,
   r1 =  240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end    
#alpha
 &rst iat= 3, 4, 4, 4, atnam= "O3'", "P", "O5'", "C5'", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 = 50, rk3 =  50,                             &end  
#gamma 
 &rst iat= 4, 4, 4, 4, atnam= "O5'", "C5'", "C4'", "C3'", iresid= 1,
    r1 = 0.0, r2 = 30.0, r3 = 90.0, r4 = 120.0,
    rk2 =  50, rk3 =  50,                             &end
#beta 
 &rst iat= 4, 4, 4, 4, atnam= "P", "O5'", "C5'", "C4'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end 
  
# eps 
 &rst iat= 4, 4, 4, 5, atnam= "C4'", "C3'", "O3'", "P", iresid= 1,
    r1 = 130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end
# zeta 
 &rst iat= 4, 4, 5, 5, atnam= "C3'", "O3'", "P", "O5'", iresid= 1,
   r1 =  240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end      
#alpha
 &rst iat= 4, 5, 5, 5, atnam= "O3'", "P", "O5'", "C5'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end  
#gamma 
 &rst iat= 5, 5, 5, 5, atnam= "O5'", "C5'", "C4'", "C3'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end
#beta 
 &rst iat= 5, 5, 5, 5, atnam= "P", "O5'", "C5'", "C4'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end 
    
# eps 
 &rst iat= 5, 5, 5, 6, atnam= "C4'", "C3'", "O3'", "P", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end
# zeta 
 &rst iat= 5, 5, 6, 6, atnam= "C3'", "O3'", "P", "O5'", iresid= 1,
   r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end  
#alpha
 &rst iat= 5, 6, 6, 6, atnam= "O3'", "P", "O5'", "C5'", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end 
#beta 
 &rst iat= 6, 6, 6, 6, atnam= "P", "O5'", "C5'", "C4'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end 
#gamma 
 &rst iat= 6, 6, 6, 6, atnam= "O5'", "C5'", "C4'", "C3'", iresid= 1,
    r1 = 0.0, r2 = 30.0, r3 = 90.0, r4 = 120.0,
    rk2 =  50, rk3 = 50,                             &end
  
# eps 
 &rst iat= 6, 6, 6, 7, atnam= "C4'", "C3'", "O3'", "P", iresid= 1,
    r1 = 130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end
# zeta 
 &rst iat= 6, 6, 7, 7, atnam= "C3'", "O3'", "P", "O5'", iresid= 1,
   r1 =  240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end          
#alpha
 &rst iat= 6, 7, 7, 7, atnam= "O3'", "P", "O5'", "C5'", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 = 50, rk3 =  50,                             &end  
#gamma 
 &rst iat= 7, 7, 7, 7, atnam= "O5'", "C5'", "C4'", "C3'", iresid= 1,
    r1 = 0.0, r2 = 30.0, r3 = 90.0, r4 = 120.0,
    rk2 =  80, rk3 =  80,                             &end
#beta 
 &rst iat= 7, 7, 7, 7, atnam= "P", "O5'", "C5'", "C4'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end 
  

#alpha
 &rst iat= 7, 8, 8, 8, atnam= "O3'", "P", "O5'", "C5'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 = 50, rk3 =  50,                             &end  
#gamma 
 &rst iat= 8, 8, 8, 8, atnam= "O5'", "C5'", "C4'", "C3'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end
#beta 
 &rst iat= 8, 8, 8, 8, atnam= "P", "O5'", "C5'", "C4'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end     
    
     # eps 
 &rst iat= 8, 8, 8, 9, atnam= "C4'", "C3'", "O3'", "P", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end
# zeta 
 &rst iat= 8, 8, 9, 9, atnam= "C3'", "O3'", "P", "O5'", iresid= 1,
   r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end  
#beta 
 &rst iat= 9, 9, 9, 9, atnam= "P", "O5'", "C5'", "C4'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end     
       
# eps 
 &rst iat= 9, 9, 9, 10, atnam= "C4'", "C3'", "O3'", "P", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end
# zeta 
 &rst iat= 9, 9, 10, 10, atnam= "C3'", "O3'", "P", "O5'", iresid= 1,
   r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end  

# eps 
 &rst iat= 10, 10, 10, 11, atnam= "C4'", "C3'", "O3'", "P", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end
# zeta 
 &rst iat= 10, 10, 11, 11, atnam= "C3'", "O3'", "P", "O5'", iresid= 1,
   r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end  

