*HEADER    RNA                                     02-JUN-11   2LDT              
*TITLE     THE 912-888 ALTERNATE CONFORMATION FOR HELIX 27 OF E.COLI 16S RRNA    
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: RNA (31-MER);                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: TRANSCRIBED USING T7 RNA POLYMERASE FROM A CHEMICALLY 
*SOURCE   4 SYNTHESIZED DOUBLE-STRANDED DNA TEMPLATE.                            
*KEYWDS    RNA, RRNA, SWITCH HELIX                                               
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    13                                                                    
*AUTHOR    M.N.SPANO, N.G.WALTER                                                 
*REVDAT   1   07-SEP-11 2LDT    0                                                


assi (resi 1 and name  O4' and segi a)(resi 1 and name  C1' and segi a)
     (resi 1 and name  N9  and segi a)(resi 1 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 2 and name  O4' and segi a)(resi 2 and name  C1' and segi a)
     (resi 2 and name  N9  and segi a)(resi 2 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 3 and name  O4' and segi a)(resi 3 and name  C1' and segi a)  
     (resi 3 and name  N1  and segi a)(resi 3 and name  C2  and segi a)  25.0  -120.0  40.0  2

assi (resi 4 and name  O4' and segi a)(resi 4 and name  C1' and segi a)
     (resi 4 and name  N9  and segi a)(resi 4 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 5 and name  O4' and segi a)(resi 5 and name  C1' and segi a)
     (resi 5 and name  N9  and segi a)(resi 5 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 6 and name  O4' and segi a)(resi 6 and name  C1' and segi a)
     (resi 6 and name  N9  and segi a)(resi 6 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 7 and name  O4' and segi a)(resi 7 and name  C1' and segi a)
     (resi 7 and name  N1  and segi a)(resi 7 and name  C2  and segi a)  25.0  -120.0  40.0  2

assi (resi 8 and name  O4' and segi a)(resi 8 and name  C1' and segi a)
     (resi 8 and name  N9  and segi a)(resi 8 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 9 and name  O4' and segi a)(resi 9 and name  C1' and segi a)
     (resi 9 and name  N1  and segi a)(resi 9 and name  C2  and segi a)  25.0  -120.0  40.0  2

assi (resi 10 and name  O4' and segi a)(resi 10 and name  C1' and segi a)
     (resi 10 and name  N9  and segi a)(resi 10 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 11 and name  O4' and segi a)(resi 11 and name  C1' and segi a)
     (resi 11 and name  N9  and segi a)(resi 11 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 12 and name  O4' and segi a)(resi 12 and name  C1' and segi a)
     (resi 12 and name  N1  and segi a)(resi 12 and name  C2  and segi a)  25.0  -120.0  40.0  2

assi (resi 13 and name  O4' and segi a)(resi 13 and name  C1' and segi a)
     (resi 13 and name  N1  and segi a)(resi 13 and name  C2  and segi a)  25.0  -120.0  40.0  2

assi (resi 14 and name  O4' and segi a)(resi 14 and name  C1' and segi a)
     (resi 14 and name  N9  and segi a)(resi 14 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 15 and name  O4' and segi a)(resi 15 and name  C1' and segi a)
     (resi 15 and name  N1  and segi a)(resi 15 and name  C2  and segi a)  25.0  -120.0  40.0  2

assi (resi 16 and name  O4' and segi a)(resi 16 and name  C1' and segi a)
     (resi 16 and name  N9  and segi a)(resi 16 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 17 and name  O4' and segi a)(resi 17 and name  C1' and segi a)
     (resi 17 and name  N9  and segi a)(resi 17 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 18 and name  O4' and segi a)(resi 18 and name  C1' and segi a)
     (resi 18 and name  N9  and segi a)(resi 18 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 19 and name  O4' and segi a)(resi 19 and name  C1' and segi a)
     (resi 19 and name  N9  and segi a)(resi 19 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 20 and name  O4' and segi a)(resi 20 and name  C1' and segi a)
     (resi 20 and name  N1  and segi a)(resi 20 and name  C2  and segi a)  25.0  -120.0  40.0  2

assi (resi 21 and name  O4' and segi a)(resi 21 and name  C1' and segi a)
     (resi 21 and name  N1  and segi a)(resi 21 and name  C2  and segi a)  25.0  -120.0  40.0  2

assi (resi 22 and name  O4' and segi a)(resi 22 and name  C1' and segi a)
     (resi 22 and name  N9  and segi a)(resi 22 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 23 and name  O4' and segi a)(resi 23 and name  C1' and segi a)
     (resi 23 and name  N9  and segi a)(resi 23 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 24 and name  O4' and segi a)(resi 24 and name  C1' and segi a)
     (resi 24 and name  N9  and segi a)(resi 24 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 25 and name  O4' and segi a)(resi 25 and name  C1' and segi a)
     (resi 25 and name  N9  and segi a)(resi 25 and name  C4  and segi a)  25.0  -120.0  40.0  2

assi (resi 26 and name  O4' and segi a)(resi 26 and name  C1' and segi a)
     (resi 26 and name  N1  and segi a)(resi 26 and name  C2  and segi a)  25.0  -120.0  40.0  2

assi (resi 27 and name  O4' and segi a)(resi 27 and name  C1' and segi a)
     (resi 27 and name  N1  and segi a)(resi 27 and name  C2  and segi a)  25.0  -120.0  40.0  2

assi (resi 28 and name  O4' and segi a)(resi 28 and name  C1' and segi a)
     (resi 28 and name  N1  and segi a)(resi 28 and name  C2  and segi a)  25.0  -120.0  40.0  2

assi (resi 29 and name  O4' and segi a)(resi 29 and name  C1' and segi a)
     (resi 29 and name  N1  and segi a)(resi 29 and name  C2  and segi a)  25.0  -120.0  40.0  2

assi (resi 30 and name  O4' and segi a)(resi 30 and name  C1' and segi a)  
     (resi 30 and name  N1  and segi a)(resi 30 and name  C2  and segi a)  25.0  -120.0  40.0  2

assi (resi 31 and name  O4' and segi a)(resi 31 and name  C1' and segi a)  
     (resi 31 and name  N1  and segi a)(resi 31 and name  C2  and segi a)  25.0  -120.0  40.0  2

 assi (resi 7 and name C1' and segi a) (resi 7 and name C2' and segi a)
      (resi 7 and name C3' and segi a) (resi 7 and name C4' and segi a) 25.0  -36.0 15.1 2 ! C2
 assi (resi 7 and name C4' and segi a) (resi 7 and name O4' and segi a)
      (resi 7 and name C1' and segi a) (resi 7 and name C2' and segi a) 25.0  -22.0 20.1 2 ! C2
 assi (resi 7 and name O3' and segi a) (resi 7 and name C3' and segi a)
      (resi 7 and name C4' and segi a) (resi 7 and name C5' and segi a) 25.0  160.0 30.0 2 ! C2 

 assi (resi 8 and name C1' and segi a) (resi 8 and name C2' and segi a)
      (resi 8 and name C3' and segi a) (resi 8 and name C4' and segi a) 25.0  -36.0 15.1 2      ! C2
 assi (resi 8 and name C4' and segi a) (resi 8 and name O4' and segi a)
      (resi 8 and name C1' and segi a) (resi 8 and name C2' and segi a) 25.0  -22.0 20.1 2 ! C2
 assi (resi 8 and name O3' and segi a) (resi 8 and name C3' and segi a)
      (resi 8 and name C4' and segi a) (resi 8 and name C5' and segi a) 25.0  160.0 30.0 2 ! C2

 assi (resi 9 and name C1' and segi a) (resi 9 and name C2' and segi a)
      (resi 9 and name C3' and segi a) (resi 9 and name C4' and segi a) 25.0  -36.0 15.1 2      ! C2
 assi (resi 9 and name C4' and segi a) (resi 9 and name O4' and segi a)
      (resi 9 and name C1' and segi a) (resi 9 and name C2' and segi a) 25.0  -22.0 20.1 2 ! C2
 assi (resi 9 and name O3' and segi a) (resi 9 and name C3' and segi a)
      (resi 9 and name C4' and segi a) (resi 9 and name C5' and segi a) 25.0  160.0 30.0 2 ! C2

 assi (resi 13 and name C1' and segi a) (resi 13 and name C2' and segi a)
      (resi 13 and name C3' and segi a) (resi 13 and name C4' and segi a) 25.0  -36.0 15.1 2 ! C2
 assi (resi 13 and name C4' and segi a) (resi 13 and name O4' and segi a)
      (resi 13 and name C1' and segi a) (resi 13 and name C2' and segi a) 25.0  -22.0 20.1 2 ! C2
 assi (resi 13 and name O3' and segi a) (resi 13 and name C3' and segi a)
      (resi 13 and name C4' and segi a) (resi 13 and name C5' and segi a) 25.0  160.0 30.0 2 ! C2

 assi (resi 15 and name C1' and segi a) (resi 15 and name C2' and segi a)
      (resi 15 and name C3' and segi a) (resi 15 and name C4' and segi a) 25.0  -36.0 15.1 2 ! C2
 assi (resi 15 and name C4' and segi a) (resi 15 and name O4' and segi a)
      (resi 15 and name C1' and segi a) (resi 15 and name C2' and segi a) 25.0  -22.0 20.1 2 ! C2
 assi (resi 15 and name O3' and segi a) (resi 15 and name C3' and segi a)
      (resi 15 and name C4' and segi a) (resi 15 and name C5' and segi a) 25.0  160.0 30.0 2 ! C2

 assi (resi 16 and name C1' and segi a) (resi 16 and name C2' and segi a)
      (resi 16 and name C3' and segi a) (resi 16 and name C4' and segi a) 25.0  -36.0 15.1 2 ! C2
 assi (resi 16 and name C4' and segi a) (resi 16 and name O4' and segi a)
      (resi 16 and name C1' and segi a) (resi 16 and name C2' and segi a) 25.0  -22.0 20.1 2 ! C2
 assi (resi 16 and name O3' and segi a) (resi 16 and name C3' and segi a)
      (resi 16 and name C4' and segi a) (resi 16 and name C5' and segi a) 25.0  160.0 30.0 2 ! C2

 assi (resi 21 and name C1' and segi a) (resi 21 and name C2' and segi a)
      (resi 21 and name C3' and segi a) (resi 21 and name C4' and segi a) 25.0  -36.0 15.1 2 ! C2
 assi (resi 21 and name C4' and segi a) (resi 21 and name O4' and segi a)
      (resi 21 and name C1' and segi a) (resi 21 and name C2' and segi a) 25.0  -22.0 20.1 2 ! C2
 assi (resi 21 and name O3' and segi a) (resi 21 and name C3' and segi a)
      (resi 21 and name C4' and segi a) (resi 21 and name C5' and segi a) 25.0  160.0 30.0 2 ! C2 

 assi (resi 22 and name C1' and segi a) (resi 22 and name C2' and segi a)
      (resi 22 and name C3' and segi a) (resi 22 and name C4' and segi a) 25.0  -36.0 15.1 2 ! C2
 assi (resi 22 and name C4' and segi a) (resi 22 and name O4' and segi a)
      (resi 22 and name C1' and segi a) (resi 22 and name C2' and segi a) 25.0  -22.0 20.1 2 ! C2
 assi (resi 22 and name O3' and segi a) (resi 22 and name C3' and segi a)
      (resi 22 and name C4' and segi a) (resi 22 and name C5' and segi a) 25.0  160.0 30.0 2 ! C2 

 assi (resi 23 and name C1' and segi a) (resi 23 and name C2' and segi a)
      (resi 23 and name C3' and segi a) (resi 23 and name C4' and segi a) 25.0  -36.0 15.1 2 ! C2
 assi (resi 23 and name C4' and segi a) (resi 23 and name O4' and segi a)
      (resi 23 and name C1' and segi a) (resi 23 and name C2' and segi a) 25.0  -22.0 20.1 2 ! C2
 assi (resi 23 and name O3' and segi a) (resi 23 and name C3' and segi a)
      (resi 23 and name C4' and segi a) (resi 23 and name C5' and segi a) 25.0  160.0 30.0 2 ! C2 

 assi (resi 24 and name C1' and segi a) (resi 24 and name C2' and segi a)
      (resi 24 and name C3' and segi a) (resi 24 and name C4' and segi a) 25.0  -36.0 15.1 2 ! C2
 assi (resi 24 and name C4' and segi a) (resi 24 and name O4' and segi a)
      (resi 24 and name C1' and segi a) (resi 24 and name C2' and segi a) 25.0  -22.0 20.1 2 ! C2
 assi (resi 24 and name O3' and segi a) (resi 24 and name C3' and segi a)
      (resi 24 and name C4' and segi a) (resi 24 and name C5' and segi a) 25.0  160.0 30.0 2 ! C2

 

 
 
                      

restraints plane

!G1-C31
 group
  select= ((resid 1 and (name n1 or name c6 or name c2)) or
              (resid 31 and (name n3)))
  weight=80.0
 end

group
  select= ((resid 1 and (name n1)) or
              (resid 31 and (name n3 or name c2 or name c4)))
  weight=80.0
 end

!G2-C30
 group
  select= ((resid 2 and (name n1 or name c6 or name c2)) or
              (resid 30 and (name n3)))
  weight=40.0
 end

group
  select= ((resid 2 and (name n1)) or
              (resid 30 and (name n3 or name c2 or name c4)))
  weight=40.0
 end

!G3-C29
 group
  select= ((resid 3 and (name n1 or name c6 or name c2)) or
              (resid 29 and (name n3)))
  weight=40.0
 end

group
  select= ((resid 3 and (name n1)) or
              (resid 29 and (name n3 or name c2 or name c4)))
  weight=40.0
 end

!G4-C28
 group
  select= ((resid 4 and (name n1 or name c6 or name c2)) or
              (resid 28 and (name n3)))
  weight=20.0
 end

group
  select= ((resid 4 and (name n1)) or
              (resid 28 and (name n3 or name c2 or name c4)))
  weight=20.0
 end

!A5-G27
 group
  select= ((resid 27 and (name n1 or name c6 or name c2)) or
              (resid 5 and (name n1)))
  weight=20.0
 end

group
  select= ((resid 27 and (name n1)) or
              (resid 5 and (name n1 or name c6 or name c2)))
  weight=20.0
 end

!G6-C26
 group
  select= ((resid 6 and (name n1 or name c6 or name c2)) or
              (resid 26 and (name n3)))
  weight=10.0
 end

group
  select= ((resid 6 and (name n1)) or
              (resid 26 and (name n3 or name c2 or name c4)))
  weight=10.0
 end




!C13-G18
 group
  select= ((resid 18 and (name n1 or name c6 or name c2)) or
              (resid 13 and (name n3)))
  weight=80.0
 end

group
  select= ((resid 18 and (name n1)) or
              (resid 13 and (name n3 or name c2 or name c4)))
  weight=80.0
 end

!C12-G19
 group
  select= ((resid 19 and (name n1 or name c6 or name c2)) or
              (resid 12 and (name n3)))
  weight=40.0
 end

group
  select= ((resid 19 and (name n1)) or
              (resid 12 and (name n3 or name c2 or name c4)))
  weight=40.0
 end

!G11-U20

 group
  select= ((resid 11 and (name n1 or name c6 or name c2)) or
              (resid 20 and (name n3)))
  weight=20.0
 end

group
  select= ((resid 11 and (name n1)) or
              (resid 20 and (name n3 or name c2 or name c4)))
  weight=20.0
 end

!G10-U21

 group
  select= ((resid 10 and (name n1 or name c6 or name c2)) or
              (resid 21 and (name n3)))
  weight=10.0
 end

group
  select= ((resid 10 and (name n1)) or
              (resid 21 and (name n3 or name c2 or name c4)))
  weight=10.0
 end




!G14-A17
 group
  select= ((resid 14 and (name n3 or name c4 or name c2)) or
              (resid 17 and (name n6)))
  weight=10.0
 end

group
  select= ((resid 14 and (name n3)) or
              (resid 17 and (name n3 or name n1 or name c6)))
  weight=10.0
 end
end
remarks refinement of RNA using torsion angle and base-base positional database potentials of mean force
remarks In this example, there is also dipolar coupling cross-validation.
remarks Clore, G.M. & Kuszewski, J. (2003) Inproving the accuracy
remarks of NMR structures of RNA by means of conformational database
remarks potentials of mean force as assessed by complete dipolar
remarks coupling cross-validation.  J. Am. Chem. Soc. 125, 1518-1525




evaluate ($end_count=1)      ! set number of structures to be calculated 
evaluate ($seed=93869099)

set seed $seed  end

{====>}
{====>}

parameter                                        {*Read the parameter file.*}
{====>} 
   @parnah1er1_mod_new.inp
   @par_axis_3.pro
end


evaluate ($knoe  = 0.1)  
evaluate ($kcdi = 10.0)


evaluate ($kori = 0.002)
evaluate ($knuc = 0.002)




{====>} structure @h27_912-888_H2.psf @axis_new.psf end           {*Read the structure file.*}

coor @../xplor_stuff/912-888/912-888_calcs/"test27_1_912-888_calcs_xxx.pdb"




flags exclude * include bonds angles impr end

mini powell nstep=100 step=1.0 end


coor copy end


@plane_888.inp


@rna_orient_888.setup





noe
{====>}                                                        
   nres=3000             {*Estimate greater than the actual number of NOEs.*}
   class all 
{====>}
   @noe_912-888_inter.tbl
   @noe_912-888_intra.tbl                 {*Read NOE distance ranges.*}
   class hb
   @hbond_912-888.tbl
end

{====>}
restraints dihed
  scale $kcdi
  nass = 5000
  set message on echo on end
    @912-888_chiral.tbl 
    @aform_912-888.tbl
    @c2_912-888.tbl
    @c3_912-888.tbl
    @chi_912-888.tbl   !dihedral angle restraints.
  set message on echo on end
end


noe                             {*Parameters for NOE effective energy term.*}
   ceiling=1000                      
   averaging  all sum
   potential  all square
   sqconstant all 1.
   sqexponent all 2
   scale      all $knoe           {*Constant NOE scale throughout the protocol.*}

   averaging  hb sum
   potential  hb biharmonic
   sqconstant hb 1.
   sqexponent hb 2
   scale      hb $knoe           {*Constant NOE scale throughout the protocol.*}

end


evaluate ($knuc=0.1)
rama
nres=10000
set message off echo off end
@nucleic_deltor_quarts2d.tbl
@nucleic_deltor_quarts3d.tbl
@nucleic_deltor_quarts4d.tbl
@force_nucleic_quarts2d.tbl
@force_nucleic_quarts3d.tbl
@force_nucleic_quarts4d.tbl
end
set message on echo on end
@setup_nucleic_2d3d.tbl
@setup_nucleic_4d.tbl
set message on echo on end


evaluate ($ini_sani = 0.001)
evaluate ($ksani  = $ini_sani)



sani
   nres=500
   class JCHw                    ! allRDCs
        force $ksani
        potential harmonic
        coeff 0.0 -27.05 0.196
        @dip_70_888_allRDCs.tbl

   class JCHf                    ! allRDCs
        force 0.0 !$ksani
        potential harmonic
        coeff 0.0 -27.05 0.196
        @dip_30_888_allRDCs.tbl


end



parameter                       {*Parameters for the repulsive energy term.*}
   nbonds
      cutnb=6.5
      rcon=4.0 nbxmod=3 repel=0.8 rexp=2 irex=2
      wmin=0.01 tolerance=0.5
   end
end



vector do (store1 = decode(resid)) (name C3')
vector show min (store1) (name C3')
evaluate ($first_residue = $result)
vector show max (store1) (name C3')
evaluate ($last_residue = $result)


dynamics internal
    
    group (resid 500 )
    hinge rotate (resid 500)


  evaluate ($res = 1)
  while ($res le 34) loop group

      group (resid $res and resname CYT and
         (name n1 or name c6 or name c5 or name c4
        or name n3 or name c2))
      group (resid $res and resname GUA and
        (name n9 or name c4 or name n3 or name c2 or name n1 or
          name c6 or name c5 or name n7 or name c8))
      group (resid $res and resname ADE and
        (name n9 or name c4 or name n3 or name c2 or name n1 or
          name c6 or name c5 or name n7 or name c8))
      group (resid $res and resname THY and
         (name n1 or name c6 or name c5 or name c4
        or name n3 or name c2))
      group (resid $res and resname URI and
         (name n1 or name c6 or name c5 or name c4
        or name n3 or name c2))

    evaluate ($res = $res +1)
  end loop group

     group (resid 34 and (name n1 or name c1 or name c2 or name o2
     or name n3 or name c3 or name c4 or name n9 or name c8
     or name n7 or name c5 or name c6 or name o6 or name h7))


set message on echo on end
cloop=false
auto torsion
maxe 10000
end



evaluate ($cool_steps = 3000)
evaluate ($init_t  = 2000.01)
evaluate ($tol = $init_t/1000)

vector do (mass = 100.0) (all)
vector do (fbeta = 10.0) (all)


{====>}

evaluate ($count = 0)
while ($count < $end_count ) loop structure 
    
   evaluate ($count=$count+1)
      
{====>}                             {*Filename(s) for embedded coordinates.*}


vector do (x=xcomp) (all)
vector do (y=ycomp) (all)
vector do (z=zcomp) (all)

evaluate ($ini_rad  = 0.9)        evaluate ($fin_rad  = 0.78)
evaluate ($ini_con=  0.004)       evaluate ($fin_con=  4.0)
evaluate ($rcon=$ini_con)
evaluate ($ini_ang = 1.0)         evaluate ($fin_ang = 1.0)
evaluate ($ini_imp = 1.0)         evaluate ($fin_imp = 1.0)

evaluate ($ini_noe = 2.0)         evaluate ($fin_noe = 30.0)
evaluate ($knoe  = $ini_noe)   
evaluate ($ini_nuc = 0.5)     evaluate ($fin_nuc = 1.0)
evaluate ($knuc = $ini_nuc)
evaluate ($ini_orie = 0.002)     evaluate ($fin_orie = 0.30)
evaluate ($korie = $ini_orie)

evaluate ($ini_sani = 0.01)         evaluate ($fin_sani = 1.0)
evaluate ($ksani  = $ini_sani)   

evaluate ($kcdi  = 10.0)   ! torsion angles


noe scale * $knoe end

evaluate ($ksanib = $ksani)

sani class JCHw force $ksani end

restraints dihed
  scale $kcdi
end


rama
@force_nucleic_quarts2d.tbl
@force_nucleic_quarts3d.tbl
@force_nucleic_quarts4d.tbl
end

orie scale $korie end


evaluate ($rcon  = 1.0)

parameters
  nbonds
    atom
    nbxmod 3
    wmin  =   0.01  ! warning off
    cutnb =   100   ! nonbonded cutoff
    tolerance 45
    repel=    1.2   ! scale factor for vdW radii = 1 ( L-J radii)
    rexp   =  2     ! exponents in (r^irex - R0^irex)^rexp
    irex   =  2
    rcon=$rcon      ! actually set the vdW weight
     end
end

   flags exclude * include bond angl impr vdw noe cdih plan sani orie rama end !orie rama





constraints

        interaction (not name c1' ) (all)

        weights * 1 angl 0.4 impr 0.1 vdw 0 elec 0 end

        interaction (name c1') (name c1')

        weights * 1 angl 0.4 impr 0.1 vdw 1.0 end

end





  vector do (vx = maxwell($init_t)) (all)
  vector do (vy = maxwell($init_t)) (all)
  vector do (vz = maxwell($init_t)) (all)


  dynamics internal
      itype=pc6
      !maxe=100
      etol=$tol
      tbath=$init_t
      response= 20
      response= 5
      nstep=5000
      timestep=  0.002
      endtime=10
  end




parameters
  nbonds
    atom
    nbxmod 3
    wmin  =   0.01  ! warning off
    cutnb =   4.5   ! nonbonded cutoff
    tolerance 0.5
    repel=    0.9   ! scale factor for vdW radii = 1 ( L-J radii)
    rexp   =  2     ! exponents in (r^irex - R0^irex)^rexp
    irex   =  2
    rcon =1.0      ! actually set the vdW weight
  end
end


evaluate ($kcdi = 200)
restraints dihed

  scale $kcdi

end


evaluate ($final_t = 25)     { K }
evaluate ($tempstep = 25)     { K }

evaluate ($ncycle = ($init_t-$final_t)/$tempstep)
evaluate ($nstep = int($cool_steps*4.0/$ncycle))
evaluate ($endtime = $nstep*0.002)

evaluate ($bath  = $init_t)
evaluate ($k_vdw = $ini_con)
evaluate ($k_vdwfact = ($fin_con/$ini_con)^(1/$ncycle))
evaluate ($radius=    $ini_rad)
evaluate ($radfact = ($fin_rad/$ini_rad)^(1/$ncycle))
evaluate ($k_ang = $ini_ang)
evaluate ($ang_fac = ($fin_ang/$ini_ang)^(1/$ncycle))
evaluate ($k_imp = $ini_imp)
evaluate ($imp_fac = ($fin_imp/$ini_imp)^(1/$ncycle))
evaluate ($noe_fac = ($fin_noe/$ini_noe)^(1/$ncycle))
evaluate ($knoe = $ini_noe)
!evaluate ($rama_fac = ($fin_rama/$ini_rama)^(1/$ncycle))
evaluate ($nuc_fac = ($fin_nuc/$ini_nuc)^(1/$ncycle))
evaluate ($knuc = $ini_nuc)
evaluate ($orie_fac = ($fin_orie/$ini_orie)^(1/$ncycle))
evaluate ($korie = $ini_orie)

evaluate ($sani_fac = ($fin_sani/$ini_sani)^(1/$ncycle))
evaluate ($ksani = $ini_sani)
evaluate ($ksanib = $ksani)
evaluate ($ksanin = $ksani*1.0)
evaluate ($ksanim = $ksani*1.0)
evaluate ($ksaddr = $ksani*1/5)
evaluate ($ksaddb = $ksani*1/8)



sani class JCHw force $ksani end

   flags exclude * include bond angl impr vdw noe cdih plan sani orie rama end   




vector do (vx = maxwell($bath)) (all)
vector do (vy = maxwell($bath)) (all)
vector do (vz = maxwell($bath)) (all)

evaluate ($i_cool = 0)
while ($i_cool < $ncycle) loop cool
    evaluate ($i_cool=$i_cool+1)

    evaluate ($bath  = $bath  - $tempstep)
    evaluate ($k_vdw=min($fin_con,$k_vdw*$k_vdwfact))
    evaluate ($radius=max($fin_rad,$radius*$radfact))
    evaluate ($k_ang = $k_ang*$ang_fac)
    evaluate ($k_imp = $k_imp*$imp_fac)
    evaluate ($knoe  = $knoe*$noe_fac)
    evaluate ($knuc  = $knuc*$nuc_fac)
    evaluate ($korie  = $korie*$orie_fac)

evaluate ($ksani  = $ksani*$sani_fac)
evaluate ($ksanib = $ksani)
evaluate ($ksanin = $ksani*1.0)
evaluate ($ksanim = $ksani*1.0)
evaluate ($ksaddr = $ksani*1/5)
evaluate ($ksaddb = $ksani*1/8)



sani class JCHw force $ksani end




constraints interaction (all) (all) weights
        * 1 angles $k_ang improper $k_imp
    end end



    parameter
        nbonds
        cutnb=4.5 rcon=$k_vdw nbxmod=3 repel=$radius
    end       end
noe scale * $knoe  end

rama
@force_nucleic_quarts2d.tbl
@force_nucleic_quarts3d.tbl
@force_nucleic_quarts4d.tbl
end
orie scale $korie end

  dynamics internal
      itype=pc6
      !maxe=100
      etol=$tol
      tbath=$bath
      response= 20
      response= 5
      nstep=$nstep
      endtime=$endtime
      timestep=  0.002
  end

end loop cool


dynamics internal
  itype=powell
  nstep=200
  maxcalls=20000
  nprint=1
  etol=1e-7
  gtol=0.01
  depred=0.001
end
 
   {* =================================== Write out the final structure(s).*}
   print threshold=0.5 noe 
   evaluate ($rms_noe=$result)
   evaluate ($violations_noe=$violations)
   print threshold=5. cdih
   evaluate ($rms_cdih=$result)
   evaluate ($violations_cdih=$violations)
   print thres=0.05 bonds          
   evaluate ($rms_bonds=$result)
   print thres=5. angles
   evaluate ($rms_angles=$result)
   print thres=5. impropers
   evaluate ($rms_impropers=$result)
   
   sani print threshold=5.0 class JCHw end
   evaluate ($rms_JCHw=$result)
   evaluate ($R_JCHw=$result*100/23.86)


   
   sani print threshold=5.0 class JCHf end
   evaluate ($rms_JCHf=$result)
   evaluate ($R_JCHf=$result*100/23.86)


   remarks =============================================================== 
   remarks            overall,bonds,angles,improper,vdw,noe,cdih,rama,orie,plan,sani,orie
   remarks energies: $ener, $bond, $angl, $impr, $vdw, $noe, $cdih,  $plan, $sani,  $orie
   remarks =============================================================== 
   remarks            bonds,angles,impropers,noe,cdih
   remarks rms-d: $rms_bonds,$rms_angles,$rms_impropers,$rms_noe,$rms_cdih
   remarks =============================================================== 
   remarks               noe,  cdih
   remarks violations.: $violations_noe, $violations_cdih
   remarks =============================================================== 
   remarks R-factor: JCH_work (70%)    JCH_free (30%) 
   remarks R-factor sani: $R_JCHw $R_JCHf 
   remarks rms sani: $rms_JCHw $rms_JCHf 
   remarks ===============================================================
      
{====>}                        {*Name(s) of the family of final structures.*}

evaluate ($filename="test27_xxx_allRDCs.sa")
    
   write coordinates output =$filename end
    
end loop structure

stop
assi (resi 1 and name C1' and segi a) (resi 1 and name C2' and segi a)
     (resi 1 and name C3' and segi a) (resi 1 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 1 and name C1' and segi a) (resi 1 and name C2' and segi a)
     (resi 1 and name C3' and segi a) (resi 1 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 1 and name C2' and segi a) (resi 1 and name C3' and segi a)
     (resi 1 and name C4' and segi a) (resi 1 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 1 and name C3' and segi a) (resi 1 and name C4' and segi a)
     (resi 1 and name O4' and segi a) (resi 1 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 1 and name C4' and segi a) (resi 1 and name O4' and segi a)
     (resi 1 and name C1' and segi a) (resi 1 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 1 and name O4' and segi a) (resi 1 and name C1' and segi a)
     (resi 1 and name C2' and segi a) (resi 1 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 1 and name O3' and segi a) (resi 1 and name C3' and segi a)
     (resi 1 and name C4' and segi a) (resi 1 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 2 and name C1' and segi a) (resi 2 and name C2' and segi a)
     (resi 2 and name C3' and segi a) (resi 2 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 2 and name C1' and segi a) (resi 2 and name C2' and segi a)
     (resi 2 and name C3' and segi a) (resi 2 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 2 and name C2' and segi a) (resi 2 and name C3' and segi a)
     (resi 2 and name C4' and segi a) (resi 2 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 2 and name C3' and segi a) (resi 2 and name C4' and segi a)
     (resi 2 and name O4' and segi a) (resi 2 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 2 and name C4' and segi a) (resi 2 and name O4' and segi a)
     (resi 2 and name C1' and segi a) (resi 2 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 2 and name O4' and segi a) (resi 2 and name C1' and segi a)
     (resi 2 and name C2' and segi a) (resi 2 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 2 and name O3' and segi a) (resi 2 and name C3' and segi a)
     (resi 2 and name C4' and segi a) (resi 2 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 3 and name C1' and segi a) (resi 3 and name C2' and segi a)
     (resi 3 and name C3' and segi a) (resi 3 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 3 and name C1' and segi a) (resi 3 and name C2' and segi a)
     (resi 3 and name C3' and segi a) (resi 3 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 3 and name C2' and segi a) (resi 3 and name C3' and segi a)
     (resi 3 and name C4' and segi a) (resi 3 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 3 and name C3' and segi a) (resi 3 and name C4' and segi a)
     (resi 3 and name O4' and segi a) (resi 3 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 3 and name C4' and segi a) (resi 3 and name O4' and segi a)
     (resi 3 and name C1' and segi a) (resi 3 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 3 and name O4' and segi a) (resi 3 and name C1' and segi a)
     (resi 3 and name C2' and segi a) (resi 3 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 3 and name O3' and segi a) (resi 3 and name C3' and segi a)
     (resi 3 and name C4' and segi a) (resi 3 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 4 and name C1' and segi a) (resi 4 and name C2' and segi a)
     (resi 4 and name C3' and segi a) (resi 4 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 4 and name C1' and segi a) (resi 4 and name C2' and segi a)
     (resi 4 and name C3' and segi a) (resi 4 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 4 and name C2' and segi a) (resi 4 and name C3' and segi a)
     (resi 4 and name C4' and segi a) (resi 4 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 4 and name C3' and segi a) (resi 4 and name C4' and segi a)
     (resi 4 and name O4' and segi a) (resi 4 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 4 and name C4' and segi a) (resi 4 and name O4' and segi a)
     (resi 4 and name C1' and segi a) (resi 4 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 4 and name O4' and segi a) (resi 4 and name C1' and segi a)
     (resi 4 and name C2' and segi a) (resi 4 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 4 and name O3' and segi a) (resi 4 and name C3' and segi a)
     (resi 4 and name C4' and segi a) (resi 4 and name C5' and segi a) 25.0  80.4 20.7 2        ! C3

assi (resi 5 and name C1' and segi a) (resi 5 and name C2' and segi a)
     (resi 5 and name C3' and segi a) (resi 5 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 5 and name C1' and segi a) (resi 5 and name C2' and segi a)
     (resi 5 and name C3' and segi a) (resi 5 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 5 and name C2' and segi a) (resi 5 and name C3' and segi a)
     (resi 5 and name C4' and segi a) (resi 5 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 5 and name C3' and segi a) (resi 5 and name C4' and segi a)
     (resi 5 and name O4' and segi a) (resi 5 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 5 and name C4' and segi a) (resi 5 and name O4' and segi a)
     (resi 5 and name C1' and segi a) (resi 5 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 5 and name O4' and segi a) (resi 5 and name C1' and segi a)
     (resi 5 and name C2' and segi a) (resi 5 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 5 and name O3' and segi a) (resi 5 and name C3' and segi a)
     (resi 5 and name C4' and segi a) (resi 5 and name C5' and segi a) 25.0  80.4 20.7 2        ! C3

assi (resi 6 and name C1' and segi a) (resi 6 and name C2' and segi a)
     (resi 6 and name C3' and segi a) (resi 6 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 6 and name C1' and segi a) (resi 6 and name C2' and segi a)
     (resi 6 and name C3' and segi a) (resi 6 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 6 and name C2' and segi a) (resi 6 and name C3' and segi a)
     (resi 6 and name C4' and segi a) (resi 6 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 6 and name C3' and segi a) (resi 6 and name C4' and segi a)
     (resi 6 and name O4' and segi a) (resi 6 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 6 and name C4' and segi a) (resi 6 and name O4' and segi a)
     (resi 6 and name C1' and segi a) (resi 6 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 6 and name O4' and segi a) (resi 6 and name C1' and segi a)
     (resi 6 and name C2' and segi a) (resi 6 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 6 and name O3' and segi a) (resi 6 and name C3' and segi a)
     (resi 6 and name C4' and segi a) (resi 6 and name C5' and segi a) 25.0  80.4 20.7 2        ! C3

assi (resi 10 and name C1' and segi a) (resi 10 and name C2' and segi a)
     (resi 10 and name C3' and segi a) (resi 10 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 10 and name C1' and segi a) (resi 10 and name C2' and segi a)
     (resi 10 and name C3' and segi a) (resi 10 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 10 and name C2' and segi a) (resi 10 and name C3' and segi a)
     (resi 10 and name C4' and segi a) (resi 10 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 10 and name C3' and segi a) (resi 10 and name C4' and segi a)
     (resi 10 and name O4' and segi a) (resi 10 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 10 and name C4' and segi a) (resi 10 and name O4' and segi a)
     (resi 10 and name C1' and segi a) (resi 10 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 10 and name O4' and segi a) (resi 10 and name C1' and segi a)
     (resi 10 and name C2' and segi a) (resi 10 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 10 and name O3' and segi a) (resi 10 and name C3' and segi a)
     (resi 10 and name C4' and segi a) (resi 10 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 11 and name C1' and segi a) (resi 11 and name C2' and segi a)
     (resi 11 and name C3' and segi a) (resi 11 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 11 and name C1' and segi a) (resi 11 and name C2' and segi a)
     (resi 11 and name C3' and segi a) (resi 11 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 11 and name C2' and segi a) (resi 11 and name C3' and segi a)
     (resi 11 and name C4' and segi a) (resi 11 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 11 and name C3' and segi a) (resi 11 and name C4' and segi a)
     (resi 11 and name O4' and segi a) (resi 11 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 11 and name C4' and segi a) (resi 11 and name O4' and segi a)
     (resi 11 and name C1' and segi a) (resi 11 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 11 and name O4' and segi a) (resi 11 and name C1' and segi a)
     (resi 11 and name C2' and segi a) (resi 11 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 11 and name O3' and segi a) (resi 11 and name C3' and segi a)
     (resi 11 and name C4' and segi a) (resi 11 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 12 and name C1' and segi a) (resi 12 and name C2' and segi a)
     (resi 12 and name C3' and segi a) (resi 12 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 12 and name C1' and segi a) (resi 12 and name C2' and segi a)
     (resi 12 and name C3' and segi a) (resi 12 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 12 and name C2' and segi a) (resi 12 and name C3' and segi a)
     (resi 12 and name C4' and segi a) (resi 12 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 12 and name C3' and segi a) (resi 12 and name C4' and segi a)
     (resi 12 and name O4' and segi a) (resi 12 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 12 and name C4' and segi a) (resi 12 and name O4' and segi a)
     (resi 12 and name C1' and segi a) (resi 12 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 12 and name O4' and segi a) (resi 12 and name C1' and segi a)
     (resi 12 and name C2' and segi a) (resi 12 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 12 and name O3' and segi a) (resi 12 and name C3' and segi a)
     (resi 12 and name C4' and segi a) (resi 12 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 14 and name C1' and segi a) (resi 14 and name C2' and segi a)
     (resi 14 and name C3' and segi a) (resi 14 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 14 and name C1' and segi a) (resi 14 and name C2' and segi a)
     (resi 14 and name C3' and segi a) (resi 14 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 14 and name C2' and segi a) (resi 14 and name C3' and segi a)
     (resi 14 and name C4' and segi a) (resi 14 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 14 and name C3' and segi a) (resi 14 and name C4' and segi a)
     (resi 14 and name O4' and segi a) (resi 14 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 14 and name C4' and segi a) (resi 14 and name O4' and segi a)
     (resi 14 and name C1' and segi a) (resi 14 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 14 and name O4' and segi a) (resi 14 and name C1' and segi a)
     (resi 14 and name C2' and segi a) (resi 14 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 14 and name O3' and segi a) (resi 14 and name C3' and segi a)
     (resi 14 and name C4' and segi a) (resi 14 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 17 and name C1' and segi a) (resi 17 and name C2' and segi a)
     (resi 17 and name C3' and segi a) (resi 17 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 17 and name C1' and segi a) (resi 17 and name C2' and segi a)
     (resi 17 and name C3' and segi a) (resi 17 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 17 and name C2' and segi a) (resi 17 and name C3' and segi a)
     (resi 17 and name C4' and segi a) (resi 17 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 17 and name C3' and segi a) (resi 17 and name C4' and segi a)
     (resi 17 and name O4' and segi a) (resi 17 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 17 and name C4' and segi a) (resi 17 and name O4' and segi a)
     (resi 17 and name C1' and segi a) (resi 17 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 17 and name O4' and segi a) (resi 17 and name C1' and segi a)
     (resi 17 and name C2' and segi a) (resi 17 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 17 and name O3' and segi a) (resi 17 and name C3' and segi a)
     (resi 17 and name C4' and segi a) (resi 17 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 18 and name C1' and segi a) (resi 18 and name C2' and segi a)
     (resi 18 and name C3' and segi a) (resi 18 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 18 and name C1' and segi a) (resi 18 and name C2' and segi a)
     (resi 18 and name C3' and segi a) (resi 18 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 18 and name C2' and segi a) (resi 18 and name C3' and segi a)
     (resi 18 and name C4' and segi a) (resi 18 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 18 and name C3' and segi a) (resi 18 and name C4' and segi a)
     (resi 18 and name O4' and segi a) (resi 18 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 18 and name C4' and segi a) (resi 18 and name O4' and segi a)
     (resi 18 and name C1' and segi a) (resi 18 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 18 and name O4' and segi a) (resi 18 and name C1' and segi a)
     (resi 18 and name C2' and segi a) (resi 18 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 18 and name O3' and segi a) (resi 18 and name C3' and segi a)
     (resi 18 and name C4' and segi a) (resi 18 and name C5' and segi a) 25.0  80.4 20.7 2 ! C31

assi (resi 19 and name C1' and segi a) (resi 19 and name C2' and segi a)
     (resi 19 and name C3' and segi a) (resi 19 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 19 and name C1' and segi a) (resi 19 and name C2' and segi a)
     (resi 19 and name C3' and segi a) (resi 19 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 19 and name C2' and segi a) (resi 19 and name C3' and segi a)
     (resi 19 and name C4' and segi a) (resi 19 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 19 and name C3' and segi a) (resi 19 and name C4' and segi a)
     (resi 19 and name O4' and segi a) (resi 19 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 19 and name C4' and segi a) (resi 19 and name O4' and segi a)
     (resi 19 and name C1' and segi a) (resi 19 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 19 and name O4' and segi a) (resi 19 and name C1' and segi a)
     (resi 19 and name C2' and segi a) (resi 19 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 19 and name O3' and segi a) (resi 19 and name C3' and segi a)
     (resi 19 and name C4' and segi a) (resi 19 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 20 and name C1' and segi a) (resi 20 and name C2' and segi a)
     (resi 20 and name C3' and segi a) (resi 20 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 20 and name C1' and segi a) (resi 20 and name C2' and segi a)
     (resi 20 and name C3' and segi a) (resi 20 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 20 and name C2' and segi a) (resi 20 and name C3' and segi a)
     (resi 20 and name C4' and segi a) (resi 20 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 20 and name C3' and segi a) (resi 20 and name C4' and segi a)
     (resi 20 and name O4' and segi a) (resi 20 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 20 and name C4' and segi a) (resi 20 and name O4' and segi a)
     (resi 20 and name C1' and segi a) (resi 20 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 20 and name O4' and segi a) (resi 20 and name C1' and segi a)
     (resi 20 and name C2' and segi a) (resi 20 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 20 and name O3' and segi a) (resi 20 and name C3' and segi a)
     (resi 20 and name C4' and segi a) (resi 20 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 25 and name C1' and segi a) (resi 25 and name C2' and segi a)
     (resi 25 and name C3' and segi a) (resi 25 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 25 and name C1' and segi a) (resi 25 and name C2' and segi a)
     (resi 25 and name C3' and segi a) (resi 25 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 25 and name C2' and segi a) (resi 25 and name C3' and segi a)
     (resi 25 and name C4' and segi a) (resi 25 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 25 and name C3' and segi a) (resi 25 and name C4' and segi a)
     (resi 25 and name O4' and segi a) (resi 25 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 25 and name C4' and segi a) (resi 25 and name O4' and segi a)
     (resi 25 and name C1' and segi a) (resi 25 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 25 and name O4' and segi a) (resi 25 and name C1' and segi a)
     (resi 25 and name C2' and segi a) (resi 25 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 25 and name O3' and segi a) (resi 25 and name C3' and segi a)
     (resi 25 and name C4' and segi a) (resi 25 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 26 and name C1' and segi a) (resi 26 and name C2' and segi a)
     (resi 26 and name C3' and segi a) (resi 26 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 26 and name C1' and segi a) (resi 26 and name C2' and segi a)
     (resi 26 and name C3' and segi a) (resi 26 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 26 and name C2' and segi a) (resi 26 and name C3' and segi a)
     (resi 26 and name C4' and segi a) (resi 26 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 26 and name C3' and segi a) (resi 26 and name C4' and segi a)
     (resi 26 and name O4' and segi a) (resi 26 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 26 and name C4' and segi a) (resi 26 and name O4' and segi a)
     (resi 26 and name C1' and segi a) (resi 26 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 26 and name O4' and segi a) (resi 26 and name C1' and segi a)
     (resi 26 and name C2' and segi a) (resi 26 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 26 and name O3' and segi a) (resi 26 and name C3' and segi a)
     (resi 26 and name C4' and segi a) (resi 26 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 27 and name C1' and segi a) (resi 27 and name C2' and segi a)
     (resi 27 and name C3' and segi a) (resi 27 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 27 and name C1' and segi a) (resi 27 and name C2' and segi a)
     (resi 27 and name C3' and segi a) (resi 27 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 27 and name C2' and segi a) (resi 27 and name C3' and segi a)
     (resi 27 and name C4' and segi a) (resi 27 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 27 and name C3' and segi a) (resi 27 and name C4' and segi a)
     (resi 27 and name O4' and segi a) (resi 27 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 27 and name C4' and segi a) (resi 27 and name O4' and segi a)
     (resi 27 and name C1' and segi a) (resi 27 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 27 and name O4' and segi a) (resi 27 and name C1' and segi a)
     (resi 27 and name C2' and segi a) (resi 27 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 27 and name O3' and segi a) (resi 27 and name C3' and segi a)
     (resi 27 and name C4' and segi a) (resi 27 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 28 and name C1' and segi a) (resi 28 and name C2' and segi a)
     (resi 28 and name C3' and segi a) (resi 28 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 28 and name C1' and segi a) (resi 28 and name C2' and segi a)
     (resi 28 and name C3' and segi a) (resi 28 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 28 and name C2' and segi a) (resi 28 and name C3' and segi a)
     (resi 28 and name C4' and segi a) (resi 28 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 28 and name C3' and segi a) (resi 28 and name C4' and segi a)
     (resi 28 and name O4' and segi a) (resi 28 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 28 and name C4' and segi a) (resi 28 and name O4' and segi a)
     (resi 28 and name C1' and segi a) (resi 28 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 28 and name O4' and segi a) (resi 28 and name C1' and segi a)
     (resi 28 and name C2' and segi a) (resi 28 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 28 and name O3' and segi a) (resi 28 and name C3' and segi a)
     (resi 28 and name C4' and segi a) (resi 28 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 29 and name C1' and segi a) (resi 29 and name C2' and segi a)
     (resi 29 and name C3' and segi a) (resi 29 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 29 and name C1' and segi a) (resi 29 and name C2' and segi a)
     (resi 29 and name C3' and segi a) (resi 29 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 29 and name C2' and segi a) (resi 29 and name C3' and segi a)
     (resi 29 and name C4' and segi a) (resi 29 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 29 and name C3' and segi a) (resi 29 and name C4' and segi a)
     (resi 29 and name O4' and segi a) (resi 29 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 29 and name C4' and segi a) (resi 29 and name O4' and segi a)
     (resi 29 and name C1' and segi a) (resi 29 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 29 and name O4' and segi a) (resi 29 and name C1' and segi a)
     (resi 29 and name C2' and segi a) (resi 29 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 29 and name O3' and segi a) (resi 29 and name C3' and segi a)
     (resi 29 and name C4' and segi a) (resi 29 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 30 and name C1' and segi a) (resi 30 and name C2' and segi a)
     (resi 30 and name C3' and segi a) (resi 30 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 30 and name C1' and segi a) (resi 30 and name C2' and segi a)
     (resi 30 and name C3' and segi a) (resi 30 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 30 and name C2' and segi a) (resi 30 and name C3' and segi a)
     (resi 30 and name C4' and segi a) (resi 30 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 30 and name C3' and segi a) (resi 30 and name C4' and segi a)
     (resi 30 and name O4' and segi a) (resi 30 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 30 and name C4' and segi a) (resi 30 and name O4' and segi a)
     (resi 30 and name C1' and segi a) (resi 30 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 30 and name O4' and segi a) (resi 30 and name C1' and segi a)
     (resi 30 and name C2' and segi a) (resi 30 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 30 and name O3' and segi a) (resi 30 and name C3' and segi a)
     (resi 30 and name C4' and segi a) (resi 30 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3

assi (resi 31 and name C1' and segi a) (resi 31 and name C2' and segi a)
     (resi 31 and name C3' and segi a) (resi 31 and name C4' and segi a) 25.0  39.5 15.1 2 ! C3
assi (resi 31 and name C1' and segi a) (resi 31 and name C2' and segi a)
     (resi 31 and name C3' and segi a) (resi 31 and name O3' and segi a) 25.0 159.2 15.6 2 ! C3
assi (resi 31 and name C2' and segi a) (resi 31 and name C3' and segi a)
     (resi 31 and name C4' and segi a) (resi 31 and name O4' and segi a) 25.0 320.3 17.8 2 ! C3
assi (resi 31 and name C3' and segi a) (resi 31 and name C4' and segi a)
     (resi 31 and name O4' and segi a) (resi 31 and name C1' and segi a) 25.0  24.2 20.8 2 ! C3
assi (resi 31 and name C4' and segi a) (resi 31 and name O4' and segi a)
     (resi 31 and name C1' and segi a) (resi 31 and name C2' and segi a) 25.0   1.4 20.1 2 ! C3
assi (resi 31 and name O4' and segi a) (resi 31 and name C1' and segi a)
     (resi 31 and name C2' and segi a) (resi 31 and name C3' and segi a) 25.0 -26.1 16.4 2 ! C3
assi (resi 31 and name O3' and segi a) (resi 31 and name C3' and segi a)
     (resi 31 and name C4' and segi a) (resi 31 and name C5' and segi a) 25.0  80.4 20.7 2 ! C3
!
!  Torsion angle restraints for sugar pucker in the 
! GZ33 - Theophylline RNA complex
!   GRZ  09/17/96
!
!  Pucker is defined with ribose torsion angles nu1 and nu2.
!  nu1 = O4'-C1'-C2'-C3'
!  nu2 = C1'-C2'-C3'-C4'
! "N" C3' endo:
!  nu1 = -20 +/- 10
!  nu2 = +35 +/-  5
! "S" C2' endo:
!  nu1 = +35 +/-  5
!  nu2 = -35 +/-  5
! See Saenger page 20.
!
!  C2' endo nucleotides:
!
! Ade 7
assign (resid 7 and name c5') (resid 7 and name c4')
       (resid 7 and name c3') (resid 7 and name o3') 1.0 145.0 20.0 2

{
assign (resid  7 and name O4')
       (resid  7 and name C1')
       (resid  7 and name C2')
       (resid  7 and name C3') 1.0  35.0  5.0 2
assign (resid  7 and name C1')
       (resid  7 and name C2')
       (resid  7 and name C3')
       (resid  7 and name C4') 1.0 -35.0  5.0 2
}
! Cyt 22
{
assign (resid 22 and name O4')
       (resid 22 and name C1')
       (resid 22 and name C2')
       (resid 22 and name C3') 1.0  35.0  5.0 2
assign (resid 22 and name C1')
       (resid 22 and name C2')
       (resid 22 and name C3')
       (resid 22 and name C4') 1.0 -35.0  5.0 2
}
assign (resid 22 and name c5') (resid 22 and name c4')
       (resid 22 and name c3') (resid 22 and name o3') 1.0 145.0 20.0 2

!
! Uri 23
assign (resid 23 and name c5') (resid 23 and name c4')
       (resid 23 and name c3') (resid 23 and name o3') 1.0 145.0 20.0 2

{
assign (resid 23 and name O4')
       (resid 23 and name C1')
       (resid 23 and name C2')
       (resid 23 and name C3') 1.0  35.0  5.0 2
assign (resid 23 and name C1')
       (resid 23 and name C2')
       (resid 23 and name C3')
       (resid 23 and name C4') 1.0 -35.0  5.0 2
}
!
! Uri 24 let this one float
{
assign (resid 24 and name O4')
       (resid 24 and name C1')
       (resid 24 and name C2')
       (resid 24 and name C3') 1.0  35.0  5.0 2
assign (resid 24 and name C1')
       (resid 24 and name C2')
       (resid 24 and name C3')
       (resid 24 and name C4') 1.0 -35.0  5.0 2
}
!assign (resid 24 and name c5') (resid 24 and name c4')
!       (resid 24 and name c3') (resid 24 and name o3') 1.0 145.0 20.0 2

!
! Gua 26
{
assign (resid 26 and name O4')
       (resid 26 and name C1')
       (resid 26 and name C2')
       (resid 26 and name C3') 1.0  35.0  5.0 2
assign (resid 26 and name C1')
       (resid 26 and name C2')
       (resid 26 and name C3')
       (resid 26 and name C4') 1.0 -35.0  5.0 2
}
assign (resid 26 and name c5') (resid 26 and name c4')
       (resid 26 and name c3') (resid 26 and name o3') 1.0 145.0 20.0 2

!
!  C3' endo nucleotides:  ( everybody else )
!
! Gua  1
{
assign (resid  1 and name O4')
       (resid  1 and name C1')
       (resid  1 and name C2')
       (resid  1 and name C3') 1.0 -20.0 10.0 2
assign (resid  1 and name C1')
       (resid  1 and name C2')
       (resid  1 and name C3')
       (resid  1 and name C4') 1.0  35.0 5.0 2
}
assign (resid 1 and name c5') (resid 1 and name c4')
       (resid 1 and name c3') (resid 1 and name o3') 1.0 80.0 20.0 2
!
! Gua  2
{
assign (resid  2 and name O4')
       (resid  2 and name C1')
       (resid  2 and name C2')
       (resid  2 and name C3') 1.0 -20.0 10.0 2
assign (resid  2 and name C1')
       (resid  2 and name C2')
       (resid  2 and name C3')
       (resid  2 and name C4') 1.0  35.0 5.0 2
}
assign (resid 2 and name c5') (resid 2 and name c4')
       (resid 2 and name c3') (resid 2 and name o3') 1.0 80.0 20.0 2

!
! Cyt  3
{
assign (resid  3 and name O4')
       (resid  3 and name C1')
       (resid  3 and name C2')
       (resid  3 and name C3') 1.0 -20.0 10.0 2
assign (resid  3 and name C1')
       (resid  3 and name C2')
       (resid  3 and name C3')
       (resid  3 and name C4') 1.0  35.0 5.0 2
}
assign (resid 3 and name c5') (resid 3 and name c4')
       (resid 3 and name c3') (resid 3 and name o3') 1.0 80.0 20.0 2

!
! Gua  4
{
assign (resid  4 and name O4')
       (resid  4 and name C1')
       (resid  4 and name C2')
       (resid  4 and name C3') 1.0 -20.0 10.0 2
assign (resid  4 and name C1')
       (resid  4 and name C2')
       (resid  4 and name C3')
       (resid  4 and name C4') 1.0  35.0 5.0 2
}
assign (resid 4 and name c5') (resid 4 and name c4')
       (resid 4 and name c3') (resid 4 and name o3') 1.0 80.0 20.0 2

!
! Ade  5
{
assign (resid  5 and name O4')
       (resid  5 and name C1')
       (resid  5 and name C2')
       (resid  5 and name C3') 1.0 -20.0 10.0 2
assign (resid  5 and name C1')
       (resid  5 and name C2')
       (resid  5 and name C3')
       (resid  5 and name C4') 1.0  35.0 5.0 2
}
assign (resid 5 and name c5') (resid 5 and name c4')
       (resid 5 and name c3') (resid 5 and name o3') 1.0 80.0 20.0 2

! Uri  6
{
assign (resid  6 and name O4')
       (resid  6 and name C1')
       (resid  6 and name C2')
       (resid  6 and name C3') 1.0 -20.0 10.0 2
assign (resid  6 and name C1')
       (resid  6 and name C2')
       (resid  6 and name C3')
       (resid  6 and name C4') 1.0  35.0 5.0 2
}
assign (resid 6 and name c5') (resid 6 and name c4')
       (resid 6 and name c3') (resid 6 and name o3') 1.0 80.0 20.0 2

!
! Ade  7  is 2' endo
!
! Cyt  8
{
assign (resid  8 and name O4')
       (resid  8 and name C1')
       (resid  8 and name C2')
       (resid  8 and name C3') 1.0 -20.0 10.0 2
assign (resid  8 and name C1')
       (resid  8 and name C2')
       (resid  8 and name C3')
       (resid  8 and name C4') 1.0  35.0 5.0 2
}
assign (resid 8 and name c5') (resid 8 and name c4')
       (resid 8 and name c3') (resid 8 and name o3') 1.0 80.0 20.0 2

!
! Cyt  9
{
assign (resid  9 and name O4')
       (resid  9 and name C1')
       (resid  9 and name C2')
       (resid  9 and name C3') 1.0 -20.0 10.0 2
assign (resid  9 and name C1')
       (resid  9 and name C2')
       (resid  9 and name C3')
       (resid  9 and name C4') 1.0  35.0 5.0 2
}
assign (resid 9 and name c5') (resid 9 and name c4')
       (resid 9 and name c3') (resid 9 and name o3') 1.0 80.0 20.0 2

!
! Ade 10
{
assign (resid 10 and name O4')
       (resid 10 and name C1')
       (resid 10 and name C2')
       (resid 10 and name C3') 1.0 -20.0 10.0 2
assign (resid 10 and name C1')
       (resid 10 and name C2')
       (resid 10 and name C3')
       (resid 10 and name C4') 1.0  35.0 5.0 2
}
assign (resid 10 and name c5') (resid 10 and name c4')
       (resid 10 and name c3') (resid 10 and name o3') 1.0 80.0 20.0 2

!
! Gua 11
{
assign (resid 11 and name O4')
       (resid 11 and name C1')
       (resid 11 and name C2')
       (resid 11 and name C3') 1.0 -20.0 10.0 2
assign (resid 11 and name C1')
       (resid 11 and name C2')
       (resid 11 and name C3')
       (resid 11 and name C4') 1.0  35.0 5.0 2
}
assign (resid 11 and name c5') (resid 11 and name c4')
       (resid 11 and name c3') (resid 11 and name o3') 1.0 80.0 20.0 2

!
! Cyt 12
{
assign (resid 12 and name O4')
       (resid 12 and name C1')
       (resid 12 and name C2')
       (resid 12 and name C3') 1.0 -20.0 10.0 2
assign (resid 12 and name C1')
       (resid 12 and name C2')
       (resid 12 and name C3')
       (resid 12 and name C4') 1.0  35.0 5.0 2
}
assign (resid 12 and name c5') (resid 12 and name c4')
       (resid 12 and name c3') (resid 12 and name o3') 1.0 80.0 20.0 2

! Cyt 13
{
assign (resid 13 and name O4')
       (resid 13 and name C1')
       (resid 13 and name C2')
       (resid 13 and name C3') 1.0 -20.0 10.0 2
assign (resid 13 and name C1')
       (resid 13 and name C2')
       (resid 13 and name C3')
       (resid 13 and name C4') 1.0  35.0 5.0 2
}
assign (resid 13 and name c5') (resid 13 and name c4')
       (resid 13 and name c3') (resid 13 and name o3') 1.0 80.0 20.0 2

!
! Gua 14
{
assign (resid 14 and name O4')
       (resid 14 and name C1')
       (resid 14 and name C2')
       (resid 14 and name C3') 1.0 -20.0 10.0 2
assign (resid 14 and name C1')
       (resid 14 and name C2')
       (resid 14 and name C3')
       (resid 14 and name C4') 1.0  35.0 5.0 2
}
assign (resid 14 and name c5') (resid 14 and name c4')
       (resid 14 and name c3') (resid 14 and name o3') 1.0 80.0 20.0 2

!
! Ade 15
{
assign (resid 15 and name O4')
       (resid 15 and name C1')
       (resid 15 and name C2')
       (resid 15 and name C3') 1.0 -20.0 10.0 2
assign (resid 15 and name C1')
       (resid 15 and name C2')
       (resid 15 and name C3')
       (resid 15 and name C4') 1.0  35.0 5.0 2
}
assign (resid 15 and name c5') (resid 15 and name c4')
       (resid 15 and name c3') (resid 15 and name o3') 1.0 80.0 20.0 2
!
! Ade 16
{
assign (resid 16 and name O4')
       (resid 16 and name C1')
       (resid 16 and name C2')
       (resid 16 and name C3') 1.0 -20.0 10.0 2
assign (resid 16 and name C1')
       (resid 16 and name C2')
       (resid 16 and name C3')
       (resid 16 and name C4') 1.0  35.0 5.0 2
}
assign (resid 16 and name c5') (resid 16 and name c4')
       (resid 16 and name c3') (resid 16 and name o3') 1.0 80.0 20.0 2

! Ade 17
{
assign (resid 17 and name O4')
       (resid 17 and name C1')
       (resid 17 and name C2')
       (resid 17 and name C3') 1.0 -20.0 10.0 2
assign (resid 17 and name C1')
       (resid 17 and name C2')
       (resid 17 and name C3')
       (resid 17 and name C4') 1.0  35.0 5.0 2
}
assign (resid 17 and name c5') (resid 17 and name c4')
       (resid 17 and name c3') (resid 17 and name o3') 1.0 80.0 20.0 2

!
! Gua 18
{
assign (resid 18 and name O4')
       (resid 18 and name C1')
       (resid 18 and name C2')
       (resid 18 and name C3') 1.0 -20.0 10.0 2
assign (resid 18 and name C1')
       (resid 18 and name C2')
       (resid 18 and name C3')
       (resid 18 and name C4') 1.0  35.0 5.0 2
}
assign (resid 18 and name c5') (resid 18 and name c4')
       (resid 18 and name c3') (resid 18 and name o3') 1.0 80.0 20.0 2

! Gua 19
{
assign (resid 19 and name O4')
       (resid 19 and name C1')
       (resid 19 and name C2')
       (resid 19 and name C3') 1.0 -20.0 10.0 2
assign (resid 19 and name C1')
       (resid 19 and name C2')
       (resid 19 and name C3')
       (resid 19 and name C4') 1.0  35.0 5.0 2
}
assign (resid 19 and name c5') (resid 19 and name c4')
       (resid 19 and name c3') (resid 19 and name o3') 1.0 80.0 20.0 2

!
! Cyt 20
{
assign (resid 20 and name O4')
       (resid 20 and name C1')
       (resid 20 and name C2')
       (resid 20 and name C3') 1.0 -20.0 10.0 2
assign (resid 20 and name C1')
       (resid 20 and name C2')
       (resid 20 and name C3')
       (resid 20 and name C4') 1.0  35.0 5.0 2
}
assign (resid 20 and name c5') (resid 20 and name c4')
       (resid 20 and name c3') (resid 20 and name o3') 1.0 80.0 20.0 2

!
! Cyt 21
{
assign (resid 21 and name O4')
       (resid 21 and name C1')
       (resid 21 and name C2')
       (resid 21 and name C3') 1.0 -20.0 10.0 2
assign (resid 21 and name C1')
       (resid 21 and name C2')
       (resid 21 and name C3')
       (resid 21 and name C4') 1.0  35.0 5.0 2
}
assign (resid 21 and name c5') (resid 21 and name c4')
       (resid 21 and name c3') (resid 21 and name o3') 1.0 80.0 20.0 2

!
! Cyt 22 is c2' endo
! Uri 23 is c2' endo
! Uri 24 is c2' endo
!
! Gua 25
{
assign (resid 25 and name O4')
       (resid 25 and name C1')
       (resid 25 and name C2')
       (resid 25 and name C3') 1.0 -20.0 10.0 2
assign (resid 25 and name C1')
       (resid 25 and name C2')
       (resid 25 and name C3')
       (resid 25 and name C4') 1.0  35.0 5.0 2
}
assign (resid 25 and name c5') (resid 25 and name c4')
       (resid 25 and name c3') (resid 25 and name o3') 1.0 80.0 20.0 2
!
! Gua 26 is c2' endo
! Cyt 27 is c2' endo
!  but is probably averaged.  Left unrestrained
!
! Ade 28
{
assign (resid 28 and name O4')
       (resid 28 and name C1')
       (resid 28 and name C2')
       (resid 28 and name C3') 1.0 -20.0 10.0 2
assign (resid 28 and name C1')
       (resid 28 and name C2')
       (resid 28 and name C3')
       (resid 28 and name C4') 1.0  35.0 5.0 2
}
assign (resid 28 and name c5') (resid 28 and name c4')
       (resid 28 and name c3') (resid 28 and name o3') 1.0 80.0 20.0 2

!
! Gua 29
{
assign (resid 29 and name O4')
       (resid 29 and name C1')
       (resid 29 and name C2')
       (resid 29 and name C3') 1.0 -20.0 10.0 2
assign (resid 29 and name C1')
       (resid 29 and name C2')
       (resid 29 and name C3')
       (resid 29 and name C4') 1.0  35.0 5.0 2
}
assign (resid 29 and name c5') (resid 29 and name c4')
       (resid 29 and name c3') (resid 29 and name o3') 1.0 80.0 20.0 2

!
! Cyt 30
{
assign (resid 30 and name O4')
       (resid 30 and name C1')
       (resid 30 and name C2')
       (resid 30 and name C3') 1.0 -20.0 10.0 2
assign (resid 30 and name C1')
       (resid 30 and name C2')
       (resid 30 and name C3')
       (resid 30 and name C4') 1.0  35.0 5.0 2
}
assign (resid 30 and name c5') (resid 30 and name c4')
       (resid 30 and name c3') (resid 30 and name o3') 1.0 80.0 20.0 2

!
! Gua 31
{
assign (resid 31 and name O4')
       (resid 31 and name C1')
       (resid 31 and name C2')
       (resid 31 and name C3') 1.0 -20.0 10.0 2
assign (resid 31 and name C1')
       (resid 31 and name C2')
       (resid 31 and name C3')
       (resid 31 and name C4') 1.0  35.0 5.0 2
}
assign (resid 31 and name c5') (resid 31 and name c4')
       (resid 31 and name c3') (resid 31 and name o3') 1.0 80.0 20.0 2

!
! Uri 32
{
assign (resid 32 and name O4')
       (resid 32 and name C1')
       (resid 32 and name C2')
       (resid 32 and name C3') 1.0 -20.0 10.0 2
assign (resid 32 and name C1')
       (resid 32 and name C2')
       (resid 32 and name C3')
       (resid 32 and name C4') 1.0  35.0 5.0 2
}
assign (resid 32 and name c5') (resid 32 and name c4')
       (resid 32 and name c3') (resid 32 and name o3') 1.0 80.0 20.0 2
!
! Cyt 33
{
assign (resid 33 and name O4')
       (resid 33 and name C1')
       (resid 33 and name C2')
       (resid 33 and name C3') 1.0 -20.0 10.0 2
assign (resid 33 and name C1')
       (resid 33 and name C2')
       (resid 33 and name C3')
       (resid 33 and name C4') 1.0  35.0 5.0 2
}
assign (resid 33 and name c5') (resid 33 and name c4')
       (resid 33 and name c3') (resid 33 and name o3') 1.0 80.0 20.0 2

!
!
!  Torsion angle restraints for the xhi torsion angle in the
!       GZ33 - Theophylline RNA complex.
!
!  Xhi is defined as follows...
!               Purines     = O4'-C1'-N9-C4
!               Pyrimidines = O4'-C1'-N1-C2
! Anti:
!  Xhi = 180.0 +/- 90.0
!   including high-anti and excluding high-syn:
!  Xhi = -150.0 +/- 90.0
! Syn:
!  Xhi =   0.0 +/- 90.0
!       See Saenger page 22.
!
!  There are no syn bases in the GZ33-Theophylline complex.
!     No large H1'-Haro nOes were observed, and large H3'-Haro
!     (or H2'-Haro) were observed for all nucleotides.
!
assign (resid  1 and name O4') (resid  1 and name C1')
       (resid  1 and name N9 )
       (resid  1 and name C4 ) 1.0 -150.0 90.0 2
assign (resid  2 and name O4') (resid  2 and name C1')
       (resid  2 and name N9 )
       (resid  2 and name C4 ) 1.0 -150.0 90.0 2
assign (resid  3 and name O4') (resid  3 and name C1')
       (resid  3 and name N1 )
       (resid  3 and name C2 ) 1.0 -150.0 90.0 2
assign (resid  4 and name O4') (resid  4 and name C1')
       (resid  4 and name N9 )
       (resid  4 and name C4 ) 1.0 -150.0 90.0 2
assign (resid  5 and name O4') (resid  5 and name C1')
       (resid  5 and name N9 )
       (resid  5 and name C4 ) 1.0 -150.0 90.0 2
assign (resid  6 and name O4') (resid  6 and name C1')
       (resid  6 and name N1 )
       (resid  6 and name C2 ) 1.0 -150.0 90.0 2
assign (resid  7 and name O4') (resid  7 and name C1')
       (resid  7 and name N9 )
       (resid  7 and name C4 ) 1.0 -150.0 90.0 2
assign (resid  8 and name O4') (resid  8 and name C1')
       (resid  8 and name N1 )
       (resid  8 and name C2 ) 1.0 -150.0 90.0 2
assign (resid  9 and name O4') (resid  9 and name C1')
       (resid  9 and name N1 )
       (resid  9 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 10 and name O4') (resid 10 and name C1')
       (resid 10 and name N9 )
       (resid 10 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 11 and name O4') (resid 11 and name C1')
       (resid 11 and name N9 )
       (resid 11 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 12 and name O4') (resid 12 and name C1')
       (resid 12 and name N1 )
       (resid 12 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 13 and name O4') (resid 13 and name C1')
       (resid 13 and name N1 )
       (resid 13 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 14 and name O4') (resid 14 and name C1')
       (resid 14 and name N9 )
       (resid 14 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 15 and name O4') (resid 15 and name C1')
       (resid 15 and name N9 )
       (resid 15 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 16 and name O4') (resid 16 and name C1')
       (resid 16 and name N9 )
       (resid 16 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 17 and name O4') (resid 17 and name C1')
       (resid 17 and name N9 )
       (resid 17 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 18 and name O4') (resid 18 and name C1')
       (resid 18 and name N9 )
       (resid 18 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 19 and name O4') (resid 19 and name C1')
       (resid 19 and name N9 )
       (resid 19 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 20 and name O4') (resid 20 and name C1')
       (resid 20 and name N1 )
       (resid 20 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 21 and name O4') (resid 21 and name C1')
       (resid 21 and name N1 )
       (resid 21 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 22 and name O4') (resid 22 and name C1')
       (resid 22 and name N1 )
       (resid 22 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 23 and name O4') (resid 23 and name C1')
       (resid 23 and name N1 )
       (resid 23 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 24 and name O4') (resid 24 and name C1')
       (resid 24 and name N1 )
       (resid 24 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 25 and name O4') (resid 25 and name C1')
       (resid 25 and name N9 )
       (resid 25 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 26 and name O4') (resid 26 and name C1')
       (resid 26 and name N9 )
       (resid 26 and name C4 ) 1.0 -150.0 90.0 2
!  Cyt 27 left unrestrained ( likely averaged ).
assign (resid 28 and name O4') (resid 28 and name C1')
       (resid 28 and name N9 )
       (resid 28 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 29 and name O4') (resid 29 and name C1')
       (resid 29 and name N9 )
       (resid 29 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 30 and name O4') (resid 30 and name C1')
       (resid 30 and name N1 )
       (resid 30 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 31 and name O4') (resid 31 and name C1')
       (resid 31 and name N9 )
       (resid 31 and name C4 ) 1.0 -150.0 90.0 2
assign (resid 32 and name O4') (resid 32 and name C1')
       (resid 32 and name N1 )
       (resid 32 and name C2 ) 1.0 -150.0 90.0 2
assign (resid 33 and name O4') (resid 33 and name C1')
       (resid 33 and name N1 )
       (resid 33 and name C2 ) 1.0 -150.0 90.0 2
!
assign (resid 27 and name O4') (resid 27 and name C1')
       (resid 27 and name N1 )
       (resid 27 and name C2 ) 1.0 -150.0 90.0 2