# eps 
 &rst iat= 11, 11, 11, 12, atnam= "C4'", "C3'", "O3'", "P", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end
# zeta 
 &rst iat= 11, 11, 12, 12, atnam= "C3'", "O3'", "P", "O5'", iresid= 1,
   r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end  
 #gamma 
 &rst iat= 12,12, 12, 12, atnam= "O5'", "C5'", "C4'", "C3'", iresid= 1,
    r1 = 0.0, r2 = 30.0, r3 = 90.0, r4 = 120.0,
    rk2 =  50, rk3 =  50,                             &end
       
# eps 
 &rst iat= 12, 12, 12, 13, atnam= "C4'", "C3'", "O3'", "P", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end
# zeta 
 &rst iat= 12, 12, 13, 13, atnam= "C3'", "O3'", "P", "O5'", iresid= 1,
   r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end  
#alpha
 &rst iat= 12, 13, 13, 13, atnam= "O3'", "P", "O5'", "C5'", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end  
#gamma 
 &rst iat= 13, 13, 13, 13, atnam= "O5'", "C5'", "C4'", "C3'", iresid= 1,
    r1 = 0.0, r2 = 30.0, r3 = 90.0, r4 = 120.0,
    rk2 = 50, rk3 =  50,                             &end
#beta 
 &rst iat= 13, 13, 13, 13, atnam= "P", "O5'", "C5'", "C4'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end      

# eps 
 &rst iat= 13, 13, 13, 14, atnam= "C4'", "C3'", "O3'", "P", iresid= 1,
    r1 = 130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end
# zeta 
 &rst iat= 13, 13, 14, 14, atnam= "C3'", "O3'", "P", "O5'", iresid= 1,
   r1 =  240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end     
#alpha
 &rst iat= 13, 14, 14, 14, atnam= "O3'", "P", "O5'", "C5'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end  
#gamma 
 &rst iat= 14, 14, 14, 14, atnam= "O5'", "C5'", "C4'", "C3'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 = 50, rk3 =  50,                             &end
#beta 
 &rst iat= 14, 14, 14, 14, atnam= "P", "O5'", "C5'", "C4'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end 
  
# eps 
 &rst iat= 14, 14, 14, 15, atnam= "C4'", "C3'", "O3'", "P", iresid= 1,
    r1 = 130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end
# zeta 
 &rst iat= 14, 14, 15, 15, atnam= "C3'", "O3'", "P", "O5'", iresid= 1,
   r1 =  240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end   
#alpha
 &rst iat= 14, 15, 15, 15, atnam= "O3'", "P", "O5'", "C5'", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 = 50, rk3 =  50,                             &end  
#gamma 
 &rst iat= 15, 15, 15, 15, atnam= "O5'", "C5'", "C4'", "C3'", iresid= 1,
    r1 = 0.0, r2 = 30.0, r3 = 90.0, r4 = 120.0,
    rk2 =  50, rk3 =  50,                             &end
#beta 
 &rst iat= 15, 15, 15, 15, atnam= "P", "O5'", "C5'", "C4'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end        
    
# eps 
 &rst iat= 15, 15, 15, 16, atnam= "C4'", "C3'", "O3'", "P", iresid= 1,
    r1 = 130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end
# zeta 
 &rst iat= 15, 15, 16, 16, atnam= "C3'", "O3'", "P", "O5'", iresid= 1,
   r1 =  240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end     
#alpha
 &rst iat= 15, 16, 16, 16, atnam= "O3'", "P", "O5'", "C5'", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end 
#gamma 
 &rst iat= 16, 16, 16, 16, atnam= "O5'", "C5'", "C4'", "C3'", iresid= 1,
    r1 = 0.0, r2 = 30.0, r3 = 90.0, r4 = 120.0,
    rk2 =  50, rk3 = 50,                             &end   
#beta 
 &rst iat= 16, 16, 16, 16, atnam= "P", "O5'", "C5'", "C4'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end  
       
# eps 
 &rst iat= 16, 16, 16, 17, atnam= "C4'", "C3'", "O3'", "P", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end
# zeta 
 &rst iat= 16, 16, 17, 17, atnam= "C3'", "O3'", "P", "O5'", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 = 50, rk3 =  50,                             &end  
#alpha
 &rst iat= 16, 17, 17, 17, atnam= "O3'", "P", "O5'", "C5'", iresid= 1,
    r1 = 240.0, r2 = 270.0, r3 = 330.0, r4 = 360.0,
    rk2 =  50, rk3 =  50,                             &end 
#gamma 
 &rst iat= 17, 17, 17, 17, atnam= "O5'", "C5'", "C4'", "C3'", iresid= 1,
    r1 = 0.0, r2 = 30.0, r3 = 90.0, r4 = 120.0,
    rk2 =  50, rk3 = 50,                             &end    
#beta 
 &rst iat= 17, 17, 17, 17, atnam= "P", "O5'", "C5'", "C4'", iresid= 1,
    r1 =  130.0, r2 = 150.0, r3 = 210.0, r4 = 230.0,
    rk2 =  50, rk3 =  50,                             &end 

     
       
# 1 GUA NU0:  (1 RG5 C4')-(1 RG5 O4')-(1 RG5 C1')-(1 RG5 C2') -38.1  37.7
 &rst     iat =     6,     8,     9,    28,
   r1 = -39.1, r2 = -38.1, r3 =  37.7, r4 =  38.7,
   rk2 =   100.0, rk3 =   100.0,    &end

# 1 GUA NU1:  (1 RG5 O4')-(1 RG5 C1')-(1 RG5 C2')-(1 RG5 C3') -38.5  27.7
 &rst     iat =     8,     9,    28,    26,
   r1 = -39.5, r2 = -38.5, r3 =  27.7, r4 =  28.7,
 &end

# 1 GUA NU2:  (1 RG5 C1')-(1 RG5 C2')-(1 RG5 C3')-(1 RG5 C4')  -6.7  38.5
 &rst     iat =     9,    28,    26,     6,
   r1 =  -7.7, r2 =  -6.7, r3 =  38.5, r4 =  39.5,
 &end

# 1 GUA NU3:  (1 RG5 C2')-(1 RG5 C3')-(1 RG5 C4')-(1 RG5 O4') -38.5   4.0
 &rst     iat =    28,    26,     6,     8,
   r1 = -39.5, r2 = -38.5, r3 =   4.0, r4 =   5.0,
 &end

# 1 GUA NU4:  (1 RG5 C3')-(1 RG5 C4')-(1 RG5 O4')-(1 RG5 C1') -25.8  38.5
 &rst     iat =    26,     6,     8,     9,
   r1 = -26.8, r2 = -25.8, r3 =  38.5, r4 =  39.5,
 &end

# 2 ADE NU0:  (2 RA C4')-(2 RA O4')-(2 RA C1')-(2 RA C2') -38.1  37.7
 &rst     iat =    40,    42,    43,    61,
   r1 = -39.1, r2 = -38.1, r3 =  37.7, r4 =  38.7,
 &end

# 2 ADE NU1:  (2 RA O4')-(2 RA C1')-(2 RA C2')-(2 RA C3') -38.5  27.7
 &rst     iat =    42,    43,    61,    59,
   r1 = -39.5, r2 = -38.5, r3 =  27.7, r4 =  28.7,
 &end

# 2 ADE NU2:  (2 RA C1')-(2 RA C2')-(2 RA C3')-(2 RA C4')  -6.7  38.5
 &rst     iat =    43,    61,    59,    40,
   r1 =  -7.7, r2 =  -6.7, r3 =  38.5, r4 =  39.5,
 &end

# 2 ADE NU3:  (2 RA C2')-(2 RA C3')-(2 RA C4')-(2 RA O4') -38.5   4.0
 &rst     iat =    61,    59,    40,    42,
   r1 = -39.5, r2 = -38.5, r3 =   4.0, r4 =   5.0,
 &end

# 2 ADE NU4:  (2 RA C3')-(2 RA C4')-(2 RA O4')-(2 RA C1') -25.8  38.5
 &rst     iat =    59,    40,    42,    43,
   r1 = -26.8, r2 = -25.8, r3 =  38.5, r4 =  39.5,
 &end

# 3 GUA NU0:  (3 RG C4')-(3 RG O4')-(3 RG C1')-(3 RG C2') -38.1  37.7
 &rst     iat =    73,    75,    76,    95,
   r1 = -39.1, r2 = -38.1, r3 =  37.7, r4 =  38.7,
 &end

# 3 GUA NU1:  (3 RG O4')-(3 RG C1')-(3 RG C2')-(3 RG C3') -38.5  27.7
 &rst     iat =    75,    76,    95,    93,
   r1 = -39.5, r2 = -38.5, r3 =  27.7, r4 =  28.7,
 &end

# 3 GUA NU2:  (3 RG C1')-(3 RG C2')-(3 RG C3')-(3 RG C4')  -6.7  38.5
 &rst     iat =    76,    95,    93,    73,
   r1 =  -7.7, r2 =  -6.7, r3 =  38.5, r4 =  39.5,
 &end

# 3 GUA NU3:  (3 RG C2')-(3 RG C3')-(3 RG C4')-(3 RG O4') -38.5   4.0
 &rst     iat =    95,    93,    73,    75,
   r1 = -39.5, r2 = -38.5, r3 =   4.0, r4 =   5.0,
 &end