!DNA
!dihedral restraints on epsilon, zeta, alpha, beta

!!1
assign  (resid  1 and name  c4') (resid  1 and name  c3')
        (resid  1 and name  o3') (resid  2 and name   p ) 1.0 -160.0 50.0 2
assign  (resid  1 and name  c3') (resid  1 and name  o3')
        (resid  2 and name   p ) (resid  2 and name  o5') 1.0 -70.0 50.0 2

!!2
assign  (resid  1 and name  o3') (resid  2 and name   p )
        (resid  2 and name  o5') (resid  2 and name  c5') 1.0 -60.0 40.0 2
assign  (resid  2 and name   p ) (resid  2 and name  o5')
        (resid  2 and name  c5') (resid  2 and name  c4') 1.0 180.0 50.0 2
assign  (resid  2 and name  c4') (resid  2 and name  c3')
        (resid  2 and name  o3') (resid  3 and name   p ) 1.0 -160.0 50.0 2
assign  (resid  2 and name  c3') (resid  2 and name  o3')
        (resid  3 and name   p ) (resid  3 and name  o5') 1.0 -70.0 50.0 2

!!3
assign  (resid  2 and name  o3') (resid  3 and name   p )
        (resid  3 and name  o5') (resid  3 and name  c5') 1.0 -60.0 40.0 2
assign  (resid  3 and name   p ) (resid  3 and name  o5')
        (resid  3 and name  c5') (resid  3 and name  c4') 1.0 180.0 50.0 2
assign  (resid  3 and name  c4') (resid  3 and name  c3')
        (resid  3 and name  o3') (resid  4 and name   p ) 1.0 -160.0 50.0 2
assign  (resid  3 and name  c3') (resid  3 and name  o3')
        (resid  4 and name   p ) (resid  4 and name  o5') 1.0 -70.0 50.0 2

!!4
assign  (resid  3 and name  o3') (resid  4 and name   p )
        (resid  4 and name  o5') (resid  4 and name  c5') 1.0 -60.0 40.0 2
assign  (resid  4 and name   p ) (resid  4 and name  o5')
        (resid  4 and name  c5') (resid  4 and name  c4') 1.0 180.0 50.0 2
assign  (resid  4 and name  c4') (resid  4 and name  c3')
        (resid  4 and name  o3') (resid  5 and name   p ) 1.0 -160.0 50.0 2
assign  (resid  4 and name  c3') (resid  4 and name  o3')
        (resid  5 and name   p ) (resid  5 and name  o5') 1.0 -70.0 50.0 2

!!5
assign  (resid  4 and name  o3') (resid  5 and name   p )
        (resid  5 and name  o5') (resid  5 and name  c5') 1.0 -60.0 40.0 2
assign  (resid  5 and name   p ) (resid  5 and name  o5')
        (resid  5 and name  c5') (resid  5 and name  c4') 1.0 180.0 50.0 2
assign  (resid  5 and name  c4') (resid  5 and name  c3')
        (resid  5 and name  o3') (resid  6 and name   p ) 1.0 -160.0 50.0 2
assign  (resid  5 and name  c3') (resid  5 and name  o3')
        (resid  6 and name   p ) (resid  6 and name  o5') 1.0 -70.0 50.0 2



!!29
assign  (resid  28 and name  o3') (resid  29 and name   p )
        (resid  29 and name  o5') (resid  29 and name  c5') 1.0 -60.0 40.0 2
assign  (resid  29 and name   p ) (resid  29 and name  o5')
        (resid  29 and name  c5') (resid  29 and name  c4') 1.0 180.0 50.0 2
assign  (resid  29 and name  c4') (resid  29 and name  c3')
        (resid  29 and name  o3') (resid  30 and name   p ) 1.0 -160.0 50.0 2
assign  (resid  29 and name  c3') (resid  29 and name  o3')
        (resid  30 and name   p ) (resid  30 and name  o5') 1.0 -70.0 50.0 2


!!30
assign  (resid  29 and name  o3') (resid  30 and name   p )
        (resid  30 and name  o5') (resid  30 and name  c5') 1.0 -60.0 40.0 2
assign  (resid  30 and name   p ) (resid  30 and name  o5')
        (resid  30 and name  c5') (resid  30 and name  c4') 1.0 180.0 50.0 2
assign  (resid  30 and name  c4') (resid  30 and name  c3')
        (resid  30 and name  o3') (resid  31 and name   p ) 1.0 -160.0 50.0 2
assign  (resid  30 and name  c3') (resid  30 and name  o3')
        (resid  31 and name   p ) (resid  31 and name  o5') 1.0 -70.0 50.0 2

!!31
assign  (resid  30 and name  o3') (resid  31 and name   p )
        (resid  31 and name  o5') (resid  31 and name  c5') 1.0 -60.0 40.0 2
assign  (resid  31 and name   p ) (resid  31 and name  o5')
        (resid  31 and name  c5') (resid  31 and name  c4') 1.0 180.0 50.0 2
assign  (resid  31 and name  c4') (resid  31 and name  c3')
        (resid  31 and name  o3') (resid  32 and name   p ) 1.0 -160.0 50.0 2
assign  (resid  31 and name  c3') (resid  31 and name  o3')
        (resid  32 and name   p ) (resid  32 and name  o5') 1.0 -70.0 50.0 2

!!32
assign  (resid  31 and name  o3') (resid  32 and name   p )
        (resid  32 and name  o5') (resid  32 and name  c5') 1.0 -60.0 40.0 2
assign  (resid  32 and name   p ) (resid  32 and name  o5')
        (resid  32 and name  c5') (resid  32 and name  c4') 1.0 180.0 50.0 2
assign  (resid  32 and name  c4') (resid  32 and name  c3')
        (resid  32 and name  o3') (resid  33 and name   p ) 1.0 -160.0 50.0 2
assign  (resid  32 and name  c3') (resid  32 and name  o3')
        (resid  33 and name   p ) (resid  33 and name  o5') 1.0 -70.0 50.0 2

!!33
assign  (resid  32 and name  o3') (resid  33 and name   p )
        (resid  33 and name  o5') (resid  33 and name  c5') 1.0 -60.0 40.0 2
assign  (resid  33 and name   p ) (resid  33 and name  o5')
        (resid  33 and name  c5') (resid  33 and name  c4') 1.0 180.0 50.0 2




!gamma

assign (resid 1 and name o5') (resid 1 and name c5')
       (resid 1 and name c4') (resid 1 and name c3')   1.0 60.0 30.0 2
assign (resid 2 and name o5') (resid 2 and name c5')
       (resid 2 and name c4') (resid 2 and name c3')   1.0 60.0 30.0 2
assign (resid 3 and name o5') (resid 3 and name c5')
       (resid 3 and name c4') (resid 3 and name c3')   1.0 60.0 30.0 2
assign (resid 4 and name o5') (resid 4 and name c5')
       (resid 4 and name c4') (resid 4 and name c3')   1.0 60.0 30.0 2
assign (resid 5 and name o5') (resid 5 and name c5')
       (resid 5 and name c4') (resid 5 and name c3')   1.0 60.0 30.0 2
assign (resid 33 and name o5') (resid 33 and name c5')
       (resid 33 and name c4') (resid 33 and name c3')   1.0 60.0 30.0 2
assign (resid 32 and name o5') (resid 32 and name c5')
       (resid 32 and name c4') (resid 32 and name c3')   1.0 60.0 30.0 2
assign (resid 31 and name o5') (resid 31 and name c5')
       (resid 31 and name c4') (resid 31 and name c3')   1.0 60.0 30.0 2
assign (resid 30 and name o5') (resid 30 and name c5')
       (resid 30 and name c4') (resid 30 and name c3')   1.0 60.0 30.0 2
assign (resid 29 and name o5') (resid 29 and name c5')
       (resid 29 and name c4') (resid 29 and name c3')   1.0 60.0 30.0 2

! Meredith's 888 dip_30_888.tbl
! modified from dip2rand.nawk Table; Output File: dip_70.tbl
!   FractRand: 0.70;  NO-Overlap
!   SEED: 54001124
!   Mean ABS(Measure):  13.4789  Mean SumSquare: 225.0152  Count:   71
!   Date: Mon Jun 24 11:00:54 EDT 2002
!   Path: /net/octave1/clore/RNA_THEO/PAIRS/TEST
!


assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  30  and name C5    )
       ( resid  30  and name H5    )   34.4670   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid   2  and name C8    )
       ( resid   2  and name H8    )   24.9900   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid   6  and name C8    )
       ( resid   6  and name H8    )   29.7880   0.6000


assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  26  and name C6    )
       ( resid  26  and name H6    )   23.3290   0.6000

! Meredith's 888 dip_70_888.tbl
! modified from dip2rand.nawk Table; Output File: dip_70.tbl
!   FractRand: 0.70;  NO-Overlap
!   SEED: 54001124
!   Mean ABS(Measure):  13.4789  Mean SumSquare: 225.0152  Count:   71
!   Date: Mon Jun 24 11:00:54 EDT 2002
!   Path: /net/octave1/clore/RNA_THEO/PAIRS/TEST
!


assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid   5  and name C2    )
       ( resid   5  and name H2    )   27.8380   0.6000

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid   8  and name C2    )
!   ( resid   8  and name H2    )   28.7350   0.6000

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid   9  and name C5    )
!   ( resid   9  and name H5    )   -1.9660   0.6000


assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  26  and name C5    )
       ( resid  26  and name H5    )   16.4510   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  27  and name C5    )
       ( resid  27  and name H5    )   24.1700   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  29  and name C5    )
       ( resid  29  and name H5    )   31.6340   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  31  and name C5    )
       ( resid  31  and name H5    )   17.1030   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid   1  and name C8    )
       ( resid   1  and name H8    )   20.9680   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid   3  and name C8    )
       ( resid   3  and name H8    )   33.7680   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid   5  and name C8    )
       ( resid   5  and name H8    )   34.9900   0.6000

! assign ( resid 500  and name OO   )
!        ( resid 500  and name Z    )
!        ( resid 500  and name X    )
!        ( resid 500  and name Y    )
!        ( resid   7  and name C6    )
!        ( resid   7  and name H6    )   21.5770   0.6000

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid   9  and name C6    )
!   ( resid   9  and name H6    )   21.2310   0.6000


assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  27  and name C6    )
       ( resid  27  and name H6    )   33.4690   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  28  and name C6    )
       ( resid  28  and name H6    )   29.1260   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  29  and name C6    )
       ( resid  29  and name H6    )   29.3090   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  30  and name C6    )
       ( resid  30  and name H6    )   26.0230   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  31  and name C6    )
       ( resid  31  and name H6    )   19.2630   0.6000


! Meredith's 888 dip_70_888.tbl
! modified from dip2rand.nawk Table; Output File: dip_70.tbl
!   FractRand: 0.70;  NO-Overlap
!   SEED: 54001124
!   Mean ABS(Measure):  13.4789  Mean SumSquare: 225.0152  Count:   71
!   Date: Mon Jun 24 11:00:54 EDT 2002
!   Path: /net/octave1/clore/RNA_THEO/PAIRS/TEST
!

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid  17  and name C1'   )
!   ( resid  17  and name H1'   )  -5.1010    0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  13  and name C5    )
       ( resid  13  and name H5    )   29.0770   0.6000

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid  22  and name C1'   )
!   ( resid  22  and name H1'   )  -26.3220   0.6000


assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  12  and name C5    )
       ( resid  12  and name H5    )   26.5430   0.6000

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid  16  and name C2    )
!   ( resid  16  and name H2    )   16.5860   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  20  and name C5    )
       ( resid  20  and name H5    )   24.1450   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  21  and name C5    )
       ( resid  21  and name H5    )   24.8400   0.6000

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid  22  and name C2    )
!   ( resid  22  and name H2    )   20.2240   0.6000

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid  23  and name C2    )
!   ( resid  23  and name H2    )   23.2080   0.6000

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid  25  and name C2    )
!   ( resid  25  and name H2    )   34.4070   0.6000



assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  10  and name C8    )
       ( resid  10  and name H8    )   32.1150   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  11  and name C8    )
       ( resid  11  and name H8    )   27.5070   0.6000

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid  15  and name C6    )
!   ( resid  15  and name H6    )    9.0380   0.6000

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid  16  and name C8    )
!   ( resid  16  and name H8    )   21.3550   0.6000

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid  17  and name C8    )
!   ( resid  17  and name H8    )   20.9640   0.6000

assign ( resid 500  and name OO   )
       ( resid 500  and name Z    )
       ( resid 500  and name X    )
       ( resid 500  and name Y    )
       ( resid  18  and name C8    )
       ( resid  18  and name H8    )   28.0210   0.6000

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid  22  and name C8    )
!   ( resid  22  and name H8    )   24.4010   0.6000

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid  23  and name C8    )
!   ( resid  23  and name H8    )   29.4920   0.6000

! assign ( resid 500  and name OO   )
!   ( resid 500  and name Z    )
!   ( resid 500  and name X    )
!   ( resid 500  and name Y    )
!   ( resid  24  and name C8    )
!   ( resid  24  and name H8    )   16.7370   0.6000

assign (resi  31 and name  N3  and segi a)
       (resi  1 and name  H1  and segi a)  1.990 0.10 0.15
assign (resi  31 and name  H41 and segi a)
       (resi  1 and name  O6  and segi a)  1.950 0.10 0.15
assign (resi  31 and name  O2  and segi a)
       (resi  1 and name  H21 and segi a)  1.950 0.10 0.15
assign (resi  31 and name  N3  and segi a)
       (resi  1 and name  N1  and segi a)  2.900 0.10 0.15
assign (resi  31 and name  N4  and segi a)
       (resi  1 and name  O6  and segi a)  2.950 0.10 0.15
assign (resi  31 and name  O2  and segi a)
       (resi  1 and name  N2  and segi a)  2.950 0.10 0.15

assign (resi  30 and name  N3  and segi a)
       (resi  2 and name  H1  and segi a)  1.990 0.10 0.15
assign (resi  30 and name  H41 and segi a)
       (resi  2 and name  O6  and segi a)  1.950 0.10 0.15
assign (resi  30 and name  O2  and segi a)
       (resi  2 and name  H21 and segi a)  1.950 0.10 0.15
assign (resi  30 and name  N3  and segi a)
       (resi  2 and name  N1  and segi a)  2.900 0.10 0.15
assign (resi  30 and name  N4  and segi a)
       (resi  2 and name  O6  and segi a)  2.950 0.10 0.15
assign (resi  30 and name  O2  and segi a)
       (resi  2 and name  N2  and segi a)  2.950 0.10 0.15

assign (resi  29 and name  N3  and segi a)
       (resi  3 and name  H1  and segi a)  1.990 0.10 0.15
assign (resi  29 and name  H41 and segi a)
       (resi  3 and name  O6  and segi a)  1.950 0.10 0.15
assign (resi  29 and name  O2  and segi a)
       (resi  3 and name  H21 and segi a)  1.950 0.10 0.15
assign (resi  29 and name  N3  and segi a)
       (resi  3 and name  N1  and segi a)  2.900 0.10 0.15
assign (resi  29 and name  N4  and segi a)
       (resi  3 and name  O6  and segi a)  2.950 0.10 0.15
assign (resi  29 and name  O2  and segi a)
       (resi  3 and name  N2  and segi a)  2.950 0.10 0.15

assign (resi  28 and name  N3  and segi a)
       (resi  4 and name  H1  and segi a)  1.990 0.10 0.15
assign (resi  28 and name  H41 and segi a)
       (resi  4 and name  O6  and segi a)  1.950 0.10 0.15
assign (resi  28 and name  O2  and segi a)
       (resi  4 and name  H21 and segi a)  1.950 0.10 0.15
assign (resi  28 and name  N3  and segi a)
       (resi  4 and name  N1  and segi a)  2.900 0.10 0.15
assign (resi  28 and name  N4  and segi a)
       (resi  4 and name  O6  and segi a)  2.950 0.10 0.15
assign (resi  28 and name  O2  and segi a)
       (resi  4 and name  N2  and segi a)  2.950 0.10 0.15

assign (resid   27 and name  H3  and segi a)
       (resid   5 and name  N1  and segi a)  1.990 0.10 0.15
assign (resid   27 and name  O4  and segi a)
       (resid   5 and name  H61 and segi a)  1.950 0.10 0.15
assign (resid   27 and name  N3  and segi a)
       (resid   5 and name  N1  and segi a)  2.900 0.10 0.15
assign (resid   27 and name  O4  and segi a)
       (resid   5 and name  N6  and segi a)  2.950 0.10 0.15

assign (resi  26 and name  N3  and segi a)
       (resi  6 and name  H1  and segi a)  1.990 0.10 0.15
assign (resi  26 and name  H41 and segi a)
       (resi  6 and name  O6  and segi a)  1.950 0.10 0.15
assign (resi  26 and name  O2  and segi a)
       (resi  6 and name  H21 and segi a)  1.950 0.10 0.15
assign (resi  26 and name  N3  and segi a)
       (resi  6 and name  N1  and segi a)  2.900 0.10 0.15
assign (resi  26 and name  N4  and segi a)
       (resi  6 and name  O6  and segi a)  2.950 0.10 0.15
assign (resi  26 and name  O2  and segi a)
       (resi  6 and name  N2  and segi a)  2.950 0.10 0.15


!  Internal loop


!  G-U Pairs -Don't restrain U905-G894, but restrain U904-G895 to a wobble pair
!  Guestimating on distances based on amino-carbonyl H-bond distances...


assign (resid   7 and name  H3  and segi a)
       (resid   25 and name  N1  and segi a)  1.990 0.10 0.15
assign (resid   7 and name  O4  and segi a)
       (resid   25 and name  H61 and segi a)  1.950 0.10 0.15
assign (resid   7 and name  N3  and segi a)
       (resid   25 and name  N1  and segi a)  2.900 0.10 0.15
assign (resid   7 and name  O4  and segi a)
       (resid   25 and name  N6  and segi a)  2.950 0.10 0.15

assign (resid   21 and name  H3  and segi a)
       (resid   10 and name  O6  and segi a)  1.950 0.10 0.15
assign (resid   21 and name  O2  and segi a)
       (resid   10 and name  H1  and segi a)  1.950 0.10 0.15
assign (resid   21 and name  N3  and segi a)
       (resid   10 and name  O6  and segi a)  2.950 0.10 0.15
assign (resid   21 and name  O2  and segi a)
       (resid   10 and name  N1  and segi a)  2.950 0.10 0.15


assign (resid   20 and name  H3  and segi a)
       (resid   11 and name  O6  and segi a)  1.950 0.10 0.15
assign (resid   20 and name  O2  and segi a)
       (resid   11 and name  H1  and segi a)  1.950 0.10 0.15
assign (resid   20 and name  N3  and segi a)
       (resid   11 and name  O6  and segi a)  2.950 0.10 0.15
assign (resid   20 and name  O2  and segi a)
       (resid   11 and name  N1  and segi a)  2.950 0.10 0.15



assign (resi  12 and name  N3  and segi a)
       (resi  19 and name  H1  and segi a)  1.990 0.10 0.15
assign (resi  12 and name  H41 and segi a)
       (resi  19 and name  O6  and segi a)  1.950 0.10 0.15
assign (resi  12 and name  O2  and segi a)
       (resi  19 and name  H21 and segi a)  1.950 0.10 0.15
assign (resi  12 and name  N3  and segi a)
       (resi  19 and name  N1  and segi a)  2.900 0.10 0.15
assign (resi  12 and name  N4  and segi a)
       (resi  19 and name  O6  and segi a)  2.950 0.10 0.15
assign (resi  12 and name  O2  and segi a)
       (resi  19 and name  N2  and segi a)  2.950 0.10 0.15

assign (resi  13 and name  N3  and segi a)
       (resi  18 and name  H1  and segi a)  1.990 0.10 0.15
assign (resi  13 and name  H41 and segi a)
       (resi  18 and name  O6  and segi a)  1.950 0.10 0.15
assign (resi  13 and name  O2  and segi a)
       (resi  18 and name  H21 and segi a)  1.950 0.10 0.15
assign (resi  13 and name  N3  and segi a)
       (resi  18 and name  N1  and segi a)  2.900 0.10 0.15
assign (resi  13 and name  N4  and segi a)
       (resi  18 and name  O6  and segi a)  2.950 0.10 0.15
assign (resi  13 and name  O2  and segi a)
       (resi  18 and name  N2  and segi a)  2.950 0.10 0.15


!  Tetraloop

!  Restrain G898 and A901 to a sheared pair, 
!  & restrain H-bonds as in Jucker et al., 1996.

assign (resid  14 and name  N3  and segi a)
       (resid  17 and name H62  and segi a)  3.070 0.10 0.15
assign (resid  14 and name H22  and segi a)
       (resid  17 and name  N7  and segi a)  1.620 0.10 0.15
assign (resid  14 and name  N3  and segi a)
       (resid  17 and name  N6  and segi a)  4.070 0.10 0.15
assign (resid  14 and name  N2  and segi a)
       (resid  17 and name  N7  and segi a)  2.620 0.10 0.15

assign (resid  14 and name H21  and segi a)
       (resid  17 and name O1P  and segi a)  1.430 0.10 0.15
assign (resid  14 and name  H1  and segi a)
       (resid  17 and name O1P  and segi a)  2.480 0.10 0.15
assign (resid  14 and name  N2  and segi a)
       (resid  17 and name O1P  and segi a)  2.430 0.10 0.15
assign (resid  14 and name  N1  and segi a)
       (resid  17 and name O1P  and segi a)  3.480 0.10 0.15

assign (resid  14 and name  H2'' and segi a)
       (resid  16 and name  N7  and segi a)  1.920 0.10 0.15
assign (resid  14 and name O2'  and segi a)
       (resid  16 and name H62  and segi a)  2.740 0.10 0.15
assign (resid  14 and name O2'  and segi a)
       (resid  16 and name  N7  and segi a)  2.920 0.10 0.15
assign (resid  14 and name O2'  and segi a)
       (resid  16 and name  N6  and segi a)  3.740 0.10 0.15










! H2O (138)

!  imino-imino

assi (resi   3 and name   h1 and segi a)
     (resi   4 and name   h1 and segi a) 4.50 2.00 0.90 ! 1
assi (resi   4 and name   h1 and segi a)
     (resi  27 and name   h3 and segi a) 5.50 2.50 1.10 ! 2
assi (resi   6 and name   h1 and segi a)
     (resi  27 and name   h3 and segi a) 5.50 2.50 1.10 ! 3
assi (resi  11 and name   h1 and segi a)
     (resi  19 and name   h1 and segi a) 4.50 2.00 0.90 ! 4
assi (resi  11 and name   h1 and segi a)
     (resi  20 and name   h3 and segi a) 3.50 1.50 0.70 ! 5
assi (resi  18 and name   h1 and segi a)
     (resi  19 and name   h1 and segi a) 4.50 2.00 0.90 ! 6
assi (resi  19 and name   h1 and segi a)
     (resi  20 and name   h3 and segi a) 4.50 2.00 0.90 ! 7

!  imino-amino & imino-base

assi (resi   4 and name   h1 and segi a)
     (resi  28 and name  h41 and segi a) 3.50 1.50 0.70 ! 8
assi (resi   4 and name   h1 and segi a)
     (resi  28 and name  h42 and segi a) 3.50 1.50 0.70 ! 8
assi (resi   4 and name   h1 and segi a)
     (resi  28 and name   h5 and segi a) 4.50 2.00 0.90 ! 8
assi (resi   6 and name   h1 and segi a)
     (resi   5 and name  h61 and segi a) 4.50 2.00 0.90 ! 10
assi (resi   6 and name   h1 and segi a)
     (resi   5 and name  h62 and segi a) 4.50 2.00 0.90 ! 11
assi (resi   6 and name   h1 and segi a)
     (resi   5 and name   h2 and segi a) 5.50 2.50 1.10 ! 32
assi (resi   6 and name   h1 and segi a)
     (resi  26 and name  h41 and segi a) 2.50 1.00 0.50 ! 12
assi (resi   6 and name   h1 and segi a)
     (resi  26 and name  h42 and segi a) 3.50 1.50 0.70 ! 13
assi (resi   6 and name   h1 and segi a)
     (resi  26 and name   h5 and segi a) 4.50 2.00 0.90 ! 13
assi (resi  11 and name   h1 and segi a)
     (resi  19 and name  h22 and segi a) 4.50 2.00 0.90 ! 14
assi (resi  11 and name   h1 and segi a)
     (resi  20 and name   h5 and segi a) 5.50 2.50 1.10 ! 14
assi (resi  11 and name   h1 and segi a)
     (resi  20 and name  h1' and segi a) 4.50 2.00 0.90 ! 14
assi (resi  11 and name   h1 and segi a)
     (resi  12 and name  h1' and segi a) 5.50 2.50 1.10 ! 14
assi (resi  14 and name   h1 and segi a)
     (resi  17 and name   h8 and segi a) 5.50 2.50 1.10 ! 33
assi (resi  18 and name   h1 and segi a)
     (resi  13 and name  h41 and segi a) 3.50 1.50 0.70 ! 15
assi (resi  18 and name   h1 and segi a)
     (resi  13 and name  h42 and segi a) 3.50 1.50 0.70 ! 16
assi (resi  18 and name   h1 and segi a)
     (resi  13 and name   h5 and segi a) 4.50 2.00 0.90 ! 16
assi (resi  19 and name   h1 and segi a)
     (resi  11 and name  h21 and segi a) 4.50 2.00 0.90 ! 17
assi (resi  19 and name   h1 and segi a)
     (resi  12 and name  h41 and segi a) 2.50 1.00 0.50 ! 18
assi (resi  19 and name   h1 and segi a)
     (resi  12 and name  h42 and segi a) 4.50 2.00 0.90 ! 19
assi (resi  19 and name   h1 and segi a)
     (resi  12 and name   h5 and segi a) 5.50 2.50 1.10 ! 19
assi (resi  19 and name   h1 and segi a)
     (resi  13 and name  h42 and segi a) 5.50 2.50 1.10 ! 20
assi (resi  19 and name   h1 and segi a)
     (resi  13 and name  h41 and segi a) 4.50 2.00 0.90 ! 21
assi (resi  19 and name   h1 and segi a)
     (resi  18 and name  h22 and segi a) 4.50 2.00 0.90 ! 22
assi (resi  19 and name   h1 and segi a)
     (resi  20 and name  h1' and segi a) 4.50 2.00 0.90 ! 22
assi (resi  19 and name   h1 and segi a)
     (resi  12 and name  h1' and segi a) 4.50 2.00 0.90 ! 22
assi (resi  20 and name   h3 and segi a)
     (resi  11 and name  h21 and segi a) 4.50 2.00 0.90 ! 23
assi (resi  20 and name   h3 and segi a)
     (resi  11 and name  h22 and segi a) 4.50 2.00 0.90 ! 24
assi (resi  26 and name  h42 and segi a)
     (resi   5 and name   h2 and segi a) 4.50 2.00 0.90 ! 34
assi (resi  27 and name   h3 and segi a)
     (resi   5 and name  h61 and segi a) 3.50 1.50 0.70 ! 25
assi (resi  27 and name   h3 and segi a)
     (resi   5 and name  h62 and segi a) 3.50 1.50 0.70 ! 26
assi (resi  27 and name   h3 and segi a)
     (resi   5 and name   h2 and segi a) 2.50 1.00 0.50 ! 31
assi (resi  27 and name   h3 and segi a)
     (resi  28 and name  h41 and segi a) 4.50 2.00 0.90 ! 27
assi (resi  27 and name   h3 and segi a)
     (resi   6 and name  h1' and segi a) 4.50 2.00 0.90 ! 27
assi (resi  27 and name   h3 and segi a)
     (resi  26 and name  h42 and segi a) 4.50 2.00 0.90 ! 27
assi (resi  27 and name   h3 and segi a)
     (resi  26 and name   h5 and segi a) 4.50 2.00 0.90 ! 27

!  amino-amino

assi (resi   5 and name  h61 and segi a)
     (resi  28 and name  h42 and segi a) 3.50 1.50 0.70 ! 28
assi (resi   5 and name  h61 and segi a)
     (resi   6 and name   h8 and segi a) 5.50 2.50 1.10 ! 29
assi (resi   6 and name  h22 and segi a)
     (resi   5 and name   h2 and segi a) 3.50 1.50 0.70 ! 29
assi (resi  13 and name  h42 and segi a)
     (resi  19 and name  h22 and segi a) 3.50 1.50 0.70 ! 29
assi (resi   3 and name  h22 and segi a)
     (resi  28 and name  h42 and segi a) 4.50 2.00 0.90 ! 30
assi (resi  22 and name  h62 and segi a)
     (resi   9 and name  h6  and segi a) 4.50 2.00 0.90 ! 30



!  amino-base




! D2O

!  base-base

assi (resi   1 and name   h8 and segi a)
     (resi   2 and name   h8 and segi a) 5.50 2.50 1.10 ! 35
assi (resi   2 and name   h8 and segi a)
     (resi   3 and name   h8 and segi a) 5.50 2.50 1.10 ! 35a
assi (resi   5 and name   h8 and segi a)
     (resi   6 and name   h8 and segi a) 5.50 2.50 1.10 ! 36
assi (resi   9 and name   h6 and segi a)
     (resi  10 and name   h8 and segi a) 5.50 2.50 1.10 ! 36a
assi (resi  15 and name   h6 and segi a)
     (resi  16 and name   h8 and segi a) 5.50 2.50 1.10 ! 37
assi (resi  16 and name   h8 and segi a)
     (resi  17 and name   h8 and segi a) 5.50 2.50 1.10 ! 38
assi (resi  17 and name   h8 and segi a)
     (resi  18 and name   h8 and segi a) 5.50 2.50 1.10 ! 39
assi (resi  18 and name   h8 and segi a)
     (resi  19 and name   h8 and segi a) 5.50 2.50 1.10 ! 40
assi (resi  19 and name   h8 and segi a)
     (resi  20 and name   h6 and segi a) 5.50 2.50 1.10 ! 41
assi (resi  20 and name   h6 and segi a)
     (resi  21 and name   h6 and segi a) 5.50 2.50 1.10 ! 42
assi (resi  26 and name   h6 and segi a)
     (resi  27 and name   h6 and segi a) 5.50 2.50 1.10 ! 43

assi (resi  26 and name   h5 and segi a)
     (resi  27 and name   h5 and segi a) 5.50 2.50 1.10 ! 44
assi (resi  27 and name   h5 and segi a)
     (resi  28 and name   h5 and segi a) 5.50 2.50 1.10 ! 45
assi (resi  28 and name   h5 and segi a)
     (resi  29 and name   h5 and segi a) 5.50 2.50 1.10 ! 46

assi (resi  20 and name   h5 and segi a)
     (resi  19 and name   h8 and segi a) 5.50 2.50 1.10 ! 47
assi (resi  29 and name   h5 and segi a)
     (resi  28 and name   h6 and segi a) 5.50 2.50 1.10 ! 48
assi (resi  13 and name   h5 and segi a)
     (resi  12 and name   h6 and segi a) 3.50 1.50 0.70 ! 49
assi (resi  15 and name   h5 and segi a)
     (resi  16 and name   h8 and segi a) 4.50 2.00 0.90 ! 49a
assi (resi  27 and name   h5 and segi a)
     (resi  26 and name   h6 and segi a) 5.50 2.50 1.10 ! 49-a
assi (resi  26 and name   h5 and segi a)
     (resi  27 and name   h6 and segi a) 5.50 2.50 1.10 ! 49-aa

assi (resi  16 and name   h2 and segi a)
     (resi  17 and name   h2 and segi a) 5.50 2.50 1.10 ! 50
assi (resi  17 and name   h2 and segi a)
     (resi  18 and name   h8 and segi a) 5.50 2.50 1.10 ! 51