# 3 GUA NU4:  (3 RG C3')-(3 RG C4')-(3 RG O4')-(3 RG C1') -25.8  38.5
 &rst     iat =    93,    73,    75,    76,
   r1 = -26.8, r2 = -25.8, r3 =  38.5, r4 =  39.5,
 &end

# 4 GUA NU0:  (4 RG C4')-(4 RG O4')-(4 RG C1')-(4 RG C2') -38.1  37.7
 &rst     iat =   107,   109,   110,   129,
   r1 = -39.1, r2 = -38.1, r3 =  37.7, r4 =  38.7,
 &end

# 4 GUA NU1:  (4 RG O4')-(4 RG C1')-(4 RG C2')-(4 RG C3') -38.5  27.7
 &rst     iat =   109,   110,   129,   127,
   r1 = -39.5, r2 = -38.5, r3 =  27.7, r4 =  28.7,
 &end

# 4 GUA NU2:  (4 RG C1')-(4 RG C2')-(4 RG C3')-(4 RG C4')  -6.7  38.5
 &rst     iat =   110,   129,   127,   107,
   r1 =  -7.7, r2 =  -6.7, r3 =  38.5, r4 =  39.5,
 &end

# 4 GUA NU3:  (4 RG C2')-(4 RG C3')-(4 RG C4')-(4 RG O4') -38.5   4.0
 &rst     iat =   129,   127,   107,   109,
   r1 = -39.5, r2 = -38.5, r3 =   4.0, r4 =   5.0,
 &end

# 4 GUA NU4:  (4 RG C3')-(4 RG C4')-(4 RG O4')-(4 RG C1') -25.8  38.5
 &rst     iat =   127,   107,   109,   110,
   r1 = -26.8, r2 = -25.8, r3 =  38.5, r4 =  39.5,
 &end

# 5 CYT NU0:  (5 RU C4')-(5 RU O4')-(5 RU C1')-(5 RU C2') -38.5  25.8
 &rst     iat =   141,   143,   144,   159,
   r1 = -39.5, r2 = -38.5, r3 =  25.8, r4 =  26.8,
 &end

# 5 CYT NU1:  (5 RU O4')-(5 RU C1')-(5 RU C2')-(5 RU C3')  -4.0  38.5
 &rst     iat =   143,   144,   159,   157,
   r1 =  -5.0, r2 =  -4.0, r3 =  38.5, r4 =  39.5,
 &end

# 5 CYT NU2:  (5 RU C1')-(5 RU C2')-(5 RU C3')-(5 RU C4') -38.5  -6.7
 &rst     iat =   144,   159,   157,   141,
   r1 = -39.5, r2 = -38.5, r3 =  -6.7, r4 =  -5.7,
 &end

# 5 CYT NU3:  (5 RU C2')-(5 RU C3')-(5 RU C4')-(5 RU O4') -16.9  38.5
 &rst     iat =   159,   157,   141,   143,
   r1 = -17.9, r2 = -16.9, r3 =  38.5, r4 =  39.5,
 &end

# 5 CYT NU4:  (5 RU C3')-(5 RU C4')-(5 RU O4')-(5 RU C1') -37.6  34.0
 &rst     iat =   157,   141,   143,   144,
   r1 = -38.6, r2 = -37.6, r3 =  34.0, r4 =  35.0,
 &end

# 6 CYT NU0:  (6 RC C4')-(6 RC O4')-(6 RC C1')-(6 RC C2') -38.1  37.7
 &rst     iat =   171,   173,   174,   190,
   r1 = -39.1, r2 = -38.1, r3 =  37.7, r4 =  38.7,
 &end

# 6 CYT NU1:  (6 RC O4')-(6 RC C1')-(6 RC C2')-(6 RC C3') -38.5  27.7
 &rst     iat =   173,   174,   190,   188,
   r1 = -39.5, r2 = -38.5, r3 =  27.7, r4 =  28.7,
 &end

# 6 CYT NU2:  (6 RC C1')-(6 RC C2')-(6 RC C3')-(6 RC C4')  -6.7  38.5
 &rst     iat =   174,   190,   188,   171,
   r1 =  -7.7, r2 =  -6.7, r3 =  38.5, r4 =  39.5,
 &end

# 6 CYT NU3:  (6 RC C2')-(6 RC C3')-(6 RC C4')-(6 RC O4') -38.5   4.0
 &rst     iat =   190,   188,   171,   173,
   r1 = -39.5, r2 = -38.5, r3 =   4.0, r4 =   5.0,
 &end

# 6 CYT NU4:  (6 RC C3')-(6 RC C4')-(6 RC O4')-(6 RC C1') -25.8  38.5
 &rst     iat =   188,   171,   173,   174,
   r1 = -26.8, r2 = -25.8, r3 =  38.5, r4 =  39.5,
 &end

# 7 GUA NU0:  (7 RG C4')-(7 RG O4')-(7 RG C1')-(7 RG C2') -38.1  37.7
 &rst     iat =   202,   204,   205,   224,
   r1 = -39.1, r2 = -38.1, r3 =  37.7, r4 =  38.7,
 &end

# 7 GUA NU1:  (7 RG O4')-(7 RG C1')-(7 RG C2')-(7 RG C3') -38.5  27.7
 &rst     iat =   204,   205,   224,   222,
   r1 = -39.5, r2 = -38.5, r3 =  27.7, r4 =  28.7,
 &end

# 7 GUA NU2:  (7 RG C1')-(7 RG C2')-(7 RG C3')-(7 RG C4')  -6.7  38.5
 &rst     iat =   205,   224,   222,   202,
   r1 =  -7.7, r2 =  -6.7, r3 =  38.5, r4 =  39.5,
 &end

# 7 GUA NU3:  (7 RG C2')-(7 RG C3')-(7 RG C4')-(7 RG O4') -38.5   4.0
 &rst     iat =   224,   222,   202,   204,
   r1 = -39.5, r2 = -38.5, r3 =   4.0, r4 =   5.0,
 &end

# 7 GUA NU4:  (7 RG C3')-(7 RG C4')-(7 RG O4')-(7 RG C1') -25.8  38.5
 &rst     iat =   222,   202,   204,   205,
   r1 = -26.8, r2 = -25.8, r3 =  38.5, r4 =  39.5,
 &end

# 8 GUA NU0:  (8 RG C4')-(8 RG O4')-(8 RG C1')-(8 RG C2') -38.5  25.8
 &rst     iat =   236,   238,   239,   258,
   r1 = -39.5, r2 = -38.5, r3 =  25.8, r4 =  26.8,
 &end

# 8 GUA NU1:  (8 RG O4')-(8 RG C1')-(8 RG C2')-(8 RG C3')  -4.0  38.5
 &rst     iat =   238,   239,   258,   256,
   r1 =  -5.0, r2 =  -4.0, r3 =  38.5, r4 =  39.5,
 &end

# 8 GUA NU2:  (8 RG C1')-(8 RG C2')-(8 RG C3')-(8 RG C4') -38.5  -6.7
 &rst     iat =   239,   258,   256,   236,
   r1 = -39.5, r2 = -38.5, r3 =  -6.7, r4 =  -5.7,
 &end

# 8 GUA NU3:  (8 RG C2')-(8 RG C3')-(8 RG C4')-(8 RG O4') -16.9  38.5
 &rst     iat =   258,   256,   236,   238,
   r1 = -17.9, r2 = -16.9, r3 =  38.5, r4 =  39.5,
 &end

# 8 GUA NU4:  (8 RG C3')-(8 RG C4')-(8 RG O4')-(8 RG C1') -37.6  34.0
 &rst     iat =   256,   236,   238,   239,
   r1 = -38.6, r2 = -37.6, r3 =  34.0, r4 =  35.0,
 &end

# 9 GUA NU0:  (9 RG C4')-(9 RG O4')-(9 RG C1')-(9 RG C2') -38.5  25.8
 &rst     iat =   270,   272,   273,   292,
   r1 = -39.5, r2 = -38.5, r3 =  25.8, r4 =  26.8,
 &end

# 9 GUA NU1:  (9 RG O4')-(9 RG C1')-(9 RG C2')-(9 RG C3')  -4.0  38.5
 &rst     iat =   272,   273,   292,   290,
   r1 =  -5.0, r2 =  -4.0, r3 =  38.5, r4 =  39.5,
 &end

# 9 GUA NU2:  (9 RG C1')-(9 RG C2')-(9 RG C3')-(9 RG C4') -38.5  -6.7
 &rst     iat =   273,   292,   290,   270,
   r1 = -39.5, r2 = -38.5, r3 =  -6.7, r4 =  -5.7,
 &end

# 9 GUA NU3:  (9 RG C2')-(9 RG C3')-(9 RG C4')-(9 RG O4') -16.9  38.5
 &rst     iat =   292,   290,   270,   272,
   r1 = -17.9, r2 = -16.9, r3 =  38.5, r4 =  39.5,
 &end