! base-h1'

assi (resi   1 and name  h1' and segi a)
     (resi   2 and name   h8 and segi a) 4.50 2.00 0.90 ! 52
assi (resi   2 and name  h1' and segi a)
     (resi   3 and name   h8 and segi a) 3.50 1.50 0.70 ! 53
assi (resi   3 and name  h1' and segi a)
     (resi   4 and name   h8 and segi a) 4.50 2.00 0.90 ! 54
assi (resi   4 and name  h1' and segi a)
     (resi   5 and name   h8 and segi a) 4.50 2.00 0.90 ! 55
assi (resi   5 and name  h1' and segi a)
     (resi   6 and name   h8 and segi a) 5.50 2.50 1.10 ! 56
assi (resi   6 and name  h1' and segi a)
     (resi   7 and name   h6 and segi a) 5.50 2.50 1.10 ! 56a
assi (resi   7 and name  h1' and segi a)
     (resi   8 and name   h8 and segi a) 5.50 2.50 1.10 ! 56b
assi (resi   8 and name  h1' and segi a)
     (resi   9 and name   h6 and segi a) 5.50 2.50 1.10 ! 56c
assi (resi   9 and name  h1' and segi a)
     (resi  10 and name   h8 and segi a) 5.50 2.50 1.10 ! 56
assi (resi  10 and name  h1' and segi a)
     (resi  11 and name   h8 and segi a) 5.50 2.50 1.10 ! 57
assi (resi  11 and name  h1' and segi a)
     (resi  12 and name   h6 and segi a) 4.50 2.00 0.90 ! 58
assi (resi  12 and name  h1' and segi a)
     (resi  13 and name   h6 and segi a) 4.50 2.00 0.90 ! 59
assi (resi  14 and name  h1' and segi a)
     (resi  15 and name   h6 and segi a) 4.50 2.00 0.90 ! 60
assi (resi  15 and name  h1' and segi a)
     (resi  16 and name   h8 and segi a) 5.50 2.50 1.10 ! 61
assi (resi  16 and name  h1' and segi a)
     (resi  17 and name   h8 and segi a) 3.50 1.50 0.70 ! 62
assi (resi  17 and name  h1' and segi a)
     (resi  18 and name   h8 and segi a) 5.50 2.50 1.10 ! 63
assi (resi  18 and name  h1' and segi a)
     (resi  19 and name   h8 and segi a) 4.50 2.00 0.90 ! 64
assi (resi  19 and name  h1' and segi a)
     (resi  20 and name   h6 and segi a) 4.50 2.00 0.90 ! 65
assi (resi  20 and name  h1' and segi a)
     (resi  21 and name   h6 and segi a) 4.50 2.00 0.90 ! 66
assi (resi  21 and name  h1' and segi a)
     (resi  22 and name   h8 and segi a) 5.50 2.50 1.10 ! 66a
assi (resi  22 and name  h1' and segi a)
     (resi  23 and name   h8 and segi a) 5.50 2.50 1.10 ! 66b
assi (resi  23 and name  h1' and segi a)
     (resi  24 and name   h8 and segi a) 5.50 2.50 1.10 ! 66c
assi (resi  24 and name  h1' and segi a)
     (resi  25 and name   h8 and segi a) 5.50 2.50 1.10 ! 66d
assi (resi  25 and name  h1' and segi a)
     (resi  26 and name   h6 and segi a) 5.50 2.50 1.10 ! 66e
assi (resi  26 and name  h1' and segi a)
     (resi  27 and name   h6 and segi a) 4.50 2.00 0.90 ! 67
assi (resi  27 and name  h1' and segi a)
     (resi  28 and name   h6 and segi a) 4.50 2.00 0.90 ! 68
assi (resi  28 and name  h1' and segi a)
     (resi  29 and name   h6 and segi a) 4.50 2.00 0.90 ! 69
assi (resi  29 and name  h1' and segi a)
     (resi  30 and name   h6 and segi a) 4.50 2.00 0.90 ! 70
assi (resi  30 and name  h1' and segi a)
     (resi  31 and name   h6 and segi a) 4.50 2.00 0.90 ! 71

assi (resi  19 and name  h1' and segi a)
     (resi  20 and name   h5 and segi a) 4.50 2.00 0.90 ! 72
assi (resi  25 and name  h1' and segi a)
     (resi  26 and name   h5 and segi a) 5.50 2.50 1.10 ! 73a
assi (resi  26 and name  h1' and segi a)
     (resi  27 and name   h5 and segi a) 5.50 2.50 1.10 ! 73
assi (resi   6 and name  h1' and segi a)
     (resi   7 and name   h5 and segi a) 5.50 2.50 1.10 ! 73a
assi (resi   8 and name  h1' and segi a)
     (resi   7 and name   h5 and segi a) 5.50 2.50 1.10 ! 73a

assi (resi   5 and name   h2 and segi a)
     (resi   6 and name  h1' and segi a) 3.50 1.50 0.70 ! 74
assi (resi  23 and name   h2 and segi a)
     (resi  24 and name  h1' and segi a) 5.50 2.50 1.10 ! 75
assi (resi  16 and name   h2 and segi a)
     (resi  17 and name  h1' and segi a) 3.50 1.50 0.70 ! 75a

!  h1'-h1'

assi (resi   5 and name  h1' and segi a)
     (resi   6 and name  h1' and segi a) 5.50 2.50 1.10 ! 76
assi (resi  16 and name  h1' and segi a)
     (resi  17 and name  h1' and segi a) 3.50 1.50 0.90 ! 77

!  h2'- h1'

assi (resi   1 and name  h2' and segi a) 
     (resi   2 and name  h1' and segi a) 3.50 1.50 0.70 ! 83
assi (resi   2 and name  h2' and segi a) 
     (resi   3 and name  h1' and segi a) 3.50 1.50 0.70 ! 84
assi (resi   6 and name  h2' and segi a) 
     (resi   7 and name  h1' and segi a) 3.50 1.50 0.70 ! 84a
assi (resi  12 and name  h2' and segi a) 
     (resi  13 and name  h1' and segi a) 3.50 1.50 0.70 ! 85
assi (resi  13 and name  h2' and segi a) 
     (resi  14 and name  h1' and segi a) 4.50 2.00 0.90 ! 86
assi (resi  16 and name  h2' and segi a)
     (resi  17 and name  h1' and segi a) 4.50 2.00 0.90 ! 87
assi (resi  18 and name  h2' and segi a)
     (resi  19 and name  h1' and segi a) 3.50 1.50 0.70 ! 88
assi (resi  21 and name  h2' and segi a) 
     (resi  22 and name  h1' and segi a) 4.50 2.00 0.90 ! 89
assi (resi  25 and name  h2' and segi a) 
     (resi  26 and name  h1' and segi a) 4.50 2.00 0.90 ! 89a
assi (resi  26 and name  h2' and segi a) 
     (resi  27 and name  h1' and segi a) 4.50 2.00 0.90 ! 89b
assi (resi  27 and name  h2' and segi a) 
     (resi  28 and name  h1' and segi a) 3.50 1.50 0.70 ! 90
assi (resi  19 and name  h2' and segi a) 
     (resi  20 and name  h1' and segi a) 5.50 2.50 1.10 ! 91

assi (resi  9 and name  h2' and segi a) 
     (resi  8 and name  h1' and segi a) 5.50 2.50 1.10 ! 91a
assi (resi  17 and name  h2' and segi a)
     (resi  16 and name  h1' and segi a) 4.50 2.00 0.90 ! 91b


!  h1'-H3'

assi (resi   2 and name  h3' and segi a) 
     (resi   3 and name  h1' and segi a) 4.50 2.00 0.90 ! 92
assi (resi   5 and name  h3' and segi a) 
     (resi   6 and name  h1' and segi a) 4.50 2.00 0.90 ! 93
assi (resi  13 and name  h3' and segi a) 
     (resi  14 and name  h1' and segi a) 5.50 2.50 1.10 ! 94
assi (resi  14 and name  h3' and segi a) 
     (resi  15 and name  h1' and segi a) 4.50 2.00 0.90 ! 95
assi (resi  18 and name  h3' and segi a) 
     (resi  19 and name  h1' and segi a) 5.50 2.50 1.10 ! 96

!  H5-sugars

assi (resi   6 and name  h2' and segi a) 
     (resi   7 and name  h5  and segi a) 3.50 1.50 0.70 ! 96a
assi (resi   6 and name  h3' and segi a) 
     (resi   7 and name  h5  and segi a) 4.50 2.00 0.90 ! 96b
assi (resi  11 and name  h3' and segi a) 
     (resi  12 and name  h5  and segi a) 3.50 1.50 0.70 ! 97
assi (resi  11 and name  h2' and segi a) 
     (resi  12 and name  h5  and segi a) 3.50 1.50 0.70 ! 98
assi (resi  12 and name  h3' and segi a) 
     (resi  13 and name  h5  and segi a) 2.50 1.00 0.50 ! 99
assi (resi  12 and name  h2' and segi a) 
     (resi  13 and name  h5  and segi a) 3.50 1.50 0.70 ! 100
assi (resi  19 and name  h3' and segi a) 
     (resi  20 and name  h5  and segi a) 3.50 1.50 0.70 ! 101
assi (resi  19 and name  h2' and segi a) 
     (resi  20 and name  h5  and segi a) 3.50 1.50 0.70 ! 102
assi (resi  20 and name  h2' and segi a) 
     (resi  21 and name  h5  and segi a) 3.50 1.50 0.70 ! 103
assi (resi  26 and name  h2' and segi a) 
     (resi  27 and name  h5  and segi a) 3.50 1.50 0.70 ! 104
assi (resi  27 and name  h3' and segi a) 
     (resi  28 and name  h5  and segi a) 3.50 1.50 0.70 ! 105
assi (resi  27 and name  h2' and segi a) 
     (resi  28 and name  h5  and segi a) 3.50 1.50 0.70 ! 106

!  base-h2'

assi (resi   1 and name  h2' and segi a) 
     (resi   2 and name  h8  and segi a) 2.50 1.00 0.50 ! 107
assi (resi   2 and name  h2' and segi a) 
     (resi   3 and name  h8  and segi a) 2.50 1.00 0.50 ! 108
assi (resi   3 and name  h2' and segi a) 
     (resi   4 and name  h8  and segi a) 2.50 1.00 0.50 ! 109
assi (resi   5 and name  h2' and segi a) 
     (resi   6 and name  h8  and segi a) 4.50 2.00 0.90 ! 110
assi (resi   6 and name  h2' and segi a) 
     (resi   7 and name  h6  and segi a) 2.50 1.00 0.50 ! 110a
assi (resi   7 and name  h2' and segi a) 
     (resi   8 and name  h8  and segi a) 3.50 1.50 0.70 ! 112
assi (resi   9 and name  h2' and segi a) 
     (resi  10 and name  h8  and segi a) 4.50 2.00 0.90 ! 111
assi (resi  10 and name  h2' and segi a) 
     (resi  11 and name  h8  and segi a) 3.50 1.50 0.70 ! 112
assi (resi  11 and name  h2' and segi a) 
     (resi  12 and name  h6  and segi a) 3.50 1.50 0.70 ! 113
assi (resi  12 and name  h2' and segi a) 
     (resi  13 and name  h6  and segi a) 2.50 1.00 0.50 ! 114
assi (resi  14 and name  h2' and segi a) 
     (resi  15 and name  h6  and segi a) 2.50 1.00 0.50 ! 115
assi (resi  15 and name  h2' and segi a) 
     (resi  16 and name  h8  and segi a) 2.50 1.00 0.50 ! 116
assi (resi  16 and name  h2' and segi a) 
     (resi  17 and name  h8  and segi a) 3.50 1.50 0.70 ! 117
assi (resi  18 and name  h2' and segi a) 
     (resi  19 and name  h8  and segi a) 2.50 1.00 0.50 ! 118
assi (resi  19 and name  h2' and segi a) 
     (resi  20 and name  h6  and segi a) 3.50 1.50 0.70 ! 119
assi (resi  20 and name  h2' and segi a) 
     (resi  21 and name  h6  and segi a) 3.50 1.50 0.70 ! 120
assi (resi  21 and name  h2' and segi a) 
     (resi  22 and name  h8  and segi a) 3.50 1.50 0.70 ! 120
assi (resi  22 and name  h2' and segi a) 
     (resi  23 and name  h8  and segi a) 3.50 1.50 0.70 ! 120a
assi (resi  25 and name  h2' and segi a) 
     (resi  26 and name  h6  and segi a) 3.50 1.50 0.70 ! 121
assi (resi  26 and name  h2' and segi a) 
     (resi  27 and name  h6  and segi a) 3.50 1.50 0.70 ! 122
assi (resi  27 and name  h2' and segi a) 
     (resi  28 and name  h6  and segi a) 3.50 1.50 0.70 ! 123
assi (resi  28 and name  h2' and segi a) 
     (resi  29 and name  h6  and segi a) 3.50 1.50 0.70 ! 124

assi (resi  14 and name  h2' and segi a) 
     (resi  16 and name  h8  and segi a) 2.50 1.00 0.50 ! 125
assi (resi  15 and name  h2' and segi a) 
     (resi  17 and name  h8  and segi a) 5.50 2.50 1.10 ! 126
assi (resi  15 and name  h2' and segi a) 
     (resi  14 and name  h8  and segi a) 5.50 2.50 1.10 ! 127

!  base-H3'

assi (resi   1 and name  h3' and segi a) 
     (resi   2 and name  h8  and segi a) 3.50 1.50 0.70 ! 128
assi (resi   2 and name  h3' and segi a) 
     (resi   3 and name  h8  and segi a) 3.50 1.50 0.70 ! 129
assi (resi   5 and name  h3' and segi a) 
     (resi   6 and name  h8  and segi a) 3.50 1.50 0.70 ! 130
assi (resi   6 and name  h3' and segi a) 
     (resi   7 and name  h6  and segi a) 3.50 1.50 0.70 ! 130a
assi (resi  11 and name  h3' and segi a) 
     (resi  12 and name  h6  and segi a) 3.50 1.50 0.70 ! 131
assi (resi  12 and name  h3' and segi a) 
     (resi  13 and name  h6  and segi a) 3.50 1.50 0.70 ! 132
assi (resi  14 and name  h3' and segi a) 
     (resi  15 and name  h6  and segi a) 3.50 1.50 0.70 ! 133
assi (resi  15 and name  h3' and segi a) 
     (resi  16 and name  h8  and segi a) 3.50 1.50 0.70 ! 134
assi (resi  18 and name  h3' and segi a) 
     (resi  19 and name  h8  and segi a) 3.50 1.50 0.70 ! 135
assi (resi  19 and name  h3' and segi a) 
     (resi  20 and name  h6  and segi a) 3.50 1.50 0.70 ! 136
assi (resi  28 and name  h3' and segi a) 
     (resi  29 and name  h6  and segi a) 3.50 1.50 0.70 ! 137

!  base-H4'

assi (resi  10 and name  h4' and segi a) 
     (resi   9 and name  h6  and segi a) 3.50 1.50 0.70 ! 138
assi (resi  11 and name  h4' and segi a) 
     (resi  12 and name  h6  and segi a) 5.50 2.50 1.10 ! 138
assi (resi  15 and name  h4' and segi a) 
     (resi  16 and name  h8  and segi a) 5.50 2.50 1.10 ! 139
assi (resi  22 and name  h4' and segi a) 
     (resi  23 and name  h8  and segi a) 5.50 2.50 1.10 ! 140
assi (resi  29 and name  h4' and segi a) 
     (resi  30 and name  h6  and segi a) 5.50 2.50 1.10 ! 141


!  long-range

assi (resi  14 and name  h1' and segi a)
     (resi  16 and name   h8 and segi a) 5.50 2.50 1.10 ! 78
assi (resi  15 and name  h2' and segi a)
     (resi  17 and name   h8 and segi a) 5.50 2.50 1.10 ! 78b 
assi (resi  26 and name  h1' and segi a)
     (resi  25 and name   h8 and segi a) 5.50 2.50 1.10 ! 81a

assi (resi  16 and name  h1' and segi a)
     (resi  17 and name   h2 and segi a) 5.50 2.50 1.10 ! 79
assi (resi  17 and name  h1' and segi a)
     (resi  16 and name   h2 and segi a) 5.50 2.50 1.10 ! 79
assi (resi  17 and name  h4' and segi a)
     (resi  16 and name   h2 and segi a) 3.50 1.50 0.70 ! 79


assi (resi  14 and name  h1' and segi a)
     (resi  17 and name   h2 and segi a) 5.50 2.50 1.10 ! 79
assi (resi  28 and name  h1' and segi a)
     (resi   5 and name   h2 and segi a) 4.50 2.00 0.90 ! 80
assi (resi   6 and name  h1' and segi a)
     (resi   5 and name   h2 and segi a) 4.50 2.00 0.90 ! 80aa
assi (resi  22 and name  h2  and segi a)
     (resi  10 and name   h1' and segi a) 5.50 2.50 1.10 ! 80a
assi (resi  22 and name  h2  and segi a)
     (resi   9 and name   h5  and segi a) 5.50 2.50 1.10 ! 80b
assi (resi  22 and name  h2  and segi a)
     (resi  23 and name   h8  and segi a) 5.50 2.50 1.10 ! 80c
assi (resi  22 and name  h2  and segi a)
     (resi  23 and name   h1'  and segi a) 5.50 2.50 1.10 ! 80c
assi (resi  22 and name  h2  and segi a)
     (resi   8 and name   h1'  and segi a) 5.50 2.50 1.10 ! 80c
assi (resi  23 and name  h2  and segi a)
     (resi  24 and name   h1'  and segi a) 5.50 2.50 1.10 ! 80c
assi (resi  25 and name  h2  and segi a)
     (resi  26 and name   h1' and segi a) 5.50 2.50 1.10 ! 81
assi (resi  25 and name  h2  and segi a)
     (resi   8 and name   h1' and segi a) 5.50 2.50 1.10 ! 82b

assi (resi   8 and name  h2  and segi a)
     (resi  25 and name   h8 and segi a) 5.50 2.50 1.10 ! 82b




!  FRET-derived distance 53.00 amgstroms; linkers (~6 A) !!!!!

! assi (resi  15 and name  h5 and segi a)
!      (resi  27 and name  h5 and segi a) 53.00 10.0 10.0 

!  UNNOEs to keep the base of helix from folding back on the bulge

! assi (resi  2 and name  P and segi a)
!      (resi  25 and name P and segi a) 15.0 6.0 6.00
! assi (resi  2 and name  P and segi a)
!      (resi  26 and name P and segi a) 15.0 6.0 6.00  
! assi (resi  3 and name  P and segi a)
!      (resi  26 and name P and segi a) 15.0 6.0 6.00



! H2O (114)

!  iminos

assi (resi   1 and name   h1 and segi a)
     (resi   1 and name  h22 and segi a) 4.50 2.00 0.90 ! 1
assi (resi   1 and name   h1 and segi a)
     (resi   1 and name  h21 and segi a) 3.50 1.50 0.70 ! 2
assi (resi   2 and name   h1 and segi a)
     (resi   2 and name  h22 and segi a) 3.50 2.00 0.90 ! 1
assi (resi   2 and name   h1 and segi a)
     (resi   2 and name  h21 and segi a) 3.50 1.50 0.70 ! 2
assi (resi   3 and name   h1 and segi a)
     (resi   3 and name  h22 and segi a) 3.50 2.00 0.90 ! 1
assi (resi   3 and name   h1 and segi a)
     (resi   3 and name  h21 and segi a) 3.50 1.50 0.70 ! 2
assi (resi   4 and name   h1 and segi a)
     (resi   4 and name  h22 and segi a) 3.50 2.00 0.90 ! 1
assi (resi   4 and name   h1 and segi a)
     (resi   4 and name  h21 and segi a) 3.50 1.50 0.70 ! 2
assi (resi   6 and name   h1 and segi a)
     (resi   6 and name  h22 and segi a) 3.50 1.50 0.70 ! 3
assi (resi   6 and name   h1 and segi a)
     (resi   6 and name  h21 and segi a) 3.50 1.50 0.70 ! 4
assi (resi  11 and name   h1 and segi a)
     (resi  11 and name  h22 and segi a) 3.50 1.50 0.70 ! 5
assi (resi  11 and name   h1 and segi a)
     (resi  11 and name  h21 and segi a) 3.50 1.50 0.70 ! 6
assi (resi  18 and name   h1 and segi a)
     (resi  18 and name  h22 and segi a) 3.50 1.50 0.70 ! 7
assi (resi  18 and name   h1 and segi a)
     (resi  18 and name  h21 and segi a) 3.50 1.50 0.70 ! 8
assi (resi  19 and name   h1 and segi a)
     (resi  19 and name  h22 and segi a) 3.50 1.50 0.70 ! 9
assi (resi  19 and name   h1 and segi a)
     (resi  19 and name  h21 and segi a) 3.50 1.50 0.70 ! 9

!  aminos

assi (resi   1 and name  h22 and segi a)
     (resi   1 and name  h21 and segi a) 2.50 1.00 0.50 ! 10
assi (resi   2 and name  h22 and segi a)
     (resi   2 and name  h21 and segi a) 2.50 1.00 0.50 ! 10
assi (resi   3 and name  h22 and segi a)
     (resi   3 and name  h21 and segi a) 2.50 1.00 0.50 ! 10
assi (resi   4 and name  h22 and segi a)
     (resi   4 and name  h21 and segi a) 2.50 1.00 0.50 ! 11
assi (resi   5 and name  h62 and segi a)
     (resi   5 and name  h61 and segi a) 2.50 1.00 0.50 ! 12
assi (resi   6 and name  h22 and segi a)
     (resi   6 and name  h21 and segi a) 2.50 1.00 0.50 ! 10
assi (resi  11 and name  h22 and segi a)
     (resi  11 and name  h21 and segi a) 2.50 1.00 0.50 ! 13
assi (resi  12 and name  h42 and segi a)
     (resi  12 and name  h41 and segi a) 2.50 1.00 0.50 ! 14
assi (resi  13 and name  h42 and segi a)
     (resi  13 and name  h41 and segi a) 2.50 1.00 0.50 ! 14
assi (resi  18 and name  h22 and segi a)
     (resi  18 and name  h21 and segi a) 2.50 1.00 0.50 ! 13
assi (resi  19 and name  h22 and segi a)
     (resi  19 and name  h21 and segi a) 2.50 1.00 0.50 ! 13
assi (resi  26 and name  h42 and segi a)
     (resi  26 and name  h41 and segi a) 2.50 1.00 0.50 ! 15
assi (resi  28 and name  h42 and segi a)
     (resi  28 and name  h41 and segi a) 2.50 1.00 0.50 ! 16
assi (resi  29 and name  h42 and segi a)
     (resi  29 and name  h41 and segi a) 2.50 1.00 0.50 ! 14
assi (resi  30 and name  h42 and segi a)
     (resi  30 and name  h41 and segi a) 2.50 1.00 0.50 ! 14
assi (resi  31 and name  h42 and segi a)
     (resi  31 and name  h41 and segi a) 2.50 1.00 0.50 ! 14

assi (resi   5 and name   h2 and segi a)
     (resi   5 and name  h62 and segi a) 4.50 2.00 0.90 ! 17
assi (resi  13 and name   h5 and segi a)
     (resi  13 and name  h42 and segi a) 2.50 1.00 0.50 ! 17
assi (resi  13 and name   h5 and segi a)
     (resi  13 and name  h41 and segi a) 3.50 1.50 0.70 ! 17
assi (resi  22 and name   h2 and segi a)
     (resi  22 and name  h62 and segi a) 4.50 2.00 0.90 ! 17


! D2O

!  base-H1'


assi (resi   1 and name  h1' and segi a)
     (resi   1 and name   h8 and segi a) 5.50 2.50 1.10 ! 18
assi (resi   3 and name  h1' and segi a)
     (resi   3 and name   h8 and segi a) 3.50 1.50 0.70 ! 19
assi (resi   4 and name  h1' and segi a)
     (resi   4 and name   h8 and segi a) 4.50 2.00 0.90 ! 20
assi (resi   5 and name  h1' and segi a)
     (resi   5 and name   h8 and segi a) 4.50 2.00 0.90 ! 21
assi (resi   6 and name  h1' and segi a)
     (resi   6 and name   h8 and segi a) 5.50 2.50 1.10 ! 22
assi (resi   7 and name  h1' and segi a)
     (resi   7 and name   h6 and segi a) 5.50 2.50 1.10 ! 22a
assi (resi   8 and name  h1' and segi a)
     (resi   8 and name   h8 and segi a) 5.50 2.50 1.10 ! 22b
assi (resi   9 and name  h1' and segi a)
     (resi   9 and name   h6 and segi a) 4.50 2.00 0.90 ! 22c
assi (resi  10 and name  h1' and segi a)
     (resi  10 and name   h8 and segi a) 5.50 2.50 1.10 ! 23
assi (resi  11 and name  h1' and segi a)
     (resi  11 and name   h8 and segi a) 5.50 2.50 1.10 ! 24
assi (resi  12 and name  h1' and segi a)
     (resi  12 and name   h6 and segi a) 5.50 2.50 1.10 ! 25
assi (resi  13 and name  h1' and segi a)
     (resi  13 and name   h6 and segi a) 4.50 2.00 0.90 ! 26
assi (resi  16 and name  h1' and segi a)
     (resi  16 and name   h8 and segi a) 4.50 2.00 0.90 ! 27
assi (resi  17 and name  h1' and segi a)
     (resi  17 and name   h8 and segi a) 3.50 1.50 0.70 ! 28
assi (resi  18 and name  h1' and segi a)
     (resi  18 and name   h8 and segi a) 4.50 2.00 0.90 ! 29
assi (resi  19 and name  h1' and segi a)
     (resi  19 and name   h8 and segi a) 4.50 2.00 0.90 ! 30
assi (resi  20 and name  h1' and segi a)
     (resi  20 and name   h6 and segi a) 4.50 2.00 0.90 ! 31
assi (resi  21 and name  h1' and segi a)
     (resi  21 and name   h6 and segi a) 5.50 2.50 1.10 ! 31
assi (resi  22 and name  h1' and segi a)
     (resi  22 and name   h8 and segi a) 4.50 2.00 0.90 ! 32a
assi (resi  23 and name  h1' and segi a)
     (resi  23 and name   h8 and segi a) 5.50 2.50 1.10 ! 32b
assi (resi  24 and name  h1' and segi a)
     (resi  24 and name   h8 and segi a) 5.50 2.50 1.10 ! 32c
assi (resi  25 and name  h1' and segi a)
     (resi  25 and name   h8 and segi a) 4.50 2.00 0.90 ! 32d
assi (resi  26 and name  h1' and segi a)
     (resi  26 and name   h6 and segi a) 4.50 2.00 0.90 ! 32e
assi (resi  27 and name  h1' and segi a)
     (resi  27 and name   h6 and segi a) 3.50 1.50 0.70 ! 33
assi (resi  28 and name  h1' and segi a)
     (resi  28 and name   h6 and segi a) 3.50 1.50 0.70 ! 34
assi (resi  29 and name  h1' and segi a)
     (resi  29 and name   h6 and segi a) 4.50 2.00 0.90 ! 35
assi (resi  30 and name  h1' and segi a)
     (resi  30 and name   h6 and segi a) 4.50 2.00 0.90 ! 36
assi (resi  31 and name  h1' and segi a)
     (resi  31 and name   h6 and segi a) 5.50 2.50 1.10 ! 36a

!  H5-H1'

assi (resi   7 and name   h5 and segi a)
     (resi   7 and name  h1' and segi a) 5.50 2.50 1.10 ! 37
assi (resi  13 and name   h5 and segi a)
     (resi  13 and name  h1' and segi a) 5.50 2.50 1.10 ! 37a
assi (resi  20 and name   h5 and segi a)
     (resi  20 and name  h1' and segi a) 5.50 2.50 1.10 ! 38
assi (resi  26 and name   h5 and segi a)
     (resi  26 and name  h1' and segi a) 5.50 2.50 1.10 ! 39
assi (resi  27 and name   h5 and segi a)
     (resi  27 and name  h1' and segi a) 5.50 2.50 1.10 ! 40

!  H5-H6

assi (resi   7 and name   h5 and segi a)
     (resi   7 and name   h6 and segi a) 2.50 1.00 0.50 ! 41
assi (resi   9 and name   h5 and segi a)
     (resi   9 and name   h6 and segi a) 2.50 1.00 0.50 ! 41a
assi (resi  12 and name   h5 and segi a)
     (resi  12 and name   h6 and segi a) 2.50 1.00 0.50 ! 42
assi (resi  13 and name   h5 and segi a)
     (resi  13 and name   h6 and segi a) 2.50 1.00 0.50 ! 43
assi (resi  15 and name   h5 and segi a)
     (resi  15 and name   h6 and segi a) 2.50 1.00 0.50 ! 44
assi (resi  20 and name   h5 and segi a)
     (resi  20 and name   h6 and segi a) 2.50 1.00 0.50 ! 45
assi (resi  26 and name   h5 and segi a)
     (resi  26 and name   h6 and segi a) 2.50 1.00 0.50 ! 46
assi (resi  27 and name   h5 and segi a)
     (resi  27 and name   h6 and segi a) 2.50 1.00 0.50 ! 47
assi (resi  28 and name   h5 and segi a)
     (resi  28 and name   h6 and segi a) 2.50 1.00 0.50 ! 48
assi (resi  29 and name   h5 and segi a)
     (resi  29 and name   h6 and segi a) 2.50 1.00 0.50 ! 49
assi (resi  30 and name   h5 and segi a)
     (resi  30 and name   h6 and segi a) 2.50 1.00 0.50 ! 50
assi (resi  31 and name   h5 and segi a)
     (resi  31 and name   h6 and segi a) 2.50 1.00 0.50 ! 51

!  H1'-h2'

assi (resi   1 and name  h2' and segi a)
     (resi   1 and name  h1' and segi a) 3.50 1.50 0.70 ! 51a
assi (resi   2 and name  h2' and segi a)
     (resi   2 and name  h1' and segi a) 2.50 1.00 0.50 ! 52
assi (resi   3 and name  h2' and segi a)
     (resi   3 and name  h1' and segi a) 2.50 1.00 0.50 ! 53
assi (resi   5 and name  h2' and segi a)
     (resi   5 and name  h1' and segi a) 2.50 1.00 0.50 ! 54
assi (resi   8 and name  h2' and segi a)
     (resi   8 and name  h1' and segi a) 3.50 1.50 0.70 ! 55
assi (resi   9 and name  h2' and segi a)
     (resi   9 and name  h1' and segi a) 3.50 1.50 0.70 ! 55a
assi (resi  11 and name  h2' and segi a)
     (resi  11 and name  h1' and segi a) 3.50 1.50 0.70 ! 55b
assi (resi  13 and name  h2' and segi a)
     (resi  13 and name  h1' and segi a) 2.50 1.00 0.50 ! 56
assi (resi  14 and name  h2' and segi a)
     (resi  14 and name  h1' and segi a) 3.50 1.50 0.70 ! 57
assi (resi  15 and name  h2' and segi a)
     (resi  15 and name  h1' and segi a) 2.50 1.00 0.50 ! 58
assi (resi  16 and name  h2' and segi a)
     (resi  16 and name  h1' and segi a) 2.50 1.00 0.50 ! 59
assi (resi  17 and name  h2' and segi a)
     (resi  17 and name  h1' and segi a) 2.50 1.00 0.50 ! 60
assi (resi  19 and name  h2' and segi a)
     (resi  19 and name  h1' and segi a) 2.50 1.00 0.50 ! 61
assi (resi  20 and name  h2' and segi a)
     (resi  20 and name  h1' and segi a) 2.50 1.00 0.50 ! 62
assi (resi  22 and name  h2' and segi a)
     (resi  22 and name  h1' and segi a) 3.50 1.50 0.70 ! 62a
assi (resi  25 and name  h2' and segi a)
     (resi  25 and name  h1' and segi a) 5.50 2.50 1.10 ! 62a
assi (resi  27 and name  h2' and segi a)
     (resi  27 and name  h1' and segi a) 2.50 1.00 0.50 ! 63
assi (resi  28 and name  h2' and segi a)
     (resi  28 and name  h1' and segi a) 2.50 1.00 0.50 ! 64
assi (resi  31 and name  h2' and segi a)
     (resi  31 and name  h1' and segi a) 3.50 1.50 0.70 ! 65

!  H3'-H1'

assi (resi   2 and name  h3' and segi a)
     (resi   2 and name  h1' and segi a) 4.50 2.00 0.90 ! 66
assi (resi   4 and name  h3' and segi a)
     (resi   4 and name  h1' and segi a) 3.50 1.50 0.70 ! 67
assi (resi   5 and name  h3' and segi a)
     (resi   5 and name  h1' and segi a) 5.50 2.50 1.10 ! 68
assi (resi   6 and name  h3' and segi a)
     (resi   6 and name  h1' and segi a) 4.50 2.00 0.90 ! 68a
assi (resi   7 and name  h3' and segi a)
     (resi   7 and name  h1' and segi a) 3.50 1.50 0.70 ! 68b
assi (resi   9 and name  h3' and segi a)
     (resi   9 and name  h1' and segi a) 3.50 1.50 0.70 ! 68c
assi (resi  10 and name  h3' and segi a)
     (resi  10 and name  h1' and segi a) 4.50 2.00 0.90 ! 69
assi (resi  11 and name  h3' and segi a)
     (resi  11 and name  h1' and segi a) 4.50 2.00 0.90 ! 70
assi (resi  14 and name  h3' and segi a)
     (resi  14 and name  h1' and segi a) 4.50 2.00 0.90 ! 71
assi (resi  19 and name  h3' and segi a)
     (resi  19 and name  h1' and segi a) 3.50 1.50 0.70 ! 72
assi (resi  20 and name  h3' and segi a)
     (resi  20 and name  h1' and segi a) 4.50 2.00 0.90 ! 73
assi (resi  27 and name  h3' and segi a)
     (resi  27 and name  h1' and segi a) 3.50 1.50 0.70 ! 74
assi (resi  29 and name  h3' and segi a)
     (resi  29 and name  h1' and segi a) 4.50 2.00 0.90 ! 74a

!  H5-sugars

assi (resi   7 and name  h1' and segi a)
     (resi   7 and name  h5  and segi a) 5.50 2.50 1.10 ! 74a
assi (resi  12 and name  h3' and segi a)
     (resi  12 and name  h5  and segi a) 3.50 1.50 0.70 ! 75
assi (resi  13 and name  h3' and segi a)
     (resi  13 and name  h5  and segi a) 5.50 2.50 1.10 ! 75-a
assi (resi  15 and name  h4' and segi a)
     (resi  15 and name  h5  and segi a) 5.50 2.50 1.10 ! 75a
assi (resi  15 and name  h5' and segi a)
     (resi  15 and name  h5  and segi a) 3.50 1.50 0.70 ! 75b
assi (resi  20 and name  h3' and segi a)
     (resi  20 and name  h5  and segi a) 5.50 2.50 1.10 ! 76
assi (resi  20 and name  h2' and segi a)
     (resi  20 and name  h5  and segi a) 5.50 2.50 1.10 ! 76a
assi (resi  26 and name  h2' and segi a)
     (resi  26 and name  h5  and segi a) 4.50 2.00 0.90 ! 77
assi (resi  27 and name  h2' and segi a)
     (resi  27 and name  h5  and segi a) 4.50 2.00 0.90 ! 78
assi (resi  27 and name  h3' and segi a)
     (resi  27 and name  h5  and segi a) 3.50 1.50 0.70 ! 79
assi (resi  28 and name  h2' and segi a)
     (resi  28 and name  h5  and segi a) 5.50 2.50 1.10 ! 80
assi (resi  28 and name  h4' and segi a)
     (resi  28 and name  h5  and segi a) 5.50 2.50 1.10 ! 80a

!  base-h2'

assi (resi   1 and name  h2' and segi a)
     (resi   1 and name  h8  and segi a) 2.50 1.00 0.50 ! 81
assi (resi   2 and name  h2' and segi a)
     (resi   2 and name  h8  and segi a) 3.50 1.50 0.70 ! 82
assi (resi   3 and name  h2' and segi a)
     (resi   3 and name  h8  and segi a) 3.50 1.50 0.70 ! 83
assi (resi   5 and name  h2' and segi a)
     (resi   5 and name  h8  and segi a) 4.50 1.00 0.90 ! 84
assi (resi   7 and name  h2' and segi a)
     (resi   7 and name  h6  and segi a) 3.50 1.50 0.70 ! 84a
assi (resi   8 and name  h2' and segi a)
     (resi   8 and name  h8  and segi a) 4.50 1.00 0.90 ! 84b
assi (resi  11 and name  h2' and segi a)
     (resi  11 and name  h8  and segi a) 4.50 1.00 0.90 ! 85
assi (resi  12 and name  h2' and segi a)
     (resi  12 and name  h6  and segi a) 3.50 1.50 0.70 ! 86
assi (resi  13 and name  h2' and segi a)
     (resi  13 and name  h6  and segi a) 3.50 1.50 0.70 ! 87
assi (resi  14 and name  h2' and segi a)
     (resi  14 and name  h8  and segi a) 3.50 1.50 0.70 ! 87a
assi (resi  15 and name  h2' and segi a)
     (resi  15 and name  h6  and segi a) 3.50 1.50 0.70 ! 88
assi (resi  16 and name  h2' and segi a)
     (resi  16 and name  h8  and segi a) 3.50 1.50 0.70 ! 89
assi (resi  17 and name  h2' and segi a)
     (resi  17 and name  h8  and segi a) 3.50 1.50 0.70 ! 90
assi (resi  18 and name  h2' and segi a)
     (resi  18 and name  h8  and segi a) 3.50 1.50 0.70 ! 91
assi (resi  21 and name  h2' and segi a)
     (resi  21 and name  h6  and segi a) 3.50 1.50 0.70 ! 91a
assi (resi  22 and name  h2' and segi a)
     (resi  22 and name  h8  and segi a) 2.50 1.00 0.50 ! 81
assi (resi  25 and name  h2' and segi a)
     (resi  25 and name  h8  and segi a) 5.50 2.50 1.10 ! 92
assi (resi  28 and name  h2' and segi a)
     (resi  28 and name  h6  and segi a) 4.50 2.00 0.90 ! 92a
assi (resi  29 and name  h2' and segi a)
     (resi  29 and name  h6  and segi a) 3.50 1.50 0.70 ! 91b

!  base-h3'

assi (resi   1 and name  h3' and segi a)
     (resi   1 and name  h8  and segi a) 3.50 1.50 0.70 ! 93
assi (resi   3 and name  h3' and segi a)
     (resi   3 and name  h8  and segi a) 3.50 1.50 0.70 ! 94
assi (resi   4 and name  h3' and segi a)
     (resi   4 and name  h8  and segi a) 3.50 1.50 0.70 ! 95
assi (resi   5 and name  h3' and segi a)
     (resi   5 and name  h8  and segi a) 4.50 2.00 0.90 ! 96
assi (resi   6 and name  h3' and segi a)
     (resi   6 and name  h8  and segi a) 3.50 1.50 0.70 ! 97
assi (resi   7 and name  h3' and segi a)
     (resi   7 and name  h6  and segi a) 4.50 2.00 0.90 ! 97a
assi (resi  10 and name  h3' and segi a)
     (resi  10 and name  h8  and segi a) 4.50 2.00 0.90 ! 98
assi (resi  11 and name  h3' and segi a)
     (resi  11 and name  h8  and segi a) 4.50 2.00 0.90 ! 99
assi (resi  12 and name  h3' and segi a)
     (resi  12 and name  h6  and segi a) 3.50 1.50 0.70 ! 100
assi (resi  13 and name  h3' and segi a)
     (resi  13 and name  h6  and segi a) 3.50 1.50 0.70 ! 100a
assi (resi  14 and name  h3' and segi a)
     (resi  14 and name  h8  and segi a) 3.50 1.50 0.70 ! 101
assi (resi  15 and name  h3' and segi a)
     (resi  15 and name  h6  and segi a) 3.50 1.50 0.70 ! 102
assi (resi  16 and name  h3' and segi a)
     (resi  16 and name  h8  and segi a) 3.50 1.50 0.70 ! 103
assi (resi  18 and name  h3' and segi a)
     (resi  18 and name  h8  and segi a) 3.50 1.50 0.70 ! 104
assi (resi  19 and name  h3' and segi a)
     (resi  19 and name  h8  and segi a) 3.50 1.50 0.70 ! 105
assi (resi  22 and name  h3' and segi a)
     (resi  22 and name  h8  and segi a) 5.50 5.50 1.10 ! 105a
assi (resi  27 and name  h3' and segi a)
     (resi  27 and name  h6  and segi a) 4.50 2.00 0.90 ! 106
assi (resi  28 and name  h3' and segi a)
     (resi  28 and name  h6  and segi a) 3.50 1.50 0.70 ! 107
assi (resi  29 and name  h3' and segi a)
     (resi  29 and name  h6  and segi a) 3.50 1.50 0.70 ! 108
assi (resi  31 and name  h3' and segi a)
     (resi  31 and name  h6  and segi a) 3.50 1.50 0.70 ! 108a


!  base-H4'

assi (resi   4 and name  h4' and segi a)
     (resi   4 and name  h8  and segi a) 3.50 1.50 0.70 ! 109
assi (resi  10 and name  h4' and segi a)
     (resi  10 and name  h6  and segi a) 5.50 2.50 1.10 ! 114a
assi (resi  11 and name  h4' and segi a)
     (resi  11 and name  h8  and segi a) 3.50 1.50 0.70 ! 109a
assi (resi  12 and name  h4' and segi a)
     (resi  12 and name  h6  and segi a) 4.50 2.00 0.90 ! 110
assi (resi  18 and name  h4' and segi a)
     (resi  18 and name  h8  and segi a) 3.50 1.50 0.70 ! 111
assi (resi  19 and name  h4' and segi a)
     (resi  19 and name  h8  and segi a) 3.50 1.50 0.70 ! 112
assi (resi  20 and name  h4' and segi a)
     (resi  20 and name  h6  and segi a) 4.50 2.00 0.90 ! 113
assi (resi  22 and name  h4' and segi a)
     (resi  22 and name  h8  and segi a) 5.50 2.50 1.10 ! 113a
assi (resi  28 and name  h4' and segi a)
     (resi  28 and name  h6  and segi a) 4.50 2.00 0.90 ! 114
assi (resi  29 and name  h4' and segi a)
     (resi  29 and name  h6  and segi a) 5.50 2.50 1.10 ! 114a

!  base-h5'/ h5''

assi (resi  15 and name  h5' and segi a)
     (resi  15 and name  h6  and segi a) 5.50 2.50 1.10 ! 114aa

!  H1'-H4'

assi (resi  11 and name  h4' and segi a)
     (resi  11 and name  h1' and segi a) 5.50 2.50 1.10 ! 114b
assi (resi  15 and name  h4' and segi a)
     (resi  15 and name  h1' and segi a) 5.50 2.50 1.10 ! 114bb
assi (resi  22 and name  h4' and segi a)
     (resi  22 and name  h1' and segi a) 3.50 1.50 0.70 ! 113b

!  H2-H8

assi (resi  22 and name  h2  and segi a)
     (resi  22 and name  h1' and segi a) 5.50 1.50 0.70 ! 113c
assi (resi  25 and name  h2  and segi a)
     (resi  25 and name  h1' and segi a) 5.50 1.50 0.70 ! 113d