# 9 GUA NU4:  (9 RG C3')-(9 RG C4')-(9 RG O4')-(9 RG C1') -37.6  34.0
 &rst     iat =   290,   270,   272,   273,
   r1 = -38.6, r2 = -37.6, r3 =  34.0, r4 =  35.0,
 &end

# 10 ADE NU0:  (10 RA C4')-(10 RA O4')-(10 RA C1')-(10 RA C2') -38.5  25.8
 &rst     iat =   304,   306,   307,   325,
   r1 = -39.5, r2 = -38.5, r3 =  25.8, r4 =  26.8,
 &end

# 10 ADE NU1:  (10 RA O4')-(10 RA C1')-(10 RA C2')-(10 RA C3')  -4.0  38.5
 &rst     iat =   306,   307,   325,   323,
   r1 =  -5.0, r2 =  -4.0, r3 =  38.5, r4 =  39.5,
 &end

# 10 ADE NU2:  (10 RA C1')-(10 RA C2')-(10 RA C3')-(10 RA C4') -38.5  -6.7
 &rst     iat =   307,   325,   323,   304,
   r1 = -39.5, r2 = -38.5, r3 =  -6.7, r4 =  -5.7,
 &end

# 10 ADE NU3:  (10 RA C2')-(10 RA C3')-(10 RA C4')-(10 RA O4') -16.9  38.5
 &rst     iat =   325,   323,   304,   306,
   r1 = -17.9, r2 = -16.9, r3 =  38.5, r4 =  39.5,
 &end

# 10 ADE NU4:  (10 RA C3')-(10 RA C4')-(10 RA O4')-(10 RA C1') -37.6  34.0
 &rst     iat =   323,   304,   306,   307,
   r1 = -38.6, r2 = -37.6, r3 =  34.0, r4 =  35.0,
 &end

# 11 CYT NU0:  (11 RU C4')-(11 RU O4')-(11 RU C1')-(11 RU C2') -38.5  25.8
 &rst     iat =   337,   339,   340,   355,
   r1 = -39.5, r2 = -38.5, r3 =  25.8, r4 =  26.8,
 &end

# 11 CYT NU1:  (11 RU O4')-(11 RU C1')-(11 RU C2')-(11 RU C3')  -4.0  38.5
 &rst     iat =   339,   340,   355,   353,
   r1 =  -5.0, r2 =  -4.0, r3 =  38.5, r4 =  39.5,
 &end

# 11 CYT NU2:  (11 RU C1')-(11 RU C2')-(11 RU C3')-(11 RU C4') -38.5  -6.7
 &rst     iat =   340,   355,   353,   337,
   r1 = -39.5, r2 = -38.5, r3 =  -6.7, r4 =  -5.7,
 &end

# 11 CYT NU3:  (11 RU C2')-(11 RU C3')-(11 RU C4')-(11 RU O4') -16.9  38.5
 &rst     iat =   355,   353,   337,   339,
   r1 = -17.9, r2 = -16.9, r3 =  38.5, r4 =  39.5,
 &end

# 11 CYT NU4:  (11 RU C3')-(11 RU C4')-(11 RU O4')-(11 RU C1') -37.6  34.0
 &rst     iat =   353,   337,   339,   340,
   r1 = -38.6, r2 = -37.6, r3 =  34.0, r4 =  35.0,
 &end

# 12 GUA NU0:  (12 RG C4')-(12 RG O4')-(12 RG C1')-(12 RG C2') -38.5  25.8
 &rst     iat =   367,   369,   370,   389,
   r1 = -39.5, r2 = -38.5, r3 =  25.8, r4 =  26.8,
 &end

# 12 GUA NU1:  (12 RG O4')-(12 RG C1')-(12 RG C2')-(12 RG C3')  -4.0  38.5
 &rst     iat =   369,   370,   389,   387,
   r1 =  -5.0, r2 =  -4.0, r3 =  38.5, r4 =  39.5,
 &end

# 12 GUA NU2:  (12 RG C1')-(12 RG C2')-(12 RG C3')-(12 RG C4') -38.5  -6.7
 &rst     iat =   370,   389,   387,   367,
   r1 = -39.5, r2 = -38.5, r3 =  -6.7, r4 =  -5.7,
 &end

# 12 GUA NU3:  (12 RG C2')-(12 RG C3')-(12 RG C4')-(12 RG O4') -16.9  38.5
 &rst     iat =   389,   387,   367,   369,
   r1 = -17.9, r2 = -16.9, r3 =  38.5, r4 =  39.5,
 &end

# 12 GUA NU4:  (12 RG C3')-(12 RG C4')-(12 RG O4')-(12 RG C1') -37.6  34.0
 &rst     iat =   387,   367,   369,   370,
   r1 = -38.6, r2 = -37.6, r3 =  34.0, r4 =  35.0,
 &end

# 13 GUA NU0:  (13 RG C4')-(13 RG O4')-(13 RG C1')-(13 RG C2') -38.1  37.7
 &rst     iat =   401,   403,   404,   423,
   r1 = -39.1, r2 = -38.1, r3 =  37.7, r4 =  38.7,
 &end

# 13 GUA NU1:  (13 RG O4')-(13 RG C1')-(13 RG C2')-(13 RG C3') -38.5  27.7
 &rst     iat =   403,   404,   423,   421,
   r1 = -39.5, r2 = -38.5, r3 =  27.7, r4 =  28.7,
 &end

# 13 GUA NU2:  (13 RG C1')-(13 RG C2')-(13 RG C3')-(13 RG C4')  -6.7  38.5
 &rst     iat =   404,   423,   421,   401,
   r1 =  -7.7, r2 =  -6.7, r3 =  38.5, r4 =  39.5,
 &end

# 13 GUA NU3:  (13 RG C2')-(13 RG C3')-(13 RG C4')-(13 RG O4') -38.5   4.0
 &rst     iat =   423,   421,   401,   403,
   r1 = -39.5, r2 = -38.5, r3 =   4.0, r4 =   5.0,
 &end

# 13 GUA NU4:  (13 RG C3')-(13 RG C4')-(13 RG O4')-(13 RG C1') -25.8  38.5
 &rst     iat =   421,   401,   403,   404,
   r1 = -26.8, r2 = -25.8, r3 =  38.5, r4 =  39.5,
 &end

# 14 ADE NU0:  (14 RA C4')-(14 RA O4')-(14 RA C1')-(14 RA C2') -38.1  37.7
 &rst     iat =   435,   437,   438,   456,
   r1 = -39.1, r2 = -38.1, r3 =  37.7, r4 =  38.7,
 &end

# 14 ADE NU1:  (14 RA O4')-(14 RA C1')-(14 RA C2')-(14 RA C3') -38.5  27.7
 &rst     iat =   437,   438,   456,   454,
   r1 = -39.5, r2 = -38.5, r3 =  27.7, r4 =  28.7,
 &end

# 14 ADE NU2:  (14 RA C1')-(14 RA C2')-(14 RA C3')-(14 RA C4')  -6.7  38.5
 &rst     iat =   438,   456,   454,   435,
   r1 =  -7.7, r2 =  -6.7, r3 =  38.5, r4 =  39.5,
 &end

# 14 ADE NU3:  (14 RA C2')-(14 RA C3')-(14 RA C4')-(14 RA O4') -38.5   4.0
 &rst     iat =   456,   454,   435,   437,
   r1 = -39.5, r2 = -38.5, r3 =   4.0, r4 =   5.0,
 &end

# 14 ADE NU4:  (14 RA C3')-(14 RA C4')-(14 RA O4')-(14 RA C1') -25.8  38.5
 &rst     iat =   454,   435,   437,   438,
   r1 = -26.8, r2 = -25.8, r3 =  38.5, r4 =  39.5,
 &end

# 15 CYT NU0:  (15 RU C4')-(15 RU O4')-(15 RU C1')-(15 RU C2') -38.1  37.7
 &rst     iat =   468,   470,   471,   486,
   r1 = -39.1, r2 = -38.1, r3 =  37.7, r4 =  38.7,
 &end

# 15 CYT NU1:  (15 RU O4')-(15 RU C1')-(15 RU C2')-(15 RU C3') -38.5  27.7
 &rst     iat =   470,   471,   486,   484,
   r1 = -39.5, r2 = -38.5, r3 =  27.7, r4 =  28.7,
 &end

# 15 CYT NU2:  (15 RU C1')-(15 RU C2')-(15 RU C3')-(15 RU C4')  -6.7  38.5
 &rst     iat =   471,   486,   484,   468,
   r1 =  -7.7, r2 =  -6.7, r3 =  38.5, r4 =  39.5,
 &end

# 15 CYT NU3:  (15 RU C2')-(15 RU C3')-(15 RU C4')-(15 RU O4') -38.5   4.0
 &rst     iat =   486,   484,   468,   470,
   r1 = -39.5, r2 = -38.5, r3 =   4.0, r4 =   5.0,
 &end

# 15 CYT NU4:  (15 RU C3')-(15 RU C4')-(15 RU O4')-(15 RU C1') -25.8  38.5
 &rst     iat =   484,   468,   470,   471,
   r1 = -26.8, r2 = -25.8, r3 =  38.5, r4 =  39.5,
 &end