  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H5'    G   1           H5'      GUA   1 -32.823 -24.010  -2.551
    2   H5''    G   1          H5''      GUA   1 -31.434 -23.212  -1.786
    3    H4'    G   1           H4'      GUA   1 -31.167 -25.621  -1.611
    4    H3'    G   1           H3'      GUA   1 -29.337 -24.375  -3.660
    5    H2'    G   1           H2'      GUA   1 -28.295 -26.511  -3.858
    6   HO2'    G   1          H2''      GUA   1 -29.643 -27.036  -1.428
    7    H1'    G   1           H1'      GUA   1 -30.655 -27.911  -3.932
    8    H8     G   1           H8       GUA   1 -31.054 -24.610  -5.762
    9    H1     G   1           H1       GUA   1 -27.520 -28.809  -9.025
   10    H21    G   1           H21      GUA   1 -27.568 -30.849  -7.734
   11    H22    G   1           H22      GUA   1 -27.106 -30.408  -6.107
   12   HO5'    G   1          H5T       GUA   1 -32.339 -22.940  -4.259
   13    H5'    G   2           H5'      GUA   2 -27.284 -26.810  -1.307
   14   H5''    G   2          H5''      GUA   2 -25.773 -26.125  -0.677
   15    H4'    G   2           H4'      GUA   2 -25.335 -28.322  -1.601
   16    H3'    G   2           H3'      GUA   2 -24.180 -26.115  -3.372
   17    H2'    G   2           H2'      GUA   2 -23.157 -27.893  -4.579
   18   HO2'    G   2          H2''      GUA   2 -22.628 -29.693  -3.609
   19    H1'    G   2           H1'      GUA   2 -25.396 -29.484  -4.653
   20    H8     G   2           H8       GUA   2 -26.395 -25.831  -4.890
   21    H1     G   2           H1       GUA   2 -24.031 -28.091 -10.385
   22    H21    G   2           H21      GUA   2 -23.123 -30.100 -10.056
   23    H22    G   2           H22      GUA   2 -23.311 -30.969  -8.551
   24    H5'    G   3           H5'      GUA   3 -21.370 -28.670  -2.651
   25   H5''    G   3          H5''      GUA   3 -19.788 -27.993  -2.220
   26    H4'    G   3           H4'      GUA   3 -19.597 -29.504  -4.129
   27    H3'    G   3           H3'      GUA   3 -19.174 -26.571  -4.912
   28    H2'    G   3           H2'      GUA   3 -18.665 -27.345  -7.102
   29   HO2'    G   3          H2''      GUA   3 -17.994 -29.660  -5.720
   30    H1'    G   3           H1'      GUA   3 -20.569 -29.379  -7.134
   31    H8     G   3           H8       GUA   3 -22.214 -26.376  -5.665
   32    H1     G   3           H1       GUA   3 -21.430 -25.751 -11.990
   33    H21    G   3           H21      GUA   3 -20.357 -27.628 -12.775
   34    H22    G   3           H22      GUA   3 -19.138 -28.296 -11.715
   35    H5'    G   4           H5'      GUA   4 -15.869 -28.852  -6.326
   36   H5''    G   4          H5''      GUA   4 -14.325 -28.024  -6.023
   37    H4'    G   4           H4'      GUA   4 -14.431 -28.725  -8.350
   38    H3'    G   4           H3'      GUA   4 -14.865 -25.736  -8.105
   39    H2'    G   4           H2'      GUA   4 -14.677 -25.736 -10.511
   40   HO2'    G   4          H2''      GUA   4 -14.170 -28.546 -10.354
   41    H1'    G   4           H1'      GUA   4 -16.461 -27.763 -10.803
   42    H8     G   4           H8       GUA   4 -17.392 -25.782  -7.691
   43    H1     G   4           H1       GUA   4 -19.041 -22.824 -13.125
   44    H21    G   4           H21      GUA   4 -18.198 -23.935 -14.870
   45    H22    G   4           H22      GUA   4 -17.201 -25.356 -14.679
   46    H5'    A   5           H5'      ADE   5 -11.996 -26.258 -10.865
   47   H5''    A   5          H5''      ADE   5 -10.603 -25.180 -10.658
   48    H4'    A   5           H4'      ADE   5 -11.383 -25.012 -12.929
   49    H3'    A   5           H3'      ADE   5 -12.093 -22.516 -11.344
   50    H2'    A   5           H2'      ADE   5 -12.914 -21.631 -13.409
   51   HO2'    A   5          H2''      ADE   5 -12.012 -22.217 -15.234
   52    H1'    A   5           H1'      ADE   5 -14.283 -23.874 -14.167
   53    H8     A   5           H8       ADE   5 -14.332 -23.500 -10.366
   54    H61    A   5           H61      ADE   5 -19.187 -19.920 -11.030
   55    H62    A   5           H62      ADE   5 -17.759 -19.940 -10.019
   56    H2     A   5           H2       ADE   5 -17.284 -20.411 -15.164
   57    H5'    G   6           H5'      GUA   6 -10.196 -21.403 -14.743
   58   H5''    G   6          H5''      GUA   6  -9.019 -20.086 -14.557
   59    H4'    G   6           H4'      GUA   6 -10.704 -19.500 -16.225
   60    H3'    G   6           H3'      GUA   6 -11.008 -18.003 -13.611
   61    H2'    G   6           H2'      GUA   6 -12.603 -16.614 -14.768
   62   HO2'    G   6          H2''      GUA   6 -12.154 -16.245 -16.793
   63    H1'    G   6           H1'      GUA   6 -13.896 -18.760 -15.890
   64    H8     G   6           H8       GUA   6 -12.581 -19.634 -12.422
   65    H1     G   6           H1       GUA   6 -17.802 -15.935 -12.191
   66    H21    G   6           H21      GUA   6 -18.186 -15.076 -14.257
   67    H22    G   6           H22      GUA   6 -17.665 -15.987 -15.654
   68    H5'    U   7           H5'      URI   7  -9.558 -13.937 -16.658
   69   H5''    U   7          H5''      URI   7 -10.149 -14.570 -15.112
   70    H4'    U   7           H4'      URI   7 -11.873 -13.194 -17.203
   71    H3'    U   7           H3'      URI   7 -10.035 -11.919 -15.369
   72    H2'    U   7           H2'      URI   7 -11.258 -12.343 -13.417
   73   HO2'    U   7          H2''      URI   7 -12.978 -10.736 -13.163
   74    H1'    U   7           H1'      URI   7 -13.899 -12.315 -14.851
   75    H3     U   7           H3       URI   7 -16.095 -13.923 -11.311
   76    H5     U   7           H5       URI   7 -12.369 -15.883 -11.044
   77    H6     U   7           H6       URI   7 -11.666 -14.672 -13.030
   78    H5'    A   8           H5'      ADE   8 -13.638  -9.511 -15.349
   79   H5''    A   8          H5''      ADE   8 -13.335  -7.799 -15.711
   80    H4'    A   8           H4'      ADE   8 -14.810  -7.898 -13.806
   81    H3'    A   8           H3'      ADE   8 -12.290  -6.612 -13.605
   82    H2'    A   8           H2'      ADE   8 -11.371  -7.903 -11.893
   83   HO2'    A   8          H2''      ADE   8 -13.323  -6.261 -10.687
   84    H1'    A   8           H1'      ADE   8 -14.076  -8.707 -10.833
   85    H8     A   8           H8       ADE   8 -10.951 -10.394 -12.435
   86    H61    A   8           H62      ADE   8 -11.078 -14.058  -7.487
   87    H62    A   8           H61      ADE   8 -10.533 -13.977  -9.148
   88    H2     A   8           H2       ADE   8 -14.644 -11.300  -7.263
   89    H5'    C   9           H5'      CYT   9 -12.828  -2.027 -11.909
   90   H5''    C   9          H5''      CYT   9 -13.201  -2.131 -13.644
   91    H4'    C   9           H4'      CYT   9 -11.012  -1.125 -13.416
   92    H3'    C   9           H3'      CYT   9 -11.308  -3.183 -15.056
   93    H2'    C   9           H2'      CYT   9 -10.787  -4.933 -13.526
   94   HO2'    C   9          H2''      CYT   9  -8.153  -4.827 -13.826
   95    H1'    C   9           H1'      CYT   9  -8.468  -3.408 -12.364
   96    H41    C   9           H42      CYT   9  -9.371  -7.915  -7.979
   97    H42    C   9           H41      CYT   9 -10.949  -7.263  -7.603
   98    H5     C   9           H5       CYT   9 -11.822  -5.277  -8.654
   99    H6     C   9           H6       CYT   9 -11.521  -3.687 -10.494
  100    H5'    G  10           H5'      GUA  10  -8.858   1.585 -13.885
  101   H5''    G  10          H5''      GUA  10  -8.540  -0.070 -13.325
  102    H4'    G  10           H4'      GUA  10 -10.970   1.425 -12.360
  103    H3'    G  10           H3'      GUA  10  -8.103   1.575 -11.261
  104    H2'    G  10           H2'      GUA  10  -9.115   1.894  -9.108
  105   HO2'    G  10          H2''      GUA  10 -11.274   2.344  -8.857
  106    H1'    G  10           H1'      GUA  10 -10.952  -0.113  -9.468
  107    H8     G  10           H8       GUA  10  -7.641  -1.084 -11.095
  108    H1     G  10           H1       GUA  10  -7.556  -1.487  -4.696
  109    H21    G  10           H21      GUA  10 -10.603   0.201  -4.880
  110    H22    G  10           H22      GUA  10  -9.543  -0.771  -3.886
  111    H5'    G  11           H5'      GUA  11  -9.940   4.585  -9.314
  112   H5''    G  11          H5''      GUA  11  -9.009   6.096  -9.348
  113    H4'    G  11           H4'      GUA  11  -9.606   5.548  -7.059
  114    H3'    G  11           H3'      GUA  11  -6.652   4.984  -7.573
  115    H2'    G  11           H2'      GUA  11  -6.487   4.662  -5.209
  116   HO2'    G  11          H2''      GUA  11  -8.655   5.012  -4.034
  117    H1'    G  11           H1'      GUA  11  -8.844   3.216  -5.037
  118    H8     G  11           H8       GUA  11  -6.902   2.335  -8.175
  119    H1     G  11           H1       GUA  11  -4.379  -0.291  -2.909
  120    H21    G  11           H21      GUA  11  -5.292   1.535  -1.101
  121    H22    G  11           H22      GUA  11  -6.790   0.639  -1.180
  122    H5'    C  12           H5'      CYT  12  -6.725   7.340  -4.319
  123   H5''    C  12          H5''      CYT  12  -5.597   8.709  -4.406
  124    H4'    C  12           H4'      CYT  12  -5.223   7.514  -2.344
  125    H3'    C  12           H3'      CYT  12  -2.917   7.073  -4.292
  126    H2'    C  12           H2'      CYT  12  -1.899   5.764  -2.610
  127   HO2'    C  12          H2''      CYT  12  -3.661   6.108  -0.548
  128    H1'    C  12           H1'      CYT  12  -4.199   4.540  -1.651
  129    H41    C  12           H41      CYT  12  -1.496   0.428  -5.729
  130    H42    C  12           H42      CYT  12  -2.278   1.249  -7.061
  131    H5     C  12           H5       CYT  12  -3.554   3.264  -6.806
  132    H6     C  12           H6       CYT  12  -4.382   4.922  -5.218
  133    H5'    C  13           H5'      CYT  13  -1.496   7.942  -0.591
  134   H5''    C  13          H5''      CYT  13  -0.497   9.410  -0.553
  135    H4'    C  13           H4'      CYT  13   0.594   7.630   0.712
  136    H3'    C  13           H3'      CYT  13   1.834   9.083  -1.201
  137    H2'    C  13           H2'      CYT  13   1.900   7.451  -2.911
  138   HO2'    C  13          H2''      CYT  13   4.059   6.640  -1.223
  139    H1'    C  13           H1'      CYT  13   2.310   5.281  -0.851
  140    H41    C  13           H41      CYT  13   0.777   1.511  -5.700
  141    H42    C  13           H42      CYT  13  -0.659   2.453  -6.031
  142    H5     C  13           H5       CYT  13  -0.579   4.852  -5.437
  143    H6     C  13           H6       CYT  13   0.090   6.396  -3.654
  144    H5'    G  14           H5'      GUA  14   6.525   9.077  -1.679
  145   H5''    G  14          H5''      GUA  14   5.045   8.566  -2.516
  146    H4'    G  14           H4'      GUA  14   7.428   6.805  -1.850
  147    H3'    G  14           H3'      GUA  14   6.524   7.890  -4.580
  148    H2'    G  14           H2'      GUA  14   7.526   5.866  -5.452
  149   HO2'    G  14          H2''      GUA  14   9.063   4.881  -4.365
  150    H1'    G  14           H1'      GUA  14   6.191   4.255  -3.779
  151    H8     G  14           H8       GUA  14   4.298   7.559  -4.357
  152    H1     G  14           H1       GUA  14   3.519   3.321  -9.085
  153    H21    G  14           H21      GUA  14   4.928   1.610  -8.800
  154    H22    G  14           H22      GUA  14   5.722   1.325  -7.273
  155    H5'    C  15           H5'      CYT  15   9.709  10.515  -7.138
  156   H5''    C  15          H5''      CYT  15   7.945  10.705  -7.144
  157    H4'    C  15           H4'      CYT  15   8.626  10.146  -9.389
  158    H3'    C  15           H3'      CYT  15   6.690   8.743  -8.181
  159    H2'    C  15           H2'      CYT  15   8.070   7.099  -7.153
  160   HO2'    C  15          H2''      CYT  15   6.510   6.143  -8.798
  161    H1'    C  15           H1'      CYT  15   9.681   6.682  -9.670
  162    H41    C  15           H42      CYT  15  14.577   5.912  -5.552
  163    H42    C  15           H41      CYT  15  13.585   4.666  -4.829
  164    H5     C  15           H5       CYT  15  11.759   7.067  -4.663
  165    H6     C  15           H6       CYT  15   9.904   7.766  -6.095
  166    H5'    A  16           H5'      ADE  16   8.080   6.161 -11.813
  167   H5''    A  16          H5''      ADE  16   6.674   5.501 -12.677
  168    H4'    A  16           H4'      ADE  16   8.148   3.674 -12.453
  169    H3'    A  16           H3'      ADE  16   5.796   3.667 -11.059
  170    H2'    A  16           H2'      ADE  16   6.641   3.569  -8.887
  171   HO2'    A  16          H2''      ADE  16   5.903   1.343  -9.400
  172    H1'    A  16           H1'      ADE  16   9.123   2.197  -9.923
  173    H8     A  16           H8       ADE  16   7.733   4.870  -7.458
  174    H61    A  16           H61      ADE  16  12.606   3.275  -4.019
  175    H62    A  16           H62      ADE  16  11.029   4.031  -3.984
  176    H2     A  16           H2       ADE  16  12.748   0.898  -7.842
  177    H5'    A  17           H5'      ADE  17   8.342   0.019 -11.709
  178   H5''    A  17          H5''      ADE  17   7.620  -1.604 -11.755
  179    H4'    A  17           H4'      ADE  17   9.792  -1.648 -10.619
  180    H3'    A  17           H3'      ADE  17   7.338  -2.051  -8.839
  181    H2'    A  17           H2'      ADE  17   8.820  -2.516  -7.034
  182   HO2'    A  17          H2''      ADE  17  10.815  -3.260  -7.306
  183    H1'    A  17           H1'      ADE  17  10.649  -0.543  -7.681
  184    H8     A  17           H8       ADE  17   7.067   0.639  -8.159
  185    H61    A  17           H61      ADE  17   6.785   1.652  -2.131
  186    H62    A  17           H62      ADE  17   6.257   2.329  -3.656
  187    H2     A  17           H2       ADE  17  10.843  -0.152  -3.014
  188    H5'    G  18           H5'      GUA  18   9.110  -4.634  -7.290
  189   H5''    G  18          H5''      GUA  18   8.200  -6.109  -6.915
  190    H4'    G  18           H4'      GUA  18   8.833  -4.969  -4.861
  191    H3'    G  18           H3'      GUA  18   5.873  -4.841  -5.486
  192    H2'    G  18           H2'      GUA  18   5.565  -3.741  -3.380
  193   HO2'    G  18          H2''      GUA  18   8.265  -4.519  -2.901
  194    H1'    G  18           H1'      GUA  18   7.582  -1.967  -3.731
  195    H8     G  18           H8       GUA  18   6.224  -2.816  -7.154
  196    H1     G  18           H1       GUA  18   2.344   1.121  -3.945
  197    H21    G  18           H21      GUA  18   3.571   1.678  -1.900
  198    H22    G  18           H22      GUA  18   3.871   0.123  -1.161
  199    H5'    G  19           H5'      GUA  19   6.198  -5.608  -1.735
  200   H5''    G  19          H5''      GUA  19   5.147  -6.856  -1.041
  201    H4'    G  19           H4'      GUA  19   4.918  -4.744   0.172
  202    H3'    G  19           H3'      GUA  19   2.420  -5.433  -1.454
  203    H2'    G  19           H2'      GUA  19   1.415  -3.556  -0.368
  204   HO2'    G  19          H2''      GUA  19   3.775  -3.411   1.242
  205    H1'    G  19           H1'      GUA  19   3.546  -1.888  -0.745
  206    H8     G  19           H8       GUA  19   3.236  -4.308  -3.647
  207    H1     G  19           H1       GUA  19  -0.850   0.609  -4.040
  208    H21    G  19           H21      GUA  19  -1.067   1.361  -1.674
  209    H22    G  19           H22      GUA  19   0.576   1.822  -1.286
  210    H5'    U  20           H5'      URI  20   1.160  -4.539   2.126
  211   H5''    U  20          H5''      URI  20  -0.023  -5.660   2.826
  212    H4'    U  20           H4'      URI  20  -0.886  -3.391   2.872
  213    H3'    U  20           H3'      URI  20  -2.323  -5.180   0.908
  214    H2'    U  20           H2'      URI  20  -3.767  -3.353   0.426
  215   HO2'    U  20          H2''      URI  20  -2.805  -2.366   2.902
  216    H1'    U  20           H1'      URI  20  -1.830  -1.385   0.473
  217    H3     U  20           H3       URI  20  -3.227  -1.899  -3.872
  218    H5     U  20           H5       URI  20  -0.465  -5.019  -3.199
  219    H6     U  20           H6       URI  20  -0.416  -4.379  -0.864
  220    H5'    U  21           H5'      URI  21  -4.702  -2.943   3.001
  221   H5''    U  21          H5''      URI  21  -6.096  -3.649   3.846
  222    H4'    U  21           H4'      URI  21  -6.676  -1.639   2.477
  223    H3'    U  21           H3'      URI  21  -8.052  -3.881   2.706
  224    H2'    U  21           H2'      URI  21  -7.770  -4.754   0.511
  225   HO2'    U  21          H2''      URI  21  -9.888  -4.379   0.295
  226    H1'    U  21           H1'      URI  21  -7.611  -1.941  -0.565
  227    H3     U  21           H3       URI  21  -6.249  -3.121  -4.626
  228    H5     U  21           H5       URI  21  -4.384  -6.004  -2.179
  229    H6     U  21           H6       URI  21  -5.479  -4.985  -0.261
  230    H5'    A  22           H5'      ADE  22  -9.610  -0.408   0.058
  231   H5''    A  22          H5''      ADE  22 -11.169   0.135   0.714
  232    H4'    A  22           H4'      ADE  22 -11.203   0.405  -1.690
  233    H3'    A  22           H3'      ADE  22 -13.086  -1.294  -0.373
  234    H2'    A  22           H2'      ADE  22 -12.531  -3.292  -1.491
  235   HO2'    A  22          H2''      ADE  22 -13.483  -2.863  -3.878
  236    H1'    A  22           H1'      ADE  22 -11.626  -1.621  -3.854
  237    H8     A  22           H8       ADE  22 -10.162  -4.461  -1.581
  238    H61    A  22           H62      ADE  22  -8.600  -7.068  -6.965
  239    H62    A  22           H61      ADE  22  -8.318  -7.101  -5.238
  240    H2     A  22           H2       ADE  22 -10.613  -3.148  -7.854
  241    H5'    A  23           H5'      ADE  23 -14.568  -0.356  -4.687
  242   H5''    A  23          H5''      ADE  23 -16.159   0.413  -4.532
  243    H4'    A  23           H4'      ADE  23 -16.295  -1.130  -6.365
  244    H3'    A  23           H3'      ADE  23 -17.960  -1.426  -4.154
  245    H2'    A  23           H2'      ADE  23 -16.920  -3.429  -3.367
  246   HO2'    A  23          H2''      ADE  23 -19.180  -3.846  -4.136
  247    H1'    A  23           H1'      ADE  23 -16.615  -4.081  -6.317
  248    H8     A  23           H8       ADE  23 -14.794  -4.623  -2.892
  249    H61    A  23           H61      ADE  23 -12.282  -9.407  -5.511
  250    H62    A  23           H62      ADE  23 -13.285  -9.338  -4.076
  251    H2     A  23           H2       ADE  23 -15.280  -7.650  -8.537
  252    H5'    A  24           H5'      ADE  24 -19.270  -4.487  -7.539
  253   H5''    A  24          H5''      ADE  24 -21.001  -4.213  -7.820
  254    H4'    A  24           H4'      ADE  24 -20.789  -6.559  -7.797
  255    H3'    A  24           H3'      ADE  24 -22.167  -5.417  -5.587
  256    H2'    A  24           H2'      ADE  24 -20.794  -6.231  -3.879
  257   HO2'    A  24          H2''      ADE  24 -22.389  -7.623  -3.401
  258    H1'    A  24           H1'      ADE  24 -19.923  -8.548  -5.604
  259    H8     A  24           H8       ADE  24 -18.548  -5.628  -3.394
  260    H61    A  24           H62      ADE  24 -13.996  -9.409  -2.052
  261    H62    A  24           H61      ADE  24 -15.093  -8.412  -1.120
  262    H2     A  24           H2       ADE  24 -16.879 -11.678  -4.769
  263    H5'    A  25           H5'      ADE  25 -24.701 -10.658  -5.947
  264   H5''    A  25          H5''      ADE  25 -23.044 -11.205  -5.618
  265    H4'    A  25           H4'      ADE  25 -23.724  -9.110  -7.709
  266    H3'    A  25           H3'      ADE  25 -23.507 -12.124  -8.084
  267    H2'    A  25           H2'      ADE  25 -22.565 -11.664 -10.224
  268   HO2'    A  25          H2''      ADE  25 -23.551  -9.024  -9.804
  269    H1'    A  25           H1'      ADE  25 -20.945  -9.616  -9.406
  270    H8     A  25           H8       ADE  25 -21.156 -12.419  -6.814
  271    H61    A  25           H61      ADE  25 -16.683 -15.144  -9.586
  272    H62    A  25           H62      ADE  25 -18.274 -15.827  -9.333
  273    H2     A  25           H2       ADE  25 -18.309 -11.876 -12.542
  274    H5'    C  26           H5'      CYT  26 -24.928 -10.587 -11.430
  275   H5''    C  26          H5''      CYT  26 -26.194 -11.524 -12.243
  276    H4'    C  26           H4'      CYT  26 -24.299 -11.082 -13.733
  277    H3'    C  26           H3'      CYT  26 -24.435 -14.047 -12.945
  278    H2'    C  26           H2'      CYT  26 -22.802 -14.345 -14.661
  279   HO2'    C  26          H2''      CYT  26 -22.457 -12.891 -16.263
  280    H1'    C  26           H1'      CYT  26 -21.376 -12.059 -13.964
  281    H41    C  26           H41      CYT  26 -18.576 -16.643 -10.395
  282    H42    C  26           H42      CYT  26 -19.979 -17.644 -10.698
  283    H5     C  26           H5       CYT  26 -21.632 -15.490  -9.840
  284    H6     C  26           H6       CYT  26 -22.735 -13.676 -11.046
  285    H5'    U  27           H5'      URI  27 -24.392 -13.856 -16.889
  286   H5''    U  27          H5''      URI  27 -25.404 -15.031 -17.749
  287    H4'    U  27           H4'      URI  27 -23.100 -15.201 -18.498
  288    H3'    U  27           H3'      URI  27 -23.879 -17.606 -16.793
  289    H2'    U  27           H2'      URI  27 -21.769 -18.514 -17.472
  290   HO2'    U  27          H2''      URI  27 -20.867 -16.482 -19.049
  291    H1'    U  27           H1'      URI  27 -20.376 -16.159 -17.131
  292    H3     U  27           H3       URI  27 -19.085 -18.956 -13.755
  293    H5     U  27           H5       URI  27 -22.892 -17.546 -12.589
  294    H6     U  27           H6       URI  27 -23.070 -16.451 -14.744
  295    H5'    C  28           H5'      CYT  28 -22.341 -18.910 -20.301
  296   H5''    C  28          H5''      CYT  28 -23.302 -20.176 -21.088
  297    H4'    C  28           H4'      CYT  28 -20.964 -20.837 -20.967
  298    H3'    C  28           H3'      CYT  28 -22.704 -22.406 -18.985
  299    H2'    C  28           H2'      CYT  28 -20.774 -23.773 -18.627
  300   HO2'    C  28          H2''      CYT  28 -18.861 -23.378 -19.980
  301    H1'    C  28           H1'      CYT  28 -19.012 -21.635 -18.568
  302    H41    C  28           H41      CYT  28 -20.815 -21.877 -12.409
  303    H42    C  28           H42      CYT  28 -22.141 -22.928 -12.876
  304    H5     C  28           H5       CYT  28 -22.753 -20.863 -14.818
  305    H6     C  28           H6       CYT  28 -22.156 -20.615 -17.167
  306    H5'    C  29           H5'      CYT  29 -20.869 -25.223 -20.921
  307   H5''    C  29          H5''      CYT  29 -21.914 -26.573 -21.399
  308    H4'    C  29           H4'      CYT  29 -20.061 -27.424 -20.112
  309    H3'    C  29           H3'      CYT  29 -22.646 -27.390 -18.532
  310    H2'    C  29           H2'      CYT  29 -21.469 -28.631 -16.865
  311   HO2'    C  29          H2''      CYT  29 -19.020 -28.843 -18.009
  312    H1'    C  29           H1'      CYT  29 -19.176 -27.094 -17.015
  313    H41    C  29           H41      CYT  29 -22.809 -24.611 -12.360
  314    H42    C  29           H42      CYT  29 -24.081 -24.263 -13.510
  315    H5     C  29           H5       CYT  29 -23.481 -24.068 -15.888
  316    H6     C  29           H6       CYT  29 -22.109 -25.072 -17.645
  317    H5'    C  30           H5'      CYT  30 -21.183 -31.190 -18.289
  318   H5''    C  30          H5''      CYT  30 -22.414 -32.417 -18.652
  319    H4'    C  30           H4'      CYT  30 -21.355 -32.973 -16.562
  320    H3'    C  30           H3'      CYT  30 -24.143 -31.822 -16.158
  321    H2'    C  30           H2'      CYT  30 -23.901 -32.384 -13.859
  322   HO2'    C  30          H2''      CYT  30 -21.943 -33.615 -13.229
  323    H1'    C  30           H1'      CYT  30 -21.252 -31.568 -13.669
  324    H41    C  30           H41      CYT  30 -24.766 -26.612 -11.701
  325    H42    C  30           H42      CYT  30 -25.406 -26.398 -13.314
  326    H5     C  30           H5       CYT  30 -24.503 -27.563 -15.213
  327    H6     C  30           H6       CYT  30 -23.242 -29.528 -15.927
  328    H5'    C  31           H5'      CYT  31 -24.255 -35.436 -14.188
  329   H5''    C  31          H5''      CYT  31 -25.681 -36.377 -14.662
  330    H4'    C  31           H4'      CYT  31 -25.591 -36.235 -12.251
  331    H3'    C  31           H3'      CYT  31 -27.692 -34.421 -13.438
  332   HO3'    C  31          H3T       CYT  31 -28.277 -36.661 -11.899
  333    H2'    C  31           H2'      CYT  31 -28.368 -33.815 -11.273
  334   HO2'    C  31          H2''      CYT  31 -26.872 -35.573  -9.787
  335    H1'    C  31           H1'      CYT  31 -25.790 -33.957 -10.128
  336    H41    C  31           H41      CYT  31 -27.356 -27.787 -10.883
  337    H42    C  31           H42      CYT  31 -26.801 -27.868 -12.538
  338    H5     C  31           H5       CYT  31 -26.256 -29.919 -13.639
  339    H6     C  31           H6       CYT  31 -25.911 -32.321 -13.351
  Start of MODEL    2
    1    H5'    G   1           H5'      GUA   1 -27.081 -28.335   0.408
    2   H5''    G   1          H5''      GUA   1 -28.284 -27.907  -0.826
    3    H4'    G   1           H4'      GUA   1 -27.208 -30.705  -0.316
    4    H3'    G   1           H3'      GUA   1 -26.435 -28.644  -2.370
    5    H2'    G   1           H2'      GUA   1 -26.141 -30.383  -3.939
    6   HO2'    G   1          H2''      GUA   1 -26.337 -32.298  -1.836
    7    H1'    G   1           H1'      GUA   1 -28.279 -31.956  -3.104
    8    H8     G   1           H8       GUA   1 -29.225 -28.290  -3.305
    9    H1     G   1           H1       GUA   1 -28.922 -31.102  -9.039
   10    H21    G   1           H21      GUA   1 -27.698 -33.020  -8.818
   11    H22    G   1           H22      GUA   1 -27.900 -33.908  -7.325
   12   HO5'    G   1          H5T       GUA   1 -29.632 -28.322   0.724
   13    H5'    G   2           H5'      GUA   2 -23.874 -31.845  -2.335
   14   H5''    G   2          H5''      GUA   2 -22.160 -31.414  -2.465
   15    H4'    G   2           H4'      GUA   2 -22.680 -33.128  -4.097
   16    H3'    G   2           H3'      GUA   2 -22.231 -30.410  -5.409
   17    H2'    G   2           H2'      GUA   2 -22.306 -31.621  -7.470
   18   HO2'    G   2          H2''      GUA   2 -22.211 -33.834  -7.567
   19    H1'    G   2           H1'      GUA   2 -24.554 -33.047  -6.826
   20    H8     G   2           H8       GUA   2 -24.717 -29.622  -5.211
   21    H1     G   2           H1       GUA   2 -25.900 -29.404 -11.487
   22    H21    G   2           H21      GUA   2 -25.332 -31.361 -12.427
   23    H22    G   2           H22      GUA   2 -25.150 -32.804 -11.456
   24    H5'    G   3           H5'      GUA   3 -20.107 -32.920  -7.280
   25   H5''    G   3          H5''      GUA   3 -18.419 -32.468  -7.586
   26    H4'    G   3           H4'      GUA   3 -19.521 -33.049  -9.673
   27    H3'    G   3           H3'      GUA   3 -18.973 -30.072  -9.369
   28    H2'    G   3           H2'      GUA   3 -19.789 -29.775 -11.584
   29   HO2'    G   3          H2''      GUA   3 -19.609 -31.283 -13.069
   30    H1'    G   3           H1'      GUA   3 -21.855 -31.630 -11.370
   31    H8     G   3           H8       GUA   3 -21.906 -29.696  -8.177
   32    H1     G   3           H1       GUA   3 -23.959 -26.122 -13.074
   33    H21    G   3           H21      GUA   3 -23.952 -27.513 -14.980
   34    H22    G   3           H22      GUA   3 -22.420 -28.345 -15.103
   35    H5'    G   4           H5'      GUA   4 -17.640 -31.327 -13.064
   36   H5''    G   4          H5''      GUA   4 -15.984 -30.793 -13.432
   37    H4'    G   4           H4'      GUA   4 -17.454 -30.275 -15.300
   38    H3'    G   4           H3'      GUA   4 -16.728 -27.775 -13.754
   39    H2'    G   4           H2'      GUA   4 -17.838 -26.594 -15.527
   40   HO2'    G   4          H2''      GUA   4 -17.410 -29.004 -16.875
   41    H1'    G   4           H1'      GUA   4 -20.008 -28.282 -15.579
   42    H8     G   4           H8       GUA   4 -18.854 -27.885 -11.977
   43    H1     G   4           H1       GUA   4 -22.185 -22.857 -14.108
   44    H21    G   4           H21      GUA   4 -22.570 -23.080 -16.304
   45    H22    G   4           H22      GUA   4 -21.890 -24.395 -17.233
   46    H5'    A   5           H5'      ADE   5 -16.067 -27.089 -17.700
   47   H5''    A   5          H5''      ADE   5 -14.540 -26.255 -18.064
   48    H4'    A   5           H4'      ADE   5 -16.417 -25.084 -19.102
   49    H3'    A   5           H3'      ADE   5 -15.327 -23.529 -16.710
   50    H2'    A   5           H2'      ADE   5 -16.805 -21.804 -17.397
   51   HO2'    A   5          H2''      ADE   5 -17.259 -21.524 -19.444
   52    H1'    A   5           H1'      ADE   5 -18.926 -23.500 -17.949
   53    H8     A   5           H8       ADE   5 -17.030 -24.558 -14.805
   54    H61    A   5           H61      ADE   5 -20.686 -20.990 -11.692
   55    H62    A   5           H62      ADE   5 -18.940 -21.043 -11.692
   56    H2     A   5           H2       ADE   5 -21.231 -19.888 -16.154
   57    H5'    G   6           H5'      GUA   6 -15.298 -21.074 -19.782
   58   H5''    G   6          H5''      GUA   6 -13.876 -20.019 -19.901
   59    H4'    G   6           H4'      GUA   6 -15.930 -18.704 -19.809
   60    H3'    G   6           H3'      GUA   6 -14.298 -18.590 -17.254
   61    H2'    G   6           H2'      GUA   6 -15.776 -16.872 -16.541
   62   HO2'    G   6          H2''      GUA   6 -16.268 -16.656 -19.295
   63    H1'    G   6           H1'      GUA   6 -18.070 -18.098 -17.563
   64    H8     G   6           H8       GUA   6 -15.686 -20.533 -15.868
   65    H1     G   6           H1       GUA   6 -19.200 -17.217 -11.669
   66    H21    G   6           H21      GUA   6 -20.140 -15.436 -12.758
   67    H22    G   6           H22      GUA   6 -20.560 -15.656 -14.439
   68    H5'    U   7           H5'      URI   7 -15.067 -14.998 -18.104
   69   H5''    U   7          H5''      URI   7 -13.683 -13.973 -18.536
   70    H4'    U   7           H4'      URI   7 -15.139 -12.812 -16.953
   71    H3'    U   7           H3'      URI   7 -12.357 -13.055 -16.542
   72    H2'    U   7           H2'      URI   7 -12.524 -14.713 -14.835
   73   HO2'    U   7          H2''      URI   7 -11.665 -12.614 -13.983
   74    H1'    U   7           H1'      URI   7 -14.962 -13.212 -13.825
   75    H3     U   7           H3       URI   7 -16.153 -16.033 -10.615
   76    H5     U   7           H5       URI   7 -14.118 -18.554 -13.323
   77    H6     U   7           H6       URI   7 -13.725 -16.611 -14.724
   78    H5'    A   8           H5'      ADE   8 -14.273 -11.038 -12.987
   79   H5''    A   8          H5''      ADE   8 -13.443  -9.535 -12.539
   80    H4'    A   8           H4'      ADE   8 -14.016 -10.735 -10.508
   81    H3'    A   8           H3'      ADE   8 -11.327  -9.969 -10.933
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  324    H41    C  30           H41      CYT  30 -27.264 -27.551 -11.401
  325    H42    C  30           H42      CYT  30 -28.671 -26.915 -12.221
  326    H5     C  30           H5       CYT  30 -28.744 -26.902 -14.647
  327    H6     C  30           H6       CYT  30 -28.101 -28.150 -16.642
  328    H5'    C  31           H5'      CYT  31 -27.832 -34.051 -17.321
  329   H5''    C  31          H5''      CYT  31 -28.938 -35.433 -17.209
  330    H4'    C  31           H4'      CYT  31 -27.101 -35.647 -15.603
  331    H3'    C  31           H3'      CYT  31 -29.793 -35.121 -14.280
  332   HO3'    C  31          H3T       CYT  31 -28.153 -37.430 -14.643
  333    H2'    C  31           H2'      CYT  31 -28.699 -35.379 -12.189
  334   HO2'    C  31          H2''      CYT  31 -26.183 -35.996 -13.190
  335    H1'    C  31           H1'      CYT  31 -26.441 -33.963 -12.865
  336    H41    C  31           H41      CYT  31 -30.315 -29.654 -10.179
  337    H42    C  31           H42      CYT  31 -31.382 -29.723 -11.563
  338    H5     C  31           H5       CYT  31 -30.786 -30.892 -13.584
  339    H6     C  31           H6       CYT  31 -29.374 -32.648 -14.526
  Start of MODEL    3
    1    H5'    G   1           H5'      GUA   1 -25.003 -27.933   1.065
    2   H5''    G   1          H5''      GUA   1 -23.284 -27.510   0.920
    3    H4'    G   1           H4'      GUA   1 -23.605 -29.779   0.145
    4    H3'    G   1           H3'      GUA   1 -23.108 -27.821  -2.110
    5    H2'    G   1           H2'      GUA   1 -23.042 -29.704  -3.571
    6   HO2'    G   1          H2''      GUA   1 -23.133 -31.418  -1.297
    7    H1'    G   1           H1'      GUA   1 -25.187 -31.002  -2.426
    8    H8     G   1           H8       GUA   1 -25.825 -27.272  -2.556
    9    H1     G   1           H1       GUA   1 -26.332 -30.043  -8.290
   10    H21    G   1           H21      GUA   1 -25.959 -32.326  -8.010
   11    H22    G   1           H22      GUA   1 -24.672 -32.675  -6.880
   12   HO5'    G   1          H5T       GUA   1 -24.391 -25.817   0.093
   13    H5'    G   2           H5'      GUA   2 -20.650 -31.003  -2.549
   14   H5''    G   2          H5''      GUA   2 -18.977 -30.570  -2.946
   15    H4'    G   2           H4'      GUA   2 -19.778 -32.246  -4.502
   16    H3'    G   2           H3'      GUA   2 -19.551 -29.509  -5.862
   17    H2'    G   2           H2'      GUA   2 -19.967 -30.730  -7.885
   18   HO2'    G   2          H2''      GUA   2 -19.315 -32.958  -6.263
   19    H1'    G   2           H1'      GUA   2 -22.036 -32.200  -6.839
   20    H8     G   2           H8       GUA   2 -22.049 -28.736  -5.301
   21    H1     G   2           H1       GUA   2 -24.447 -28.791 -11.230
   22    H21    G   2           H21      GUA   2 -23.911 -30.727 -12.238
   23    H22    G   2           H22      GUA   2 -23.517 -32.137 -11.282
   24    H5'    G   3           H5'      GUA   3 -17.530 -32.034  -8.060
   25   H5''    G   3          H5''      GUA   3 -15.977 -31.437  -8.679
   26    H4'    G   3           H4'      GUA   3 -17.399 -32.176 -10.515
   27    H3'    G   3           H3'      GUA   3 -17.179 -29.146 -10.381
   28    H2'    G   3           H2'      GUA   3 -18.285 -29.151 -12.507
   29   HO2'    G   3          H2''      GUA   3 -17.856 -31.978 -12.458
   30    H1'    G   3           H1'      GUA   3 -20.154 -31.025 -11.748
   31    H8     G   3           H8       GUA   3 -19.546 -28.884  -8.750
   32    H1     G   3           H1       GUA   3 -22.641 -25.642 -13.338
   33    H21    G   3           H21      GUA   3 -22.442 -26.752 -15.285
   34    H22    G   3           H22      GUA   3 -22.095 -28.472 -15.300
   35    H5'    G   4           H5'      GUA   4 -16.100 -30.370 -14.195
   36   H5''    G   4          H5''      GUA   4 -14.567 -29.640 -14.716
   37    H4'    G   4           H4'      GUA   4 -16.215 -29.362 -16.467
   38    H3'    G   4           H3'      GUA   4 -15.730 -26.770 -14.961
   39    H2'    G   4           H2'      GUA   4 -17.080 -25.724 -16.674
   40   HO2'    G   4          H2''      GUA   4 -16.592 -28.159 -17.998
   41    H1'    G   4           H1'      GUA   4 -19.065 -27.562 -16.453
   42    H8     G   4           H8       GUA   4 -17.395 -27.222 -13.057
   43    H1     G   4           H1       GUA   4 -21.152 -22.234 -14.448
   44    H21    G   4           H21      GUA   4 -21.884 -22.385 -16.545
   45    H22    G   4           H22      GUA   4 -21.381 -23.669 -17.619
   46    H5'    A   5           H5'      ADE   5 -15.427 -25.792 -18.850
   47   H5''    A   5          H5''      ADE   5 -13.985 -24.821 -19.217
   48    H4'    A   5           H4'      ADE   5 -15.920 -23.703 -20.118
   49    H3'    A   5           H3'      ADE   5 -14.900 -22.272 -17.637
   50    H2'    A   5           H2'      ADE   5 -16.533 -20.602 -18.126
   51   HO2'    A   5          H2''      ADE   5 -16.688 -21.926 -20.642
   52    H1'    A   5           H1'      ADE   5 -18.572 -22.364 -18.613
   53    H8     A   5           H8       ADE   5 -16.342 -23.822 -15.902
   54    H61    A   5           H61      ADE   5 -19.535 -20.671 -11.881
   55    H62    A   5           H62      ADE   5 -17.813 -20.873 -12.110
   56    H2     A   5           H2       ADE   5 -20.583 -18.995 -16.035
   57    H5'    G   6           H5'      GUA   6 -15.272 -19.650 -20.584
   58   H5''    G   6          H5''      GUA   6 -13.971 -18.453 -20.717
   59    H4'    G   6           H4'      GUA   6 -16.100 -17.323 -20.548
   60    H3'    G   6           H3'      GUA   6 -14.449 -17.101 -18.017
   61    H2'    G   6           H2'      GUA   6 -16.085 -15.498 -17.312
   62   HO2'    G   6          H2''      GUA   6 -16.311 -14.954 -19.846
   63    H1'    G   6           H1'      GUA   6 -18.238 -17.027 -18.039
   64    H8     G   6           H8       GUA   6 -15.293 -19.170 -16.918
   65    H1     G   6           H1       GUA   6 -18.417 -16.587 -11.969
   66    H21    G   6           H21      GUA   6 -19.827 -15.024 -12.689
   67    H22    G   6           H22      GUA   6 -20.327 -14.945 -14.361
   68    H5'    U   7           H5'      URI   7 -15.611 -13.463 -19.009
   69   H5''    U   7          H5''      URI   7 -14.245 -12.437 -19.486
   70    H4'    U   7           H4'      URI   7 -15.741 -11.197 -18.013
   71    H3'    U   7           H3'      URI   7 -12.932 -11.408 -17.489
   72    H2'    U   7           H2'      URI   7 -13.217 -12.942 -15.688
   73   HO2'    U   7          H2''      URI   7 -12.169 -11.191 -14.753
   74    H1'    U   7           H1'      URI   7 -15.661 -11.289 -14.934
   75    H3     U   7           H3       URI   7 -17.197 -13.714 -11.512
   76    H5     U   7           H5       URI   7 -14.741 -16.476 -13.552
   77    H6     U   7           H6       URI   7 -14.279 -14.748 -15.194
   78    H5'    A   8           H5'      ADE   8 -14.638  -9.388 -14.038
   79   H5''    A   8          H5''      ADE   8 -13.899  -7.799 -13.754
   80    H4'    A   8           H4'      ADE   8 -14.098  -8.919 -11.631
   81    H3'    A   8           H3'      ADE   8 -11.521  -8.035 -12.491
   82    H2'    A   8           H2'      ADE   8 -10.754 -10.280 -12.859
   83   HO2'    A   8          H2''      ADE   8  -9.869 -10.893 -10.608
   84    H1'    A   8           H1'      ADE   8 -12.408 -10.909 -10.385
   85    H8     A   8           H8       ADE   8 -12.577 -12.976 -13.602
   86    H61    A   8           H62      ADE   8 -11.025 -17.524 -10.287
   87    H62    A   8           H61      ADE   8  -9.914 -17.051 -11.554
   88    H2     A   8           H2       ADE   8 -10.148 -13.713  -7.707
   89    H5'    C   9           H5'      CYT   9  -8.608  -6.600 -11.527
   90   H5''    C   9          H5''      CYT   9  -9.278  -8.086 -12.231
   91    H4'    C   9           H4'      CYT   9  -6.863  -8.237 -12.247
   92    H3'    C   9           H3'      CYT   9  -8.132 -10.428 -11.253
   93    H2'    C   9           H2'      CYT   9  -8.124  -9.621  -8.966
   94   HO2'    C   9          H2''      CYT   9  -6.824 -11.073  -7.993
   95    H1'    C   9           H1'      CYT   9  -5.211  -8.866  -9.290
   96    H41    C   9           H41      CYT   9  -6.197  -5.301  -4.117