# 16 CYT NU0:  (16 RC C4')-(16 RC O4')-(16 RC C1')-(16 RC C2') -38.1  37.7
 &rst     iat =   498,   500,   501,   517,
   r1 = -39.1, r2 = -38.1, r3 =  37.7, r4 =  38.7,
 &end

# 16 CYT NU1:  (16 RC O4')-(16 RC C1')-(16 RC C2')-(16 RC C3') -38.5  27.7
 &rst     iat =   500,   501,   517,   515,
   r1 = -39.5, r2 = -38.5, r3 =  27.7, r4 =  28.7,
 &end

# 16 CYT NU2:  (16 RC C1')-(16 RC C2')-(16 RC C3')-(16 RC C4')  -6.7  38.5
 &rst     iat =   501,   517,   515,   498,
   r1 =  -7.7, r2 =  -6.7, r3 =  38.5, r4 =  39.5,
 &end

# 16 CYT NU3:  (16 RC C2')-(16 RC C3')-(16 RC C4')-(16 RC O4') -38.5   4.0
 &rst     iat =   517,   515,   498,   500,
   r1 = -39.5, r2 = -38.5, r3 =   4.0, r4 =   5.0,
 &end

# 16 CYT NU4:  (16 RC C3')-(16 RC C4')-(16 RC O4')-(16 RC C1') -25.8  38.5
 &rst     iat =   515,   498,   500,   501,
   r1 = -26.8, r2 = -25.8, r3 =  38.5, r4 =  39.5,
 &end

# 17 CYT NU0:  (17 RU C4')-(17 RU O4')-(17 RU C1')-(17 RU C2') -38.1  37.7
 &rst     iat =   529,   531,   532,   547,
   r1 = -39.1, r2 = -38.1, r3 =  37.7, r4 =  38.7,
 &end

# 17 CYT NU1:  (17 RU O4')-(17 RU C1')-(17 RU C2')-(17 RU C3') -38.5  27.7
 &rst     iat =   531,   532,   547,   545,
   r1 = -39.5, r2 = -38.5, r3 =  27.7, r4 =  28.7,
 &end

# 17 CYT NU2:  (17 RU C1')-(17 RU C2')-(17 RU C3')-(17 RU C4')  -6.7  38.5
 &rst     iat =   532,   547,   545,   529,
   r1 =  -7.7, r2 =  -6.7, r3 =  38.5, r4 =  39.5,
 &end

# 17 CYT NU3:  (17 RU C2')-(17 RU C3')-(17 RU C4')-(17 RU O4') -38.5   4.0
 &rst     iat =   547,   545,   529,   531,
   r1 = -39.5, r2 = -38.5, r3 =   4.0, r4 =   5.0,
 &end

# 17 CYT NU4:  (17 RU C3')-(17 RU C4')-(17 RU O4')-(17 RU C1') -25.8  38.5
 &rst     iat =   545,   529,   531,   532,
   r1 = -26.8, r2 = -25.8, r3 =  38.5, r4 =  39.5,
 &end

# 18 CYT NU0:  (18 RC3 C4')-(18 RC3 O4')-(18 RC3 C1')-(18 RC3 C2') -38.1  37.7
 &rst     iat =   559,   561,   562,   578,
   r1 = -39.1, r2 = -38.1, r3 =  37.7, r4 =  38.7,
 &end

# 18 CYT NU1:  (18 RC3 O4')-(18 RC3 C1')-(18 RC3 C2')-(18 RC3 C3') -38.5  27.7
 &rst     iat =   561,   562,   578,   576,
   r1 = -39.5, r2 = -38.5, r3 =  27.7, r4 =  28.7,
 &end

# 18 CYT NU2:  (18 RC3 C1')-(18 RC3 C2')-(18 RC3 C3')-(18 RC3 C4')  -6.7  38.5
 &rst     iat =   562,   578,   576,   559,
   r1 =  -7.7, r2 =  -6.7, r3 =  38.5, r4 =  39.5,
 &end

# 18 CYT NU3:  (18 RC3 C2')-(18 RC3 C3')-(18 RC3 C4')-(18 RC3 O4') -38.5   4.0
 &rst     iat =   578,   576,   559,   561,
   r1 = -39.5, r2 = -38.5, r3 =   4.0, r4 =   5.0,
 &end

# 18 CYT NU4:  (18 RC3 C3')-(18 RC3 C4')-(18 RC3 O4')-(18 RC3 C1') -25.8  38.5
 &rst     iat =   576,   559,   561,   562,
   r1 = -26.8, r2 = -25.8, r3 =  38.5, r4 =  39.5,
 &end




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