   97    H42    C   9           H42      CYT   9  -7.710  -6.135  -3.844
   98    H5     C   9           H5       CYT   9  -8.011  -5.154  -6.699
   99    H6     C   9           H6       CYT   9  -7.682  -6.330  -8.820
  100    H5'    G  10           H5'      GUA  10  -4.157  -7.900 -14.020
  101   H5''    G  10          H5''      GUA  10  -4.374  -8.176 -12.278
  102    H4'    G  10           H4'      GUA  10  -5.989  -6.153 -13.861
  103    H3'    G  10           H3'      GUA  10  -3.464  -5.598 -12.241
  104    H2'    G  10           H2'      GUA  10  -4.453  -3.500 -11.761
  105   HO2'    G  10          H2''      GUA  10  -6.631  -3.538 -13.390
  106    H1'    G  10           H1'      GUA  10  -7.122  -4.479 -11.788
  107    H8     G  10           H8       GUA  10  -4.530  -6.180  -9.480
  108    H1     G  10           H1       GUA  10  -7.625  -1.168  -6.932
  109    H21    G  10           H21      GUA  10  -9.575  -1.016  -9.138
  110    H22    G  10           H22      GUA  10  -8.238   0.048  -9.502
  111    H5'    G  11           H5'      GUA  11  -4.547  -2.366 -14.726
  112   H5''    G  11          H5''      GUA  11  -3.143  -1.599 -15.495
  113    H4'    G  11           H4'      GUA  11  -4.587   0.108 -14.555
  114    H3'    G  11           H3'      GUA  11  -2.166  -0.281 -12.785
  115    H2'    G  11           H2'      GUA  11  -2.894   1.663 -11.620
  116   HO2'    G  11          H2''      GUA  11  -4.554   2.998 -12.466
  117    H1'    G  11           H1'      GUA  11  -5.609   0.957 -11.800
  118    H8     G  11           H8       GUA  11  -3.410  -1.959 -10.813
  119    H1     G  11           H1       GUA  11  -4.429   2.091  -5.955
  120    H21    G  11           H21      GUA  11  -4.911   4.319  -7.341
  121    H22    G  11           H22      GUA  11  -6.505   3.710  -7.714
  122    H5'    C  12           H5'      CYT  12  -2.506   3.632 -13.767
  123   H5''    C  12          H5''      CYT  12  -0.983   4.443 -14.186
  124    H4'    C  12           H4'      CYT  12  -2.121   5.720 -12.482
  125    H3'    C  12           H3'      CYT  12   0.354   4.389 -11.323
  126    H2'    C  12           H2'      CYT  12  -0.178   5.524  -9.314
  127   HO2'    C  12          H2''      CYT  12  -1.599   7.264  -9.246
  128    H1'    C  12           H1'      CYT  12  -2.923   5.166  -9.430
  129    H41    C  12           H41      CYT  12  -0.501   0.568  -5.705
  130    H42    C  12           H42      CYT  12  -0.188  -0.409  -7.122
  131    H5     C  12           H5       CYT  12  -0.429   0.411  -9.368
  132    H6     C  12           H6       CYT  12  -1.173   2.288 -10.743
  133    H5'    C  13           H5'      CYT  13   0.038   8.359 -10.430
  134   H5''    C  13          H5''      CYT  13   1.446   9.323 -10.924
  135    H4'    C  13           H4'      CYT  13   0.771   9.908  -8.641
  136    H3'    C  13           H3'      CYT  13   3.300   9.303  -9.350
  137    H2'    C  13           H2'      CYT  13   3.441   7.156  -8.402
  138   HO2'    C  13          H2''      CYT  13   3.813   8.892  -6.177
  139    H1'    C  13           H1'      CYT  13   1.695   8.008  -6.100
  140    H41    C  13           H41      CYT  13   1.623   1.741  -5.204
  141    H42    C  13           H42      CYT  13   1.085   1.464  -6.845
  142    H5     C  13           H5       CYT  13   1.976   3.139  -8.492
  143    H6     C  13           H6       CYT  13   2.130   5.553  -8.879
  144    H5'    G  14           H5'      GUA  14   7.020  10.218  -7.036
  145   H5''    G  14          H5''      GUA  14   6.002   8.875  -7.608
  146    H4'    G  14           H4'      GUA  14   7.042   9.271  -4.781
  147    H3'    G  14           H3'      GUA  14   7.918   7.223  -6.898
  148    H2'    G  14           H2'      GUA  14   8.425   5.823  -4.990
  149   HO2'    G  14          H2''      GUA  14   8.863   6.710  -3.112
  150    H1'    G  14           H1'      GUA  14   6.008   6.118  -3.874
  151    H8     G  14           H8       GUA  14   5.909   6.666  -7.694
  152    H1     G  14           H1       GUA  14   6.072   0.501  -6.000
  153    H21    G  14           H21      GUA  14   6.445   0.330  -3.808
  154    H22    G  14           H22      GUA  14   6.178   1.680  -2.735
  155    H5'    C  15           H5'      CYT  15  12.607   7.174  -8.169
  156   H5''    C  15          H5''      CYT  15  11.246   6.761  -9.233
  157    H4'    C  15           H4'      CYT  15  12.618   4.794  -9.028
  158    H3'    C  15           H3'      CYT  15  10.011   4.625  -8.534
  159    H2'    C  15           H2'      CYT  15  10.072   5.141  -6.208
  160   HO2'    C  15          H2''      CYT  15   9.281   2.848  -6.694
  161    H1'    C  15           H1'      CYT  15  12.406   3.286  -5.742
  162    H41    C  15           H42      CYT  15  14.201   7.804  -1.503
  163    H42    C  15           H41      CYT  15  12.657   7.486  -0.747
  164    H5     C  15           H5       CYT  15  11.925   8.265  -3.614
  165    H6     C  15           H6       CYT  15  11.313   6.859  -5.519
  166    H5'    A  16           H5'      ADE  16  11.965   0.764  -6.691
  167   H5''    A  16          H5''      ADE  16  10.992  -0.661  -7.120
  168    H4'    A  16           H4'      ADE  16  11.426  -0.917  -4.819
  169    H3'    A  16           H3'      ADE  16   8.873  -0.411  -5.644
  170    H2'    A  16           H2'      ADE  16   8.533   1.637  -4.569
  171   HO2'    A  16          H2''      ADE  16   8.467  -0.118  -2.317
  172    H1'    A  16           H1'      ADE  16  10.493   0.823  -2.423
  173    H8     A  16           H8       ADE  16   9.196   3.737  -4.638
  174    H61    A  16           H61      ADE  16  11.095   7.275   0.056
  175    H62    A  16           H62      ADE  16  10.026   7.214  -1.328
  176    H2     A  16           H2       ADE  16  12.087   2.991   1.024
  177    H5'    A  17           H5'      ADE  17   9.913  -1.838  -1.502
  178   H5''    A  17          H5''      ADE  17   8.763  -2.802  -0.552
  179    H4'    A  17           H4'      ADE  17   9.974  -1.216   0.874
  180    H3'    A  17           H3'      ADE  17   7.012  -0.573   0.408
  181    H2'    A  17           H2'      ADE  17   7.252   1.149   2.069
  182   HO2'    A  17          H2''      ADE  17   8.509   0.716   3.703
  183    H1'    A  17           H1'      ADE  17   9.702   2.021   1.141
  184    H8     A  17           H8       ADE  17   7.372   1.047  -1.703
  185    H61    A  17           H61      ADE  17   4.590   6.442  -1.057
  186    H62    A  17           H62      ADE  17   5.166   5.362  -2.309
  187    H2     A  17           H2       ADE  17   7.728   6.135   2.210
  188    H5'    G  18           H5'      GUA  18   6.684   0.093   3.773
  189   H5''    G  18          H5''      GUA  18   5.231  -0.541   4.571
  190    H4'    G  18           H4'      GUA  18   5.137   1.885   4.481
  191    H3'    G  18           H3'      GUA  18   3.183   0.509   2.622
  192    H2'    G  18           H2'      GUA  18   2.306   2.702   2.101
  193   HO2'    G  18          H2''      GUA  18   3.552   3.343   4.492
  194    H1'    G  18           H1'      GUA  18   4.730   3.813   1.652
  195    H8     G  18           H8       GUA  18   5.031   0.153   0.801
  196    H1     G  18           H1       GUA  18   1.815   3.389  -3.675
  197    H21    G  18           H21      GUA  18   1.883   5.694  -3.002
  198    H22    G  18           H22      GUA  18   1.330   5.764  -1.346
  199    H5'    G  19           H5'      GUA  19   1.351   3.375   4.311
  200   H5''    G  19          H5''      GUA  19  -0.289   3.118   4.941
  201    H4'    G  19           H4'      GUA  19  -0.236   5.018   3.408
  202    H3'    G  19           H3'      GUA  19  -1.726   2.621   2.236
  203    H2'    G  19           H2'      GUA  19  -2.316   4.084   0.442
  204   HO2'    G  19          H2''      GUA  19  -2.195   5.957   2.285
  205    H1'    G  19           H1'      GUA  19   0.191   5.134   0.145
  206    H8     G  19           H8       GUA  19   0.371   1.494   1.195
  207    H1     G  19           H1       GUA  19  -0.798   2.269  -5.062
  208    H21    G  19           H21      GUA  19  -1.791   4.531  -5.185
  209    H22    G  19           H22      GUA  19  -0.523   5.563  -4.542
  210    H5'    U  20           H5'      URI  20  -4.108   5.752   1.798
  211   H5''    U  20          H5''      URI  20  -5.795   5.475   2.269
  212    H4'    U  20           H4'      URI  20  -5.718   6.349   0.017
  213    H3'    U  20           H3'      URI  20  -6.502   3.416   0.117
  214    H2'    U  20           H2'      URI  20  -6.809   3.534  -2.247
  215   HO2'    U  20          H2''      URI  20  -6.246   6.142  -2.733
  216    H1'    U  20           H1'      URI  20  -4.573   5.047  -2.778
  217    H3     U  20           H3       URI  20  -3.695   0.835  -4.312
  218    H5     U  20           H5       URI  20  -3.163   0.594  -0.132
  219    H6     U  20           H6       URI  20  -3.987   2.867   0.034
  220    H5'    U  21           H5'      URI  21  -9.041   5.230  -2.439
  221   H5''    U  21          H5''      URI  21 -10.660   5.331  -1.714
  222    H4'    U  21           H4'      URI  21 -10.900   4.789  -4.052
  223    H3'    U  21           H3'      URI  21 -11.971   3.191  -2.068
  224    H2'    U  21           H2'      URI  21 -10.759   1.244  -2.359
  225   HO2'    U  21          H2''      URI  21 -11.545   0.334  -4.653
  226    H1'    U  21           H1'      URI  21 -10.111   1.672  -5.229
  227    H3     U  21           H3       URI  21  -6.598  -1.080  -5.001
  228    H5     U  21           H5       URI  21  -6.642   0.675  -1.165
  229    H6     U  21           H6       URI  21  -8.609   1.927  -1.836
  230    H5'    A  22           H5'      ADE  22 -13.567   1.651  -6.157
  231   H5''    A  22          H5''      ADE  22 -15.342   1.641  -6.039
  232    H4'    A  22           H4'      ADE  22 -14.705  -0.404  -7.124
  233    H3'    A  22           H3'      ADE  22 -16.177  -0.650  -4.683
  234    H2'    A  22           H2'      ADE  22 -14.325  -1.432  -3.400
  235   HO2'    A  22          H2''      ADE  22 -14.673  -3.920  -4.599
  236    H1'    A  22           H1'      ADE  22 -13.409  -2.892  -5.902
  237    H8     A  22           H8       ADE  22 -11.835  -0.691  -3.071
  238    H61    A  22           H62      ADE  22  -7.076  -4.235  -3.591
  239    H62    A  22           H61      ADE  22  -8.026  -3.929  -2.152
  240    H2     A  22           H2       ADE  22 -10.370  -6.080  -6.239
  241    H5'    A  23           H5'      ADE  23 -14.792  -4.335  -7.004
  242   H5''    A  23          H5''      ADE  23 -16.158  -5.412  -7.352
  243    H4'    A  23           H4'      ADE  23 -14.173  -6.766  -7.099
  244    H3'    A  23           H3'      ADE  23 -16.437  -7.269  -5.478
  245    H2'    A  23           H2'      ADE  23 -15.505  -6.563  -3.432
  246   HO2'    A  23          H2''      ADE  23 -14.679  -9.206  -3.962
  247    H1'    A  23           H1'      ADE  23 -12.768  -7.496  -4.303
  248    H8     A  23           H8       ADE  23 -14.668  -4.435  -2.807
  249    H61    A  23           H62      ADE  23  -9.819  -3.660   0.695
  250    H62    A  23           H61      ADE  23 -11.535  -3.813   1.008
  251    H2     A  23           H2       ADE  23  -9.160  -7.540  -1.701
  252    H5'    A  24           H5'      ADE  24 -13.442 -10.656  -4.593
  253   H5''    A  24          H5''      ADE  24 -14.290 -12.178  -4.941
  254    H4'    A  24           H4'      ADE  24 -13.218 -12.553  -2.864
  255    H3'    A  24           H3'      ADE  24 -15.990 -12.574  -2.923
  256    H2'    A  24           H2'      ADE  24 -16.254 -10.459  -1.841
  257   HO2'    A  24          H2''      ADE  24 -16.144 -12.555   0.059
  258    H1'    A  24           H1'      ADE  24 -13.913 -11.313  -0.109
  259    H8     A  24           H8       ADE  24 -16.051  -8.320  -1.258
  260    H61    A  24           H61      ADE  24 -13.473  -5.226   2.915
  261    H62    A  24           H62      ADE  24 -12.992  -4.764   1.297
  262    H2     A  24           H2       ADE  24 -10.839  -9.164   2.403
  263    H5'    A  25           H5'      ADE  25 -17.504 -13.009  -1.281
  264   H5''    A  25          H5''      ADE  25 -18.497 -14.483  -1.343
  265    H4'    A  25           H4'      ADE  25 -19.631 -12.578  -2.409
  266    H3'    A  25           H3'      ADE  25 -18.878 -14.863  -4.216
  267    H2'    A  25           H2'      ADE  25 -19.971 -13.703  -5.965
  268   HO2'    A  25          H2''      ADE  25 -20.989 -11.877  -4.029
  269    H1'    A  25           H1'      ADE  25 -19.030 -11.204  -5.350
  270    H8     A  25           H8       ADE  25 -16.288 -13.780  -4.785
  271    H61    A  25           H61      ADE  25 -15.621 -14.620 -10.330
  272    H62    A  25           H62      ADE  25 -14.493 -13.349  -9.905
  273    H2     A  25           H2       ADE  25 -19.004 -11.211 -10.009
  274    H5'    C  26           H5'      CYT  26 -22.381 -13.485  -4.624
  275   H5''    C  26          H5''      CYT  26 -23.778 -14.535  -4.920
  276    H4'    C  26           H4'      CYT  26 -23.449 -12.696  -6.603
  277    H3'    C  26           H3'      CYT  26 -23.463 -15.593  -7.631
  278    H2'    C  26           H2'      CYT  26 -23.446 -14.622  -9.816
  279   HO2'    C  26          H2''      CYT  26 -23.707 -12.039  -8.643
  280    H1'    C  26           H1'      CYT  26 -21.498 -12.790  -9.280
  281    H41    C  26           H41      CYT  26 -18.012 -18.054 -10.541
  282    H42    C  26           H42      CYT  26 -19.457 -18.999 -10.275
  283    H5     C  26           H5       CYT  26 -19.734 -17.630  -7.773
  284    H6     C  26           H6       CYT  26 -20.968 -15.626  -7.131
  285    H5'    U  27           H5'      URI  27 -26.004 -13.712  -9.928
  286   H5''    U  27          H5''      URI  27 -27.529 -14.571 -10.216
  287    H4'    U  27           H4'      URI  27 -26.514 -14.029 -12.334
  288    H3'    U  27           H3'      URI  27 -26.303 -16.980 -11.672
  289    H2'    U  27           H2'      URI  27 -25.427 -17.267 -13.886
  290   HO2'    U  27          H2''      URI  27 -25.435 -14.748 -14.830
  291    H1'    U  27           H1'      URI  27 -23.758 -15.092 -13.785
  292    H3     U  27           H3       URI  27 -21.173 -18.869 -13.417
  293    H5     U  27           H5       URI  27 -22.747 -18.220  -9.550
  294    H6     U  27           H6       URI  27 -24.106 -16.443 -10.477
  295    H5'    C  28           H5'      CYT  28 -27.894 -16.580 -15.400
  296   H5''    C  28          H5''      CYT  28 -29.270 -17.649 -15.733
  297    H4'    C  28           H4'      CYT  28 -27.592 -17.853 -17.485
  298    H3'    C  28           H3'      CYT  28 -27.640 -20.280 -15.652
  299    H2'    C  28           H2'      CYT  28 -26.205 -21.307 -17.269
  300   HO2'    C  28          H2''      CYT  28 -25.984 -20.570 -19.310
  301    H1'    C  28           H1'      CYT  28 -24.614 -19.063 -17.562
  302    H41    C  28           H41      CYT  28 -21.961 -22.116 -12.518
  303    H42    C  28           H42      CYT  28 -23.397 -23.117 -12.489
  304    H5     C  28           H5       CYT  28 -24.944 -20.703 -12.440
  305    H6     C  28           H6       CYT  28 -25.974 -19.383 -14.216
  306    H5'    C  29           H5'      CYT  29 -27.991 -21.746 -19.249
  307   H5''    C  29          H5''      CYT  29 -29.258 -22.971 -19.443
  308    H4'    C  29           H4'      CYT  29 -27.155 -23.875 -20.204
  309    H3'    C  29           H3'      CYT  29 -28.043 -24.989 -17.503
  310    H2'    C  29           H2'      CYT  29 -26.230 -26.540 -17.708
  311   HO2'    C  29          H2''      CYT  29 -25.063 -25.958 -19.996
  312    H1'    C  29           H1'      CYT  29 -24.413 -24.673 -18.606
  313    H41    C  29           H41      CYT  29 -23.747 -24.717 -12.239
  314    H42    C  29           H42      CYT  29 -25.475 -24.513 -12.046
  315    H5     C  29           H5       CYT  29 -26.541 -23.184 -13.890
  316    H6     C  29           H6       CYT  29 -26.798 -23.173 -16.321
  317    H5'    C  30           H5'      CYT  30 -27.474 -28.418 -19.641
  318   H5''    C  30          H5''      CYT  30 -28.889 -29.482 -19.522
  319    H4'    C  30           H4'      CYT  30 -26.923 -30.738 -18.917
  320    H3'    C  30           H3'      CYT  30 -28.575 -29.932 -16.485
  321    H2'    C  30           H2'      CYT  30 -27.143 -31.327 -15.187
  322   HO2'    C  30          H2''      CYT  30 -25.910 -32.281 -17.570
  323    H1'    C  30           H1'      CYT  30 -24.814 -30.552 -16.482
  324    H41    C  30           H41      CYT  30 -25.437 -26.959 -11.216
  325    H42    C  30           H42      CYT  30 -26.598 -25.949 -12.045
  326    H5     C  30           H5       CYT  30 -27.345 -26.353 -14.279
  327    H6     C  30           H6       CYT  30 -27.209 -27.856 -16.196
  328    H5'    C  31           H5'      CYT  31 -28.396 -34.006 -16.055
  329   H5''    C  31          H5''      CYT  31 -30.025 -34.653 -15.784
  330    H4'    C  31           H4'      CYT  31 -28.567 -35.454 -14.041
  331    H3'    C  31           H3'      CYT  31 -30.396 -33.250 -13.107
  332   HO3'    C  31          H3T       CYT  31 -30.366 -36.085 -12.771
  333    H2'    C  31           H2'      CYT  31 -29.561 -33.487 -10.933
  334   HO2'    C  31          H2''      CYT  31 -29.633 -36.014 -11.429
  335    H1'    C  31           H1'      CYT  31 -26.933 -34.180 -11.721
  336    H41    C  31           H41      CYT  31 -26.963 -28.171  -9.487
  337    H42    C  31           H42      CYT  31 -27.437 -27.600 -11.071
  338    H5     C  31           H5       CYT  31 -28.221 -29.068 -12.799
  339    H6     C  31           H6       CYT  31 -28.415 -31.395 -13.513
  Start of MODEL    4
    1    H5'    G   1           H5'      GUA   1 -36.451 -20.548  -7.873
    2   H5''    G   1          H5''      GUA   1 -35.266 -19.653  -6.903
    3    H4'    G   1           H4'      GUA   1 -35.390 -21.915  -6.076
    4    H3'    G   1           H3'      GUA   1 -32.881 -21.358  -7.638
    5    H2'    G   1           H2'      GUA   1 -32.129 -23.526  -6.989
    6   HO2'    G   1          H2''      GUA   1 -34.176 -23.296  -5.055
    7    H1'    G   1           H1'      GUA   1 -34.530 -24.782  -7.450
    8    H8     G   1           H8       GUA   1 -33.917 -22.139 -10.100
    9    H1     G   1           H1       GUA   1 -30.133 -27.231 -10.790
   10    H21    G   1           H21      GUA   1 -30.579 -28.712  -9.102
   11    H22    G   1           H22      GUA   1 -31.072 -28.007  -7.580
   12   HO5'    G   1          H5T       GUA   1 -34.319 -19.220  -8.695
   13    H5'    G   2           H5'      GUA   2 -32.073 -23.174  -4.196
   14   H5''    G   2          H5''      GUA   2 -30.719 -22.496  -3.269
   15    H4'    G   2           H4'      GUA   2 -30.441 -24.902  -3.503
   16    H3'    G   2           H3'      GUA   2 -28.391 -23.364  -5.164
   17    H2'    G   2           H2'      GUA   2 -27.416 -25.501  -5.547
   18   HO2'    G   2          H2''      GUA   2 -28.986 -27.210  -4.256
   19    H1'    G   2           H1'      GUA   2 -29.783 -26.799  -6.060
   20    H8     G   2           H8       GUA   2 -29.923 -23.248  -7.401
   21    H1     G   2           H1       GUA   2 -26.397 -27.113 -11.078
   22    H21    G   2           H21      GUA   2 -26.035 -29.045 -10.027
   23    H22    G   2           H22      GUA   2 -26.893 -29.480  -8.567
   24    H5'    G   3           H5'      GUA   3 -26.579 -25.989  -2.945
   25   H5''    G   3          H5''      GUA   3 -25.100 -25.453  -2.124
   26    H4'    G   3           H4'      GUA   3 -24.671 -27.444  -3.466
   27    H3'    G   3           H3'      GUA   3 -23.360 -24.933  -4.619
   28    H2'    G   3           H2'      GUA   3 -22.370 -26.343  -6.264
   29   HO2'    G   3          H2''      GUA   3 -22.374 -28.116  -4.295
   30    H1'    G   3           H1'      GUA   3 -24.591 -27.974  -6.617
   31    H8     G   3           H8       GUA   3 -25.835 -24.458  -6.379
   32    H1     G   3           H1       GUA   3 -23.076 -25.607 -12.049
   33    H21    G   3           H21      GUA   3 -22.133 -27.630 -12.044
   34    H22    G   3           H22      GUA   3 -21.869 -28.510 -10.556
   35    H5'    G   4           H5'      GUA   4 -20.395 -28.020  -4.212
   36   H5''    G   4          H5''      GUA   4 -18.895 -27.375  -3.508
   37    H4'    G   4           H4'      GUA   4 -18.350 -28.666  -5.488
   38    H3'    G   4           H3'      GUA   4 -18.161 -25.702  -6.038
   39    H2'    G   4           H2'      GUA   4 -17.183 -26.352  -8.141
   40   HO2'    G   4          H2''      GUA   4 -17.466 -29.096  -7.478
   41    H1'    G   4           H1'      GUA   4 -19.173 -28.114  -8.704
   42    H8     G   4           H8       GUA   4 -20.575 -25.284  -6.564
   43    H1     G   4           H1       GUA   4 -19.551 -23.544 -12.632
   44    H21    G   4           H21      GUA   4 -18.471 -25.167 -13.715
   45    H22    G   4           H22      GUA   4 -18.039 -26.677 -12.946
   46    H5'    A   5           H5'      ADE   5 -14.733 -27.359  -7.293
   47   H5''    A   5          H5''      ADE   5 -13.292 -26.496  -6.724
   48    H4'    A   5           H4'      ADE   5 -13.090 -26.807  -9.090
   49    H3'    A   5           H3'      ADE   5 -13.691 -23.926  -8.387
   50    H2'    A   5           H2'      ADE   5 -13.470 -23.446 -10.714
   51   HO2'    A   5          H2''      ADE   5 -12.821 -25.250 -12.159
   52    H1'    A   5           H1'      ADE   5 -14.958 -25.558 -11.621
   53    H8     A   5           H8       ADE   5 -16.321 -24.300  -8.276
   54    H61    A   5           H61      ADE   5 -19.601 -20.277 -11.430
   55    H62    A   5           H62      ADE   5 -18.688 -20.258  -9.938
   56    H2     A   5           H2       ADE   5 -16.504 -22.043 -14.294
   57    H5'    G   6           H5'      GUA   6 -10.519 -24.121 -10.802
   58   H5''    G   6          H5''      GUA   6  -9.165 -23.043 -10.416
   59    H4'    G   6           H4'      GUA   6  -9.941 -22.669 -12.699
   60    H3'    G   6           H3'      GUA   6 -10.664 -20.465 -10.759
   61    H2'    G   6           H2'      GUA   6 -11.344 -19.174 -12.688
   62   HO2'    G   6          H2''      GUA   6 -10.075 -19.475 -14.365
   63    H1'    G   6           H1'      GUA   6 -12.704 -21.275 -13.836
   64    H8     G   6           H8       GUA   6 -12.990 -21.386 -10.050
   65    H1     G   6           H1       GUA   6 -16.854 -16.976 -12.616
   66    H21    G   6           H21      GUA   6 -16.228 -16.595 -14.762
   67    H22    G   6           H22      GUA   6 -15.525 -17.919 -15.661
   68    H5'    U   7           H5'      URI   7  -7.229 -17.798 -14.081
   69   H5''    U   7          H5''      URI   7  -8.178 -17.861 -12.586
   70    H4'    U   7           H4'      URI   7  -9.149 -16.784 -15.261
   71    H3'    U   7           H3'      URI   7  -7.558 -15.477 -13.450
   72    H2'    U   7           H2'      URI   7  -9.165 -15.482 -11.677
   73   HO2'    U   7          H2''      URI   7  -9.558 -13.403 -11.507
   74    H1'    U   7           H1'      URI   7 -11.231 -14.980 -13.842
   75    H3     U   7           H3       URI   7 -14.922 -15.129 -11.412
   76    H5     U   7           H5       URI   7 -12.208 -17.320  -9.033
   77    H6     U   7           H6       URI   7 -10.522 -16.950 -10.745
   78    H5'    A   8           H5'      ADE   8 -10.445 -12.203 -14.135
   79   H5''    A   8          H5''      ADE   8  -9.602 -10.721 -14.622
   80    H4'    A   8           H4'      ADE   8 -10.921 -10.053 -12.802
   81    H3'    A   8           H3'      ADE   8  -8.158  -9.985 -12.372
   82    H2'    A   8           H2'      ADE   8  -8.202 -11.848 -10.850
   83   HO2'    A   8          H2''      ADE   8  -8.585  -9.409  -9.478
   84    H1'    A   8           H1'      ADE   8 -10.821 -10.580  -9.956
   85    H8     A   8           H8       ADE   8  -8.522 -13.546  -9.409
   86    H61    A   8           H62      ADE   8 -11.442 -14.699  -4.911
   87    H62    A   8           H61      ADE   8 -12.157 -15.921  -5.941
   88    H2     A   8           H2       ADE   8 -14.229 -11.621  -7.304
   89    H5'    C   9           H5'      CYT   9 -10.868  -6.784 -12.394
   90   H5''    C   9          H5''      CYT   9  -9.526  -5.715 -12.855
   91    H4'    C   9           H4'      CYT   9 -11.566  -4.421 -12.762
   92    H3'    C   9           H3'      CYT   9  -9.294  -3.585 -11.207
   93    H2'    C   9           H2'      CYT   9 -10.265  -4.307  -9.152
   94   HO2'    C   9          H2''      CYT   9 -11.647  -2.210  -8.567
   95    H1'    C   9           H1'      CYT   9 -12.897  -3.278 -10.277
   96    H41    C   9           H41      CYT   9 -15.601  -6.671  -5.463
   97    H42    C   9           H42      CYT   9 -14.815  -5.398  -4.556
   98    H5     C   9           H5       CYT   9 -12.297  -5.728  -5.560
   99    H6     C   9           H6       CYT   9 -11.124  -4.927  -7.566
  100    H5'    G  10           H5'      GUA  10 -12.430  -0.955 -10.053
  101   H5''    G  10          H5''      GUA  10 -12.044   0.776 -10.109
  102    H4'    G  10           H4'      GUA  10 -12.985   0.246  -7.947
  103    H3'    G  10           H3'      GUA  10  -9.974   0.662  -7.868
  104    H2'    G  10           H2'      GUA  10 -10.171   0.614  -5.472
  105   HO2'    G  10          H2''      GUA  10 -12.041   0.897  -4.436
  106    H1'    G  10           H1'      GUA  10 -11.735  -1.624  -5.462
  107    H8     G  10           H8       GUA  10  -9.280  -1.757  -8.376
  108    H1     G  10           H1       GUA  10  -6.438  -2.791  -2.743
  109    H21    G  10           H21      GUA  10  -8.606  -3.088  -1.184
  110    H22    G  10           H22      GUA  10  -8.810  -1.353  -1.261
  111    H5'    G  11           H5'      GUA  11 -11.322   3.009  -4.983
  112   H5''    G  11          H5''      GUA  11 -10.727   4.677  -5.098
  113    H4'    G  11           H4'      GUA  11 -10.356   3.909  -2.862
  114    H3'    G  11           H3'      GUA  11  -7.794   4.003  -4.480
  115    H2'    G  11           H2'      GUA  11  -6.704   3.575  -2.377
  116   HO2'    G  11          H2''      GUA  11  -9.055   4.630  -1.389
  117    H1'    G  11           H1'      GUA  11  -8.442   1.612  -1.578
  118    H8     G  11           H8       GUA  11  -7.917   1.371  -5.329
  119    H1     G  11           H1       GUA  11  -2.867  -0.672  -1.961
  120    H21    G  11           H21      GUA  11  -3.372   0.968   0.290
  121    H22    G  11           H22      GUA  11  -4.292  -0.467   0.676
  122    H5'    C  12           H5'      CYT  12  -7.145   6.083  -1.114
  123   H5''    C  12          H5''      CYT  12  -6.370   7.660  -1.366
  124    H4'    C  12           H4'      CYT  12  -5.103   6.411   0.266
  125    H3'    C  12           H3'      CYT  12  -3.557   6.671  -2.340
  126    H2'    C  12           H2'      CYT  12  -1.811   5.483  -1.261
  127   HO2'    C  12          H2''      CYT  12  -3.193   5.654   1.227
  128    H1'    C  12           H1'      CYT  12  -3.380   3.650   0.080
  129    H41    C  12           H41      CYT  12  -1.481   0.992  -5.426
  130    H42    C  12           H42      CYT  12  -2.950   1.570  -6.177
  131    H5     C  12           H5       CYT  12  -4.320   3.288  -5.184
  132    H6     C  12           H6       CYT  12  -4.854   4.452  -3.108
  133    H5'    C  13           H5'      CYT  13  -1.270   7.480   0.931
  134   H5''    C  13          H5''      CYT  13  -0.506   9.084   0.918
  135    H4'    C  13           H4'      CYT  13   1.112   7.341   1.555
  136    H3'    C  13           H3'      CYT  13   1.578   9.259  -0.282
  137    H2'    C  13           H2'      CYT  13   1.428   7.948  -2.240
  138   HO2'    C  13          H2''      CYT  13   3.496   7.303  -2.845
  139    H1'    C  13           H1'      CYT  13   2.638   5.581  -0.808
  140    H41    C  13           H41      CYT  13   0.274   2.542  -5.850
  141    H42    C  13           H42      CYT  13  -1.326   3.148  -5.489
  142    H5     C  13           H5       CYT  13  -1.204   5.550  -4.638
  143    H6     C  13           H6       CYT  13  -0.262   6.839  -2.782
  144    H5'    G  14           H5'      GUA  14   5.739  10.411  -1.839
  145   H5''    G  14          H5''      GUA  14   4.184   9.734  -2.365
  146    H4'    G  14           H4'      GUA  14   6.923   8.501  -2.814
  147    H3'    G  14           H3'      GUA  14   5.109   9.951  -4.829
  148    H2'    G  14           H2'      GUA  14   6.043   8.453  -6.456
  149   HO2'    G  14          H2''      GUA  14   7.959   7.585  -6.167
  150    H1'    G  14           H1'      GUA  14   5.570   6.223  -5.033
  151    H8     G  14           H8       GUA  14   3.187   9.177  -4.244
  152    H1     G  14           H1       GUA  14   1.482   5.771  -9.379
  153    H21    G  14           H21      GUA  14   3.091   4.304  -9.876
  154    H22    G  14           H22      GUA  14   4.303   3.854  -8.703
  155    H5'    C  15           H5'      CYT  15   6.357  13.753  -7.035
  156   H5''    C  15          H5''      CYT  15   4.780  13.088  -6.567
  157    H4'    C  15           H4'      CYT  15   4.751  13.370  -8.948
  158    H3'    C  15           H3'      CYT  15   4.180  11.005  -7.854
  159    H2'    C  15           H2'      CYT  15   6.200   9.848  -8.152
  160   HO2'    C  15          H2''      CYT  15   6.192   9.079 -10.551
  161    H1'    C  15           H1'      CYT  15   6.919  11.129 -10.755
  162    H41    C  15           H41      CYT  15  12.370   9.151  -8.004
  163    H42    C  15           H42      CYT  15  12.616  10.819  -7.534
  164    H5     C  15           H5       CYT  15   9.971  10.546  -6.311
  165    H6     C  15           H6       CYT  15   7.713  10.997  -7.121
  166    H5'    A  16           H5'      ADE  16   4.261   9.903 -12.277
  167   H5''    A  16          H5''      ADE  16   2.729   9.098 -12.676
  168    H4'    A  16           H4'      ADE  16   4.440   7.738 -13.587
  169    H3'    A  16           H3'      ADE  16   2.783   6.838 -11.709
  170    H2'    A  16           H2'      ADE  16   4.300   6.682  -9.920
  171   HO2'    A  16          H2''      ADE  16   4.987   4.344 -11.409
  172    H1'    A  16           H1'      ADE  16   6.470   5.943 -11.888
  173    H8     A  16           H8       ADE  16   5.630   7.799  -8.593
  174    H61    A  16           H61      ADE  16  11.649   7.104  -7.388
  175    H62    A  16           H62      ADE  16  10.085   7.338  -6.637
  176    H2     A  16           H2       ADE  16  10.810   5.323 -11.436
  177    H5'    A  17           H5'      ADE  17   5.662   4.054 -13.786
  178   H5''    A  17          H5''      ADE  17   5.262   2.339 -13.999
  179    H4'    A  17           H4'      ADE  17   7.651   2.653 -13.529
  180    H3'    A  17           H3'      ADE  17   6.036   1.412 -11.251
  181    H2'    A  17           H2'      ADE  17   8.155   0.944 -10.206
  182   HO2'    A  17          H2''      ADE  17  10.092   1.726 -11.543
  183    H1'    A  17           H1'      ADE  17   9.181   3.443 -10.728
  184    H8     A  17           H8       ADE  17   5.443   3.529 -10.039
  185    H61    A  17           H61      ADE  17   6.614   3.159  -4.114
  186    H62    A  17           H62      ADE  17   5.620   4.109  -5.199
  187    H2     A  17           H2       ADE  17  10.626   2.975  -6.278
  188    H5'    G  18           H5'      GUA  18   8.623  -0.970 -11.076
  189   H5''    G  18          H5''      GUA  18   8.119  -2.645 -10.767
  190    H4'    G  18           H4'      GUA  18   9.259  -1.727  -8.813
  191    H3'    G  18           H3'      GUA  18   6.294  -2.195  -8.444
  192    H2'    G  18           H2'      GUA  18   6.544  -1.499  -6.168
  193   HO2'    G  18          H2''      GUA  18   9.209  -0.870  -6.209
  194    H1'    G  18           H1'      GUA  18   7.941   0.739  -6.731
  195    H8     G  18           H8       GUA  18   5.685   0.004  -9.691
  196    H1     G  18           H1       GUA  18   2.436   2.338  -4.709
  197    H21    G  18           H21      GUA  18   4.024   2.884  -3.048
  198    H22    G  18           H22      GUA  18   5.157   1.568  -2.841
  199    H5'    G  19           H5'      GUA  19   8.086  -3.403  -5.247
  200   H5''    G  19          H5''      GUA  19   7.583  -4.956  -4.548
  201    H4'    G  19           H4'      GUA  19   7.437  -3.174  -2.885
  202    H3'    G  19           H3'      GUA  19   4.714  -4.205  -3.776
  203    H2'    G  19           H2'      GUA  19   3.796  -2.807  -2.077
  204   HO2'    G  19          H2''      GUA  19   6.305  -3.085  -1.004
  205    H1'    G  19           H1'      GUA  19   5.311  -0.619  -2.697
  206    H8     G  19           H8       GUA  19   4.533  -2.618  -5.824
  207    H1     G  19           H1       GUA  19  -0.339   1.096  -3.939
  208    H21    G  19           H21      GUA  19   0.124   1.430  -1.501
  209    H22    G  19           H22      GUA  19   1.668   2.254  -1.550
  210    H5'    U  20           H5'      URI  20   4.689  -4.168   0.156
  211   H5''    U  20          H5''      URI  20   4.025  -5.616   0.938
  212    H4'    U  20           H4'      URI  20   2.872  -3.639   1.745
  213    H3'    U  20           H3'      URI  20   1.151  -5.384  -0.043
  214    H2'    U  20           H2'      URI  20  -0.640  -3.887   0.346
  215   HO2'    U  20          H2''      URI  20   0.887  -3.198   2.601
  216    H1'    U  20           H1'      URI  20   0.825  -1.556   0.205
  217    H3     U  20           H3       URI  20  -1.761  -1.688  -3.570
  218    H5     U  20           H5       URI  20   1.345  -4.451  -4.291
  219    H6     U  20           H6       URI  20   2.105  -4.090  -2.020
  220    H5'    U  21           H5'      URI  21  -0.983  -4.270   3.021
  221   H5''    U  21          H5''      URI  21  -1.481  -5.576   4.114
  222    H4'    U  21           H4'      URI  21  -3.351  -4.076   3.776
  223    H3'    U  21           H3'      URI  21  -3.496  -6.710   3.370
  224    H2'    U  21           H2'      URI  21  -3.754  -6.781   1.038
  225   HO2'    U  21          H2''      URI  21  -6.317  -5.794   1.767
  226    H1'    U  21           H1'      URI  21  -5.163  -4.139   0.971
  227    H3     U  21           H3       URI  21  -4.631  -3.568  -3.402
  228    H5     U  21           H5       URI  21  -1.137  -5.684  -2.343
  229    H6     U  21           H6       URI  21  -1.959  -5.753  -0.056
  230    H5'    A  22           H5'      ADE  22  -7.381  -4.174   2.744
  231   H5''    A  22          H5''      ADE  22  -8.585  -4.819   3.879
  232    H4'    A  22           H4'      ADE  22  -9.779  -4.101   1.937
  233    H3'    A  22           H3'      ADE  22  -9.793  -6.924   2.636
  234    H2'    A  22           H2'      ADE  22  -8.904  -7.759   0.635
  235   HO2'    A  22          H2''      ADE  22 -10.949  -7.065  -0.985
  236    H1'    A  22           H1'      ADE  22  -9.877  -5.370  -0.922
  237    H8     A  22           H8       ADE  22  -6.414  -6.950  -0.029
  238    H61    A  22           H62      ADE  22  -5.554  -6.939  -6.157
  239    H62    A  22           H61      ADE  22  -4.791  -7.211  -4.605
  240    H2     A  22           H2       ADE  22  -9.655  -5.307  -5.330
  241    H5'    A  23           H5'      ADE  23 -12.964  -5.293  -0.388
  242   H5''    A  23          H5''      ADE  23 -14.522  -5.904   0.196
  243    H4'    A  23           H4'      ADE  23 -14.679  -5.675  -2.189
  244    H3'    A  23           H3'      ADE  23 -15.188  -8.197  -1.020
  245    H2'    A  23           H2'      ADE  23 -13.099  -9.131  -1.741
  246   HO2'    A  23          H2''      ADE  23 -14.587 -10.506  -2.634
  247    H1'    A  23           H1'      ADE  23 -13.564  -7.593  -4.325
  248    H8     A  23           H8       ADE  23 -10.697  -8.742  -1.933
  249    H61    A  23           H62      ADE  23  -7.212  -8.872  -6.921
  250    H62    A  23           H61      ADE  23  -7.511  -9.897  -5.534
  251    H2     A  23           H2       ADE  23 -11.418  -7.725  -8.238
  252    H5'    A  24           H5'      ADE  24 -17.658  -6.001  -3.969
  253   H5''    A  24          H5''      ADE  24 -19.316  -6.517  -3.609
  254    H4'    A  24           H4'      ADE  24 -19.333  -5.355  -5.724
  255    H3'    A  24           H3'      ADE  24 -20.358  -7.904  -5.533
  256    H2'    A  24           H2'      ADE  24 -18.618  -9.057  -6.654
  257   HO2'    A  24          H2''      ADE  24 -19.469  -8.150  -9.104
  258    H1'    A  24           H1'      ADE  24 -18.196  -6.713  -8.504
  259    H8     A  24           H8       ADE  24 -16.222  -9.090  -6.101
  260    H61    A  24           H61      ADE  24 -12.140  -9.303 -10.674
  261    H62    A  24           H62      ADE  24 -12.174  -9.290  -8.924
  262    H2     A  24           H2       ADE  24 -15.347  -6.287 -11.807
  263    H5'    A  25           H5'      ADE  25 -23.007  -8.551 -10.321
  264   H5''    A  25          H5''      ADE  25 -21.878  -9.682  -9.545
  265    H4'    A  25           H4'      ADE  25 -21.336  -7.969 -11.998
  266    H3'    A  25           H3'      ADE  25 -21.808 -10.949 -11.715
  267    H2'    A  25           H2'      ADE  25 -20.317 -11.251 -13.570
  268   HO2'    A  25          H2''      ADE  25 -19.356  -9.118 -14.395
  269    H1'    A  25           H1'      ADE  25 -18.393  -9.619 -12.610
  270    H8     A  25           H8       ADE  25 -20.322 -11.324  -9.744
  271    H61    A  25           H61      ADE  25 -16.386 -15.823 -10.120
  272    H62    A  25           H62      ADE  25 -18.130 -15.889 -10.249
  273    H2     A  25           H2       ADE  25 -15.810 -13.176 -13.913
  274    H5'    C  26           H5'      CYT  26 -21.882 -10.189 -15.524
  275   H5''    C  26          H5''      CYT  26 -23.046 -11.085 -16.516
  276    H4'    C  26           H4'      CYT  26 -20.758 -11.440 -17.295
  277    H3'    C  26           H3'      CYT  26 -21.939 -13.957 -16.014
  278    H2'    C  26           H2'      CYT  26 -20.026 -15.030 -16.988
  279   HO2'    C  26          H2''      CYT  26 -20.092 -12.803 -18.645
  280    H1'    C  26           H1'      CYT  26 -18.277 -13.035 -16.222
  281    H41    C  26           H41      CYT  26 -18.372 -17.018 -11.140
  282    H42    C  26           H42      CYT  26 -19.780 -17.758 -11.868
  283    H5     C  26           H5       CYT  26 -20.866 -15.069 -11.968
  284    H6     C  26           H6       CYT  26 -20.891 -13.400 -13.753
  285    H5'    U  27           H5'      URI  27 -20.662 -14.868 -19.584
  286   H5''    U  27          H5''      URI  27 -21.629 -16.020 -20.522
  287    H4'    U  27           H4'      URI  27 -19.349 -16.815 -20.336
  288    H3'    U  27           H3'      URI  27 -21.255 -18.476 -18.636
  289    H2'    U  27           H2'      URI  27 -19.364 -19.931 -18.336
  290   HO2'    U  27          H2''      URI  27 -18.156 -18.372 -20.402
  291    H1'    U  27           H1'      URI  27 -17.574 -17.904 -17.868
  292    H3     U  27           H3       URI  27 -18.382 -19.965 -13.873
  293    H5     U  27           H5       URI  27 -21.758 -17.507 -14.515
  294    H6     U  27           H6       URI  27 -20.867 -16.974 -16.703
  295    H5'    C  28           H5'      CYT  28 -19.120 -20.903 -21.038
  296   H5''    C  28          H5''      CYT  28 -20.084 -22.126 -21.886
  297    H4'    C  28           H4'      CYT  28 -18.168 -23.167 -20.809
  298    H3'    C  28           H3'      CYT  28 -20.789 -23.774 -19.353
  299    H2'    C  28           H2'      CYT  28 -19.519 -25.402 -18.133
  300   HO2'    C  28          H2''      CYT  28 -17.764 -25.128 -20.307
  301    H1'    C  28           H1'      CYT  28 -17.374 -23.703 -17.745
  302    H41    C  28           H41      CYT  28 -21.241 -22.167 -12.799
  303    H42    C  28           H42      CYT  28 -22.490 -23.097 -13.601
  304    H5     C  28           H5       CYT  28 -21.838 -21.380 -15.887
  305    H6     C  28           H6       CYT  28 -20.398 -21.766 -17.817
  306    H5'    C  29           H5'      CYT  29 -19.241 -27.208 -20.004
  307   H5''    C  29          H5''      CYT  29 -20.364 -28.454 -20.576
  308    H4'    C  29           H4'      CYT  29 -19.239 -29.229 -18.580
  309    H3'    C  29           H3'      CYT  29 -22.142 -28.483 -18.081
  310    H2'    C  29           H2'      CYT  29 -21.848 -29.464 -15.914
  311   HO2'    C  29          H2''      CYT  29 -19.424 -30.492 -17.017
  312    H1'    C  29           H1'      CYT  29 -19.398 -28.291 -15.465
  313    H41    C  29           H41      CYT  29 -23.792 -24.293 -13.063
  314    H42    C  29           H42      CYT  29 -24.533 -24.133 -14.641
  315    H5     C  29           H5       CYT  29 -23.056 -24.520 -16.601
  316    H6     C  29           H6       CYT  29 -21.399 -26.080 -17.493
  317    H5'    C  30           H5'      CYT  30 -21.660 -32.229 -16.639
  318   H5''    C  30          H5''      CYT  30 -22.921 -33.350 -17.184
  319    H4'    C  30           H4'      CYT  30 -22.732 -33.523 -14.799
  320    H3'    C  30           H3'      CYT  30 -25.218 -31.996 -15.652
  321    H2'    C  30           H2'      CYT  30 -25.847 -32.034 -13.339
  322   HO2'    C  30          H2''      CYT  30 -23.631 -33.619 -12.608
  323    H1'    C  30           H1'      CYT  30 -23.330 -31.453 -12.361
  324    H41    C  30           H41      CYT  30 -26.595 -25.977 -12.952
  325    H42    C  30           H42      CYT  30 -26.163 -25.905 -14.645
  326    H5     C  30           H5       CYT  30 -25.057 -27.682 -15.797
  327    H6     C  30           H6       CYT  30 -23.978 -29.858 -15.564
  328    H5'    C  31           H5'      CYT  31 -26.651 -34.912 -13.194
  329   H5''    C  31          H5''      CYT  31 -27.965 -35.827 -13.953
  330    H4'    C  31           H4'      CYT  31 -28.681 -35.091 -11.770
  331    H3'    C  31           H3'      CYT  31 -29.909 -33.478 -14.007
  332   HO3'    C  31          H3T       CYT  31 -31.693 -34.842 -13.436
  333    H2'    C  31           H2'      CYT  31 -31.187 -32.293 -12.421
  334   HO2'    C  31          H2''      CYT  31 -31.828 -33.133 -10.559
  335    H1'    C  31           H1'      CYT  31 -29.203 -32.247 -10.443
  336    H41    C  31           H41      CYT  31 -29.319 -26.518 -13.314
  337    H42    C  31           H42      CYT  31 -28.372 -27.169 -14.631
  338    H5     C  31           H5       CYT  31 -27.683 -29.457 -14.760
  339    H6     C  31           H6       CYT  31 -27.857 -31.663 -13.731
  Start of MODEL    5
    1    H5'    G   1           H5'      GUA   1 -30.702 -19.753  -2.858
    2   H5''    G   1          H5''      GUA   1 -31.098 -20.130  -4.548
    3    H4'    G   1           H4'      GUA   1 -31.131 -22.135  -2.271
    4    H3'    G   1           H3'      GUA   1 -29.039 -21.558  -4.365
    5    H2'    G   1           H2'      GUA   1 -28.526 -23.886  -4.358
    6   HO2'    G   1          H2''      GUA   1 -29.780 -23.786  -1.853
    7    H1'    G   1           H1'      GUA   1 -31.142 -24.745  -4.281
    8    H8     G   1           H8       GUA   1 -30.858 -21.708  -6.519
    9    H1     G   1           H1       GUA   1 -28.435 -26.963  -9.225
   10    H21    G   1           H21      GUA   1 -28.726 -28.726  -7.742
   11    H22    G   1           H22      GUA   1 -28.473 -28.291  -6.069
   12   HO5'    G   1          H5T       GUA   1 -32.742 -19.761  -2.378
   13    H5'    G   2           H5'      GUA   2 -27.586 -24.171  -1.697
   14   H5''    G   2          H5''      GUA   2 -25.972 -23.759  -1.085
   15    H4'    G   2           H4'      GUA   2 -26.019 -26.083  -1.784
   16    H3'    G   2           H3'      GUA   2 -24.379 -24.379  -3.734
   17    H2'    G   2           H2'      GUA   2 -23.784 -26.450  -4.742
   18   HO2'    G   2          H2''      GUA   2 -24.790 -27.575  -2.328
   19    H1'    G   2           H1'      GUA   2 -26.323 -27.527  -4.644
   20    H8     G   2           H8       GUA   2 -26.543 -23.827  -5.402
   21    H1     G   2           H1       GUA   2 -24.904 -27.288 -10.529
   22    H21    G   2           H21      GUA   2 -24.355 -29.364  -9.893
   23    H22    G   2           H22      GUA   2 -24.789 -29.972  -8.312
   24    H5'    G   3           H5'      GUA   3 -22.181 -27.373  -2.719
   25   H5''    G   3          H5''      GUA   3 -20.484 -27.018  -2.343
   26    H4'    G   3           H4'      GUA   3 -20.622 -28.690  -4.097
   27    H3'    G   3           H3'      GUA   3 -19.643 -25.983  -5.146
   28    H2'    G   3           H2'      GUA   3 -19.318 -27.071  -7.238
   29   HO2'    G   3          H2''      GUA   3 -18.748 -29.100  -7.362
   30    H1'    G   3           H1'      GUA   3 -21.582 -28.698  -7.072
   31    H8     G   3           H8       GUA   3 -22.699 -25.290  -6.047
   32    H1     G   3           H1       GUA   3 -21.827 -25.733 -12.384
   33    H21    G   3           H21      GUA   3 -21.053 -27.819 -12.864
   34    H22    G   3           H22      GUA   3 -20.031 -28.594 -11.674
   35    H5'    G   4           H5'      GUA   4 -16.826 -28.997  -6.331
   36   H5''    G   4          H5''      GUA   4 -15.162 -28.424  -6.085
   37    H4'    G   4           H4'      GUA   4 -15.367 -29.311  -8.332
   38    H3'    G   4           H3'      GUA   4 -15.347 -26.290  -8.386
   39    H2'    G   4           H2'      GUA   4 -15.110 -26.560 -10.765
   40   HO2'    G   4          H2''      GUA   4 -15.342 -29.243 -10.995
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  281    H41    C  26           H41      CYT  26 -17.838 -17.210 -11.743
  282    H42    C  26           H42      CYT  26 -19.332 -18.048 -12.100
  283    H5     C  26           H5       CYT  26 -20.640 -15.537 -11.501
  284    H6     C  26           H6       CYT  26 -21.373 -13.701 -12.930
  285    H5'    U  27           H5'      URI  27 -22.867 -14.380 -18.770
  286   H5''    U  27          H5''      URI  27 -24.025 -15.496 -19.521
  287    H4'    U  27           H4'      URI  27 -21.779 -16.041 -20.246
  288    H3'    U  27           H3'      URI  27 -22.861 -18.081 -18.272
  289    H2'    U  27           H2'      URI  27 -20.920 -19.368 -18.788
  290   HO2'    U  27          H2''      URI  27 -19.541 -18.788 -20.510
  291    H1'    U  27           H1'      URI  27 -19.184 -17.227 -18.716
  292    H3     U  27           H3       URI  27 -18.443 -19.811 -15.000
  293    H5     U  27           H5       URI  27 -21.907 -17.568 -14.096
  294    H6     U  27           H6       URI  27 -21.867 -16.723 -16.367
  295    H5'    C  28           H5'      CYT  28 -21.584 -20.045 -21.595
  296   H5''    C  28          H5''      CYT  28 -22.712 -21.282 -22.184
  297    H4'    C  28           H4'      CYT  28 -20.478 -22.220 -21.950
  298    H3'    C  28           H3'      CYT  28 -22.373 -23.188 -19.758
  299    H2'    C  28           H2'      CYT  28 -20.650 -24.748 -19.190
  300   HO2'    C  28          H2''      CYT  28 -18.654 -24.453 -20.750
  301    H1'    C  28           H1'      CYT  28 -18.610 -22.889 -19.445
  302    H41    C  28           H41      CYT  28 -20.428 -22.111 -13.303
  303    H42    C  28           H42      CYT  28 -21.860 -23.042 -13.686
  304    H5     C  28           H5       CYT  28 -22.299 -21.253 -15.885
  305    H6     C  28           H6       CYT  28 -21.664 -21.364 -18.240
  306    H5'    C  29           H5'      CYT  29 -21.043 -26.540 -21.255
  307   H5''    C  29          H5''      CYT  29 -22.309 -27.741 -21.573
  308    H4'    C  29           H4'      CYT  29 -20.645 -28.731 -20.150
  309    H3'    C  29           H3'      CYT  29 -23.189 -28.004 -18.668
  310    H2'    C  29           H2'      CYT  29 -22.269 -29.195 -16.805
  311   HO2'    C  29          H2''      CYT  29 -19.894 -30.010 -17.752
  312    H1'    C  29           H1'      CYT  29 -19.737 -28.133 -17.071
  313    H41    C  29           H41      CYT  29 -22.864 -24.346 -12.976
  314    H42    C  29           H42      CYT  29 -24.016 -23.917 -14.220
  315    H5     C  29           H5       CYT  29 -23.363 -24.193 -16.568
  316    H6     C  29           H6       CYT  29 -22.206 -25.696 -18.110
  317    H5'    C  30           H5'      CYT  30 -22.538 -31.948 -17.831
  318   H5''    C  30          H5''      CYT  30 -23.995 -32.930 -18.073
  319    H4'    C  30           H4'      CYT  30 -23.112 -33.389 -15.880
  320    H3'    C  30           H3'      CYT  30 -25.590 -31.623 -15.768
  321    H2'    C  30           H2'      CYT  30 -25.513 -31.883 -13.401
  322   HO2'    C  30          H2''      CYT  30 -23.373 -33.545 -13.140
  323    H1'    C  30           H1'      CYT  30 -22.756 -31.646 -13.199
  324    H41    C  30           H41      CYT  30 -25.378 -25.922 -12.017
  325    H42    C  30           H42      CYT  30 -25.504 -25.627 -13.735
  326    H5     C  30           H5       CYT  30 -25.014 -27.282 -15.398
  327    H6     C  30           H6       CYT  30 -24.188 -29.544 -15.792
  328    H5'    C  31           H5'      CYT  31 -26.551 -34.802 -13.323
  329   H5''    C  31          H5''      CYT  31 -28.139 -35.462 -13.748
  330    H4'    C  31           H4'      CYT  31 -28.068 -35.015 -11.376
  331    H3'    C  31           H3'      CYT  31 -29.678 -32.965 -12.889
  332   HO3'    C  31          H3T       CYT  31 -30.936 -34.653 -11.166
  333    H2'    C  31           H2'      CYT  31 -30.245 -31.921 -10.872
  334   HO2'    C  31          H2''      CYT  31 -30.660 -33.040  -9.126
  335    H1'    C  31           H1'      CYT  31 -27.805 -32.551  -9.561
  336    H41    C  31           H41      CYT  31 -28.007 -26.291 -11.007
  337    H42    C  31           H42      CYT  31 -27.169 -26.658 -12.498
  338    H5     C  31           H5       CYT  31 -27.229 -28.884 -13.443
  339    H6     C  31           H6       CYT  31 -27.463 -31.258 -12.921
  Start of MODEL    6
    1    H5'    G   1           H5'      GUA   1 -29.944 -26.560  -0.112
    2   H5''    G   1          H5''      GUA   1 -28.250 -26.169   0.253
    3    H4'    G   1           H4'      GUA   1 -28.416 -28.521  -0.293
    4    H3'    G   1           H3'      GUA   1 -27.143 -26.880  -2.483
    5    H2'    G   1           H2'      GUA   1 -26.670 -28.939  -3.587
    6   HO2'    G   1          H2''      GUA   1 -27.690 -30.449  -1.421
    7    H1'    G   1           H1'      GUA   1 -29.138 -30.051  -3.104
    8    H8     G   1           H8       GUA   1 -29.487 -26.343  -3.820
    9    H1     G   1           H1       GUA   1 -28.155 -29.752  -9.050
   10    H21    G   1           H21      GUA   1 -27.893 -31.930  -8.467
   11    H22    G   1           H22      GUA   1 -27.370 -32.284  -6.837
   12   HO5'    G   1          H5T       GUA   1 -28.208 -24.868  -1.377
   13    H5'    G   2           H5'      GUA   2 -24.897 -30.114  -1.710
   14   H5''    G   2          H5''      GUA   2 -23.168 -29.758  -1.525
   15    H4'    G   2           H4'      GUA   2 -23.463 -31.617  -3.066
   16    H3'    G   2           H3'      GUA   2 -22.582 -29.085  -4.543
   17    H2'    G   2           H2'      GUA   2 -22.361 -30.503  -6.442
   18   HO2'    G   2          H2''      GUA   2 -23.126 -32.864  -5.206
   19    H1'    G   2           H1'      GUA   2 -24.740 -31.832  -6.041
   20    H8     G   2           H8       GUA   2 -25.107 -28.196  -5.038
   21    H1     G   2           H1       GUA   2 -25.223 -29.015 -11.378
   22    H21    G   2           H21      GUA   2 -24.543 -31.087 -11.884
   23    H22    G   2           H22      GUA   2 -24.484 -32.343 -10.671
   24    H5'    G   3           H5'      GUA   3 -20.186 -31.952  -5.596
   25   H5''    G   3          H5''      GUA   3 -18.460 -31.541  -5.646
   26    H4'    G   3           H4'      GUA   3 -19.208 -32.426  -7.799
   27    H3'    G   3           H3'      GUA   3 -18.603 -29.428  -7.926
   28    H2'    G   3           H2'      GUA   3 -19.015 -29.563 -10.263
   29   HO2'    G   3          H2''      GUA   3 -18.664 -31.334 -11.387
   30    H1'    G   3           H1'      GUA   3 -21.131 -31.360 -10.059
   31    H8     G   3           H8       GUA   3 -21.627 -28.798  -7.397
   32    H1     G   3           H1       GUA   3 -22.871 -26.409 -13.205
   33    H21    G   3           H21      GUA   3 -22.481 -28.056 -14.762
   34    H22    G   3           H22      GUA   3 -21.144 -29.129 -14.415
   35    H5'    G   4           H5'      GUA   4 -16.519 -31.309 -11.076
   36   H5''    G   4          H5''      GUA   4 -14.833 -30.752 -11.151
   37    H4'    G   4           H4'      GUA   4 -15.826 -30.611 -13.365
   38    H3'    G   4           H3'      GUA   4 -15.606 -27.856 -12.124
   39    H2'    G   4           H2'      GUA   4 -16.240 -27.064 -14.315
   40   HO2'    G   4          H2''      GUA   4 -16.114 -29.795 -15.148
   41    H1'    G   4           H1'      GUA   4 -18.335 -28.793 -14.511
   42    H8     G   4           H8       GUA   4 -17.878 -27.856 -10.850
   43    H1     G   4           H1       GUA   4 -20.696 -23.255 -14.282
   44    H21    G   4           H21      GUA   4 -20.640 -23.785 -16.451
   45    H22    G   4           H22      GUA   4 -19.877 -25.246 -17.031
   46    H5'    A   5           H5'      ADE   5 -13.979 -27.639 -15.807
   47   H5''    A   5          H5''      ADE   5 -12.425 -26.780 -15.865
   48    H4'    A   5           H4'      ADE   5 -13.930 -25.827 -17.507
   49    H3'    A   5           H3'      ADE   5 -13.563 -23.928 -15.145
   50    H2'    A   5           H2'      ADE   5 -14.879 -22.386 -16.394
   51   HO2'    A   5          H2''      ADE   5 -15.383 -23.862 -18.630
   52    H1'    A   5           H1'      ADE   5 -16.782 -24.200 -17.172
   53    H8     A   5           H8       ADE   5 -15.578 -25.035 -13.656
   54    H61    A   5           H61      ADE   5 -19.849 -21.256 -11.614
   55    H62    A   5           H62      ADE   5 -18.181 -21.564 -11.191
   56    H2     A   5           H2       ADE   5 -19.471 -20.557 -16.119
   57    H5'    G   6           H5'      GUA   6 -12.862 -21.936 -18.491
   58   H5''    G   6          H5''      GUA   6 -11.527 -20.770 -18.440
   59    H4'    G   6           H4'      GUA   6 -13.597 -19.681 -19.112
   60    H3'    G   6           H3'      GUA   6 -12.739 -18.971 -16.291
   61    H2'    G   6           H2'      GUA   6 -14.418 -17.232 -16.421
   62   HO2'    G   6          H2''      GUA   6 -15.114 -17.938 -19.057
   63    H1'    G   6           H1'      GUA   6 -16.310 -18.926 -17.482
   64    H8     G   6           H8       GUA   6 -14.070 -20.780 -15.049
   65    H1     G   6           H1       GUA   6 -18.437 -17.189 -12.052
   66    H21    G   6           H21      GUA   6 -19.361 -15.750 -13.527
   67    H22    G   6           H22      GUA   6 -19.392 -16.162 -15.224
   68    H5'    U   7           H5'      URI   7 -11.928 -14.301 -18.734
   69   H5''    U   7          H5''      URI   7 -11.976 -15.278 -17.257
   70    H4'    U   7           H4'      URI   7 -14.141 -13.363 -18.178
   71    H3'    U   7           H3'      URI   7 -11.646 -12.775 -16.904
   72    H2'    U   7           H2'      URI   7 -12.255 -13.492 -14.765
   73   HO2'    U   7          H2''      URI   7 -14.097 -11.567 -14.266
   74    H1'    U   7           H1'      URI   7 -15.176 -12.972 -15.252
   75    H3     U   7           H3       URI   7 -16.384 -15.045 -11.503
   76    H5     U   7           H5       URI   7 -13.093 -17.348 -12.790
   77    H6     U   7           H6       URI   7 -12.868 -15.838 -14.683
   78    H5'    A   8           H5'      ADE   8 -11.410  -8.190 -14.595
   79   H5''    A   8          H5''      ADE   8 -10.169  -9.360 -15.083
   80    H4'    A   8           H4'      ADE   8 -10.096  -9.069 -12.680
   81    H3'    A   8           H3'      ADE   8 -10.420 -11.614 -13.871
   82    H2'    A   8           H2'      ADE   8 -12.519 -12.086 -12.952
   83   HO2'    A   8          H2''      ADE   8 -12.203 -13.317 -11.217
   84    H1'    A   8           H1'      ADE   8 -12.006 -10.337 -10.552
   85    H8     A   8           H8       ADE   8 -14.588  -9.814 -13.354
   86    H61    A   8           H61      ADE   8 -18.828 -11.309  -9.203
   87    H62    A   8           H62      ADE   8 -18.530 -11.192 -10.924
   88    H2     A   8           H2       ADE   8 -14.769 -12.251  -7.415
   89    H5'    C   9           H5'      CYT   9  -6.149  -9.546 -12.460
   90   H5''    C   9          H5''      CYT   9  -7.815  -8.968 -12.280
   91    H4'    C   9           H4'      CYT   9  -6.135  -8.650 -14.794
   92    H3'    C   9           H3'      CYT   9  -5.723  -7.002 -12.506
   93    H2'    C   9           H2'      CYT   9  -7.968  -6.137 -12.559
   94   HO2'    C   9          H2''      CYT   9  -6.731  -4.309 -12.695
   95    H1'    C   9           H1'      CYT   9  -7.624  -6.074 -15.581
   96    H41    C   9           H41      CYT   9 -14.002  -5.349 -15.814
   97    H42    C   9           H42      CYT   9 -13.745  -4.105 -14.612
   98    H5     C   9           H5       CYT   9 -12.048  -4.855 -12.858
   99    H6     C   9           H6       CYT   9  -9.709  -5.572 -12.685
  100    H5'    G  10           H5'      GUA  10  -6.291  -4.140 -15.156
  101   H5''    G  10          H5''      GUA  10  -4.924  -3.064 -15.504
  102    H4'    G  10           H4'      GUA  10  -7.091  -1.874 -15.005
  103    H3'    G  10           H3'      GUA  10  -4.761  -1.389 -13.052
  104    H2'    G  10           H2'      GUA  10  -6.131   0.349 -12.134
  105   HO2'    G  10          H2''      GUA  10  -7.931   1.123 -13.150
  106    H1'    G  10           H1'      GUA  10  -8.383  -1.203 -12.067
  107    H8     G  10           H8       GUA  10  -5.297  -3.323 -11.364
  108    H1     G  10           H1       GUA  10  -7.052   0.251  -6.352
  109    H21    G  10           H21      GUA  10  -9.697   1.177  -8.058
  110    H22    G  10           H22      GUA  10  -8.352   2.125  -7.463
  111    H5'    G  11           H5'      GUA  11  -6.048   2.248 -14.160
  112   H5''    G  11          H5''      GUA  11  -4.736   3.301 -14.723
  113    H4'    G  11           H4'      GUA  11  -6.103   4.500 -13.123
  114    H3'    G  11           H3'      GUA  11  -3.430   3.679 -11.934
  115    H2'    G  11           H2'      GUA  11  -4.032   5.034 -10.063
  116   HO2'    G  11          H2''      GUA  11  -6.449   5.883 -11.207
  117    H1'    G  11           H1'      GUA  11  -6.639   4.134  -9.954
  118    H8     G  11           H8       GUA  11  -4.285   1.289 -10.857
  119    H1     G  11           H1       GUA  11  -3.958   2.909  -4.672
  120    H21    G  11           H21      GUA  11  -4.746   5.438  -4.849
  121    H22    G  11           H22      GUA  11  -6.398   4.891  -5.022
  122    H5'    C  12           H5'      CYT  12  -3.859   7.646 -11.290
  123   H5''    C  12          H5''      CYT  12  -2.429   8.620 -11.687
  124    H4'    C  12           H4'      CYT  12  -3.144   9.125  -9.429
  125    H3'    C  12           H3'      CYT  12  -0.515   7.596  -9.417
  126    H2'    C  12           H2'      CYT  12  -0.556   7.777  -7.068
  127   HO2'    C  12          H2''      CYT  12  -1.575   9.370  -6.021
  128    H1'    C  12           H1'      CYT  12  -3.258   7.329  -6.702
  129    H41    C  12           H41      CYT  12  -0.168   1.767  -5.938
  130    H42    C  12           H42      CYT  12  -0.309   1.468  -7.657
  131    H5     C  12           H5       CYT  12  -1.024   3.153  -9.223
  132    H6     C  12           H6       CYT  12  -1.980   5.387  -9.463
  133    H5'    C  13           H5'      CYT  13  -0.502  10.725  -6.937
  134   H5''    C  13          H5''      CYT  13   0.761  11.939  -7.233
  135    H4'    C  13           H4'      CYT  13   0.610  11.395  -4.844
  136    H3'    C  13           H3'      CYT  13   2.889  11.502  -6.238
  137    H2'    C  13           H2'      CYT  13   3.292   9.188  -6.466
  138   HO2'    C  13          H2''      CYT  13   4.657   8.510  -4.728
  139    H1'    C  13           H1'      CYT  13   2.182   8.709  -3.696
  140    H41    C  13           H41      CYT  13   2.096   2.692  -5.737
  141    H42    C  13           H42      CYT  13   1.065   3.147  -7.074
  142    H5     C  13           H5       CYT  13   1.851   5.405  -8.004
  143    H6     C  13           H6       CYT  13   2.045   7.747  -7.311
  144    H5'    G  14           H5'      GUA  14   7.065  11.671  -4.436
  145   H5''    G  14          H5''      GUA  14   5.991  10.638  -5.401
  146    H4'    G  14           H4'      GUA  14   7.577   9.812  -2.945
  147    H3'    G  14           H3'      GUA  14   8.010   9.049  -5.896
  148    H2'    G  14           H2'      GUA  14   8.871   6.984  -5.015
  149   HO2'    G  14          H2''      GUA  14   9.697   6.900  -3.059
  150    H1'    G  14           H1'      GUA  14   6.774   6.515  -3.408
  151    H8     G  14           H8       GUA  14   5.874   8.689  -6.473
  152    H1     G  14           H1       GUA  14   5.971   2.418  -7.739
  153    H21    G  14           H21      GUA  14   6.882   1.319  -6.018
  154    H22    G  14           H22      GUA  14   6.940   2.031  -4.426
  155    H5'    C  15           H5'      CYT  15  12.030  10.019  -8.138
  156   H5''    C  15          H5''      CYT  15  10.375   9.835  -8.753
  157    H4'    C  15           H4'      CYT  15  11.761   8.216  -9.889
  158    H3'    C  15           H3'      CYT  15   9.518   7.463  -8.706
  159    H2'    C  15           H2'      CYT  15  10.372   6.832  -6.588
  160   HO2'    C  15          H2''      CYT  15   9.585   4.870  -7.912
  161    H1'    C  15           H1'      CYT  15  12.806   5.496  -7.741
  162    H41    C  15           H41      CYT  15  15.564   7.001  -2.228
  163    H42    C  15           H42      CYT  15  14.670   8.502  -2.136
  164    H5     C  15           H5       CYT  15  12.759   8.946  -3.542
  165    H6     C  15           H6       CYT  15  11.613   8.335  -5.613
  166    H5'    A  16           H5'      ADE  16  11.620   3.454  -9.481
  167   H5''    A  16          H5''      ADE  16  10.504   2.343 -10.303
  168    H4'    A  16           H4'      ADE  16  11.443   1.065  -8.558
  169    H3'    A  16           H3'      ADE  16   8.797   1.723  -8.425
  170    H2'    A  16           H2'      ADE  16   8.803   2.986  -6.467
  171   HO2'    A  16          H2''      ADE  16   9.172   0.368  -5.380
  172    H1'    A  16           H1'      ADE  16  11.190   1.428  -5.469
  173    H8     A  16           H8       ADE  16   9.568   4.949  -5.784
  174    H61    A  16           H61      ADE  16  12.524   6.066  -0.483
  175    H62    A  16           H62      ADE  16  11.209   6.585  -1.515
  176    H2     A  16           H2       ADE  16  13.537   1.880  -1.800
  177    H5'    A  17           H5'      ADE  17  10.706  -1.413  -5.804
  178   H5''    A  17          H5''      ADE  17   9.762  -2.790  -5.201
  179    H4'    A  17           H4'      ADE  17  11.321  -1.990  -3.495
  180    H3'    A  17           H3'      ADE  17   8.364  -1.423  -2.959
  181    H2'    A  17           H2'      ADE  17   9.001  -0.634  -0.795
  182   HO2'    A  17          H2''      ADE  17  10.756  -2.492  -0.830
  183    H1'    A  17           H1'      ADE  17  11.241   0.721  -1.675
  184    H8     A  17           H8       ADE  17   8.321   1.063  -4.104
  185    H61    A  17           H61      ADE  17   6.074   5.443  -0.492
  186    H62    A  17           H62      ADE  17   6.273   5.049  -2.187
  187    H2     A  17           H2       ADE  17   9.824   3.850   1.493
  188    H5'    G  18           H5'      GUA  18   8.891  -2.424   0.342
  189   H5''    G  18          H5''      GUA  18   7.596  -3.366   1.105
  190    H4'    G  18           H4'      GUA  18   7.712  -1.136   2.083
  191    H3'    G  18           H3'      GUA  18   5.244  -1.621   0.395
  192    H2'    G  18           H2'      GUA  18   4.489   0.578   1.032
  193   HO2'    G  18          H2''      GUA  18   6.669   0.511   2.879
  194    H1'    G  18           H1'      GUA  18   6.836   1.813   0.515
  195    H8     G  18           H8       GUA  18   6.627  -1.127  -1.835
  196    H1     G  18           H1       GUA  18   2.888   3.718  -3.678
  197    H21    G  18           H21      GUA  18   3.158   5.444  -2.145
  198    H22    G  18           H22      GUA  18   3.246   4.898  -0.487
  199    H5'    G  19           H5'      GUA  19   4.103   0.258   3.587
  200   H5''    G  19          H5''      GUA  19   2.630  -0.299   4.405
  201    H4'    G  19           H4'      GUA  19   2.471   2.074   3.848
  202    H3'    G  19           H3'      GUA  19   0.606   0.342   2.167
  203    H2'    G  19           H2'      GUA  19  -0.273   2.412   1.333
  204   HO2'    G  19          H2''      GUA  19   0.525   4.427   2.253
  205    H1'    G  19           H1'      GUA  19   2.170   3.571   0.930
  206    H8     G  19           H8       GUA  19   2.380  -0.157   0.303
  207    H1     G  19           H1       GUA  19  -0.193   3.047  -4.605
  208    H21    G  19           H21      GUA  19  -1.102   5.104  -3.525
  209    H22    G  19           H22      GUA  19   0.353   5.843  -2.896
  210    H5'    U  20           H5'      URI  20  -1.567   3.289   3.575
  211   H5''    U  20          H5''      URI  20  -3.153   2.831   4.228
  212    H4'    U  20           H4'      URI  20  -3.426   4.535   2.527
  213    H3'    U  20           H3'      URI  20  -4.404   1.808   1.673
  214    H2'    U  20           H2'      URI  20  -5.133   2.784  -0.348
  215   HO2'    U  20          H2''      URI  20  -4.584   5.378   0.676
  216    H1'    U  20           H1'      URI  20  -2.960   4.464  -0.710
  217    H3     U  20           H3       URI  20  -2.730   1.211  -3.939
  218    H5     U  20           H5       URI  20  -1.403  -0.671  -0.402
  219    H6     U  20           H6       URI  20  -1.985   1.346   0.807
  220    H5'    U  21           H5'      URI  21  -7.009   4.458   0.651
  221   H5''    U  21          H5''      URI  21  -8.609   4.332   1.413
  222    H4'    U  21           H4'      URI  21  -8.862   4.741  -0.973
  223    H3'    U  21           H3'      URI  21 -10.157   2.661   0.347
  224    H2'    U  21           H2'      URI  21  -8.833   0.898  -0.505
  225   HO2'    U  21          H2''      URI  21 -10.119  -0.104  -1.878
  226    H1'    U  21           H1'      URI  21  -8.625   2.325  -3.161
  227    H3     U  21           H3       URI  21  -5.566  -0.395  -4.911
  228    H5     U  21           H5       URI  21  -4.693  -0.584  -0.788
  229    H6     U  21           H6       URI  21  -6.556   0.923  -0.396
  230    H5'    A  22           H5'      ADE  22 -13.018   0.763   0.222
  231   H5''    A  22          H5''      ADE  22 -11.323   0.620  -0.282
  232    H4'    A  22           H4'      ADE  22 -13.704  -0.894  -1.413
  233    H3'    A  22           H3'      ADE  22 -11.928  -1.531   0.702
  234    H2'    A  22           H2'      ADE  22 -10.119  -2.224  -0.640
  235   HO2'    A  22          H2''      ADE  22 -11.360  -4.197   0.232
  236    H1'    A  22           H1'      ADE  22 -12.160  -3.019  -2.734
  237    H8     A  22           H8       ADE  22  -8.565  -1.596  -2.223
  238    H61    A  22           H62      ADE  22  -7.614  -3.681  -7.969
  239    H62    A  22           H61      ADE  22  -6.837  -3.091  -6.517
  240    H2     A  22           H2       ADE  22 -11.922  -4.414  -6.916
  241    H5'    A  23           H5'      ADE  23 -15.964  -2.795  -0.703
  242   H5''    A  23          H5''      ADE  23 -17.235  -3.192   0.470
  243    H4'    A  23           H4'      ADE  23 -17.668  -4.472  -1.514
  244    H3'    A  23           H3'      ADE  23 -17.298  -5.715   0.915
  245    H2'    A  23           H2'      ADE  23 -15.108  -6.542   0.430
  246   HO2'    A  23          H2''      ADE  23 -16.271  -8.630  -0.972
  247    H1'    A  23           H1'      ADE  23 -16.154  -7.064  -2.368
  248    H8     A  23           H8       ADE  23 -12.912  -5.683  -0.653
  249    H61    A  23           H62      ADE  23  -9.928  -9.311  -4.517
  250    H62    A  23           H61      ADE  23  -9.824  -7.633  -4.028
  251    H2     A  23           H2       ADE  23 -14.386  -9.673  -5.471
  252    H5'    A  24           H5'      ADE  24 -18.124  -9.263  -1.843
  253   H5''    A  24          H5''      ADE  24 -19.714  -9.915  -1.401
  254    H4'    A  24           H4'      ADE  24 -18.222 -11.774  -1.800
  255    H3'    A  24           H3'      ADE  24 -19.513 -11.541   0.690
  256    H2'    A  24           H2'      ADE  24 -17.560 -11.004   1.944
  257   HO2'    A  24          H2''      ADE  24 -17.602 -12.772   3.088
  258    H1'    A  24           H1'      ADE  24 -16.025 -12.857   0.095
  259    H8     A  24           H8       ADE  24 -15.125  -9.184   0.469
  260    H61    A  24           H62      ADE  24 -10.676 -10.985   4.322
  261    H62    A  24           H61      ADE  24 -11.111  -9.758   3.151
  262    H2     A  24           H2       ADE  24 -13.148 -14.611   3.277
  263    H5'    A  25           H5'      ADE  25 -22.215 -14.043  -2.522
  264   H5''    A  25          H5''      ADE  25 -20.786 -14.878  -3.163
  265    H4'    A  25           H4'      ADE  25 -21.733 -12.114  -3.982
  266    H3'    A  25           H3'      ADE  25 -21.965 -14.787  -5.399
  267    H2'    A  25           H2'      ADE  25 -21.778 -13.572  -7.449
  268   HO2'    A  25          H2''      ADE  25 -21.628 -11.225  -7.362
  269    H1'    A  25           H1'      ADE  25 -19.648 -12.095  -6.653
  270    H8     A  25           H8       ADE  25 -19.568 -15.535  -4.971
  271    H61    A  25           H61      ADE  25 -16.573 -17.598  -9.815
  272    H62    A  25           H62      ADE  25 -17.897 -18.187  -8.833
  273    H2     A  25           H2       ADE  25 -18.157 -13.426 -10.879
  274    H5'    C  26           H5'      CYT  26 -24.230 -12.316  -7.360
  275   H5''    C  26          H5''      CYT  26 -25.764 -12.979  -7.949
  276    H4'    C  26           H4'      CYT  26 -24.466 -12.068  -9.791
  277    H3'    C  26           H3'      CYT  26 -24.566 -15.124  -9.842
  278    H2'    C  26           H2'      CYT  26 -23.699 -14.854 -12.069
  279   HO2'    C  26          H2''      CYT  26 -24.153 -12.050 -11.733
  280    H1'    C  26           H1'      CYT  26 -21.865 -12.926 -11.327
  281    H41    C  26           H41      CYT  26 -18.703 -18.474 -10.412
  282    H42    C  26           H42      CYT  26 -20.253 -19.279 -10.517
  283    H5     C  26           H5       CYT  26 -21.168 -17.442  -8.496
  284    H6     C  26           H6       CYT  26 -22.313 -15.291  -8.637
  285    H5'    U  27           H5'      URI  27 -25.983 -13.789 -13.285
  286   H5''    U  27          H5''      URI  27 -27.367 -14.678 -13.946
  287    H4'    U  27           H4'      URI  27 -25.584 -14.596 -15.587
  288    H3'    U  27           H3'      URI  27 -25.877 -17.366 -14.385
  289    H2'    U  27           H2'      URI  27 -24.334 -18.061 -16.068
  290   HO2'    U  27          H2''      URI  27 -23.843 -16.838 -17.831
  291    H1'    U  27           H1'      URI  27 -22.627 -15.934 -15.705
  292    H3     U  27           H3       URI  27 -20.673 -19.676 -13.918
  293    H5     U  27           H5       URI  27 -23.516 -18.462 -11.040
  294    H6     U  27           H6       URI  27 -24.263 -16.761 -12.600
  295    H5'    C  28           H5'      CYT  28 -26.028 -17.586 -18.421
  296   H5''    C  28          H5''      CYT  28 -27.312 -18.636 -19.050
  297    H4'    C  28           H4'      CYT  28 -25.178 -19.219 -20.059
  298    H3'    C  28           H3'      CYT  28 -26.123 -21.293 -18.031
  299    H2'    C  28           H2'      CYT  28 -24.344 -22.661 -18.841
  300   HO2'    C  28          H2''      CYT  28 -24.789 -21.449 -21.129
  301    H1'    C  28           H1'      CYT  28 -22.499 -20.603 -18.893
  302    H41    C  28           H41      CYT  28 -22.029 -22.650 -12.791
  303    H42    C  28           H42      CYT  28 -23.509 -23.551 -13.061
  304    H5     C  28           H5       CYT  28 -24.674 -21.099 -13.997
  305    H6     C  28           H6       CYT  28 -24.906 -20.145 -16.229
  306    H5'    C  29           H5'      CYT  29 -25.460 -23.409 -21.182
  307   H5''    C  29          H5''      CYT  29 -26.761 -24.545 -21.581
  308    H4'    C  29           H4'      CYT  29 -24.687 -25.756 -21.394
  309    H3'    C  29           H3'      CYT  29 -26.548 -26.180 -19.025
  310    H2'    C  29           H2'      CYT  29 -25.006 -27.865 -18.290
  311   HO2'    C  29          H2''      CYT  29 -24.614 -28.232 -20.861
  312    H1'    C  29           H1'      CYT  29 -22.742 -26.395 -18.854
  313    H41    C  29           H41      CYT  29 -24.116 -25.156 -12.744
  314    H42    C  29           H42      CYT  29 -25.674 -24.502 -13.194
  315    H5     C  29           H5       CYT  29 -25.932 -23.665 -15.506
  316    H6     C  29           H6       CYT  29 -25.414 -24.191 -17.836
  317    H5'    C  30           H5'      CYT  30 -25.617 -29.968 -20.271
  318   H5''    C  30          H5''      CYT  30 -27.065 -30.974 -20.462
  319    H4'    C  30           H4'      CYT  30 -25.483 -32.152 -19.084
  320    H3'    C  30           H3'      CYT  30 -27.784 -30.984 -17.457
  321    H2'    C  30           H2'      CYT  30 -26.894 -32.166 -15.585
  322   HO2'    C  30          H2''      CYT  30 -26.096 -33.888 -17.484
  323    H1'    C  30           H1'      CYT  30 -24.231 -31.634 -16.182
  324    H41    C  30           H41      CYT  30 -26.039 -27.206 -11.945
  325    H42    C  30           H42      CYT  30 -27.013 -26.417 -13.165
  326    H5     C  30           H5       CYT  30 -27.057 -27.118 -15.455
  327    H6     C  30           H6       CYT  30 -26.459 -28.897 -17.012
  328    H5'    C  31           H5'      CYT  31 -27.881 -34.985 -16.449
  329   H5''    C  31          H5''      CYT  31 -29.529 -35.629 -16.575
  330    H4'    C  31           H4'      CYT  31 -28.629 -36.130 -14.381
  331    H3'    C  31           H3'      CYT  31 -30.644 -33.885 -14.325
  332   HO3'    C  31          H3T       CYT  31 -30.647 -36.696 -13.870
  333    H2'    C  31           H2'      CYT  31 -30.472 -33.799 -11.988
  334   HO2'    C  31          H2''      CYT  31 -28.983 -36.154 -11.704
  335    H1'    C  31           H1'      CYT  31 -27.738 -34.568 -11.908
  336    H41    C  31           H41      CYT  31 -28.260 -28.333 -10.448
  337    H42    C  31           H42      CYT  31 -28.018 -27.968 -12.140
  338    H5     C  31           H5       CYT  31 -28.457 -29.621 -13.849
  339    H6     C  31           H6       CYT  31 -28.552 -32.013 -14.323
  Start of MODEL    7
    1    H5'    G   1           H5'      GUA   1 -27.565 -27.756   1.301
    2   H5''    G   1          H5''      GUA   1 -25.934 -27.054   1.302
    3    H4'    G   1           H4'      GUA   1 -25.776 -29.378   0.673
    4    H3'    G   1           H3'      GUA   1 -25.353 -27.499  -1.639
    5    H2'    G   1           H2'      GUA   1 -24.910 -29.368  -2.996
    6   HO2'    G   1          H2''      GUA   1 -24.085 -31.215  -2.251
    7    H1'    G   1           H1'      GUA   1 -26.763 -31.088  -1.781
    8    H8     G   1           H8       GUA   1 -28.293 -27.712  -2.553
    9    H1     G   1           H1       GUA   1 -27.687 -31.416  -7.732
   10    H21    G   1           H21      GUA   1 -26.199 -33.069  -7.266
   11    H22    G   1           H22      GUA   1 -26.100 -33.645  -5.618
   12   HO5'    G   1          H5T       GUA   1 -26.626 -25.670  -0.086
   13    H5'    G   2           H5'      GUA   2 -22.420 -30.362  -1.382
   14   H5''    G   2          H5''      GUA   2 -20.771 -29.758  -1.633
   15    H4'    G   2           H4'      GUA   2 -21.159 -31.707  -3.035
   16    H3'    G   2           H3'      GUA   2 -21.039 -29.154  -4.718
   17    H2'    G   2           H2'      GUA   2 -21.107 -30.630  -6.594
   18   HO2'    G   2          H2''      GUA   2 -21.282 -33.052  -5.439
   19    H1'    G   2           H1'      GUA   2 -23.123 -32.203  -5.606
   20    H8     G   2           H8       GUA   2 -23.686 -28.629  -4.503
   21    H1     G   2           H1       GUA   2 -25.285 -29.562 -10.623
   22    H21    G   2           H21      GUA   2 -24.483 -31.530 -11.319
   23    H22    G   2           H22      GUA   2 -23.994 -32.758 -10.177
   24    H5'    G   3           H5'      GUA   3 -18.699 -31.731  -6.366
   25   H5''    G   3          H5''      GUA   3 -17.109 -31.144  -6.888
   26    H4'    G   3           H4'      GUA   3 -18.292 -32.179  -8.748
   27    H3'    G   3           H3'      GUA   3 -18.119 -29.147  -8.990
   28    H2'    G   3           H2'      GUA   3 -19.050 -29.396 -11.169
   29   HO2'    G   3          H2''      GUA   3 -18.831 -32.225 -10.939
   30    H1'    G   3           H1'      GUA   3 -20.877 -31.348 -10.432
   31    H8     G   3           H8       GUA   3 -20.900 -28.870  -7.655
   32    H1     G   3           H1       GUA   3 -23.763 -26.540 -12.884
   33    H21    G   3           H21      GUA   3 -23.672 -28.192 -14.524
   34    H22    G   3           H22      GUA   3 -22.123 -29.000 -14.599
   35    H5'    G   4           H5'      GUA   4 -16.722 -30.850 -12.510
   36   H5''    G   4          H5''      GUA   4 -15.164 -30.162 -13.021
   37    H4'    G   4           H4'      GUA   4 -16.715 -30.151 -14.894
   38    H3'    G   4           H3'      GUA   4 -16.335 -27.346 -13.774
   39    H2'    G   4           H2'      GUA   4 -17.635 -26.622 -15.670
   40   HO2'    G   4          H2''      GUA   4 -17.789 -29.297 -16.616
   41    H1'    G   4           H1'      GUA   4 -19.558 -28.532 -15.334
   42    H8     G   4           H8       GUA   4 -18.321 -27.583 -11.881
   43    H1     G   4           H1       GUA   4 -22.371 -23.285 -14.341
   44    H21    G   4           H21      GUA   4 -22.775 -23.755 -16.478
   45    H22    G   4           H22      GUA   4 -22.004 -25.089 -17.302
   46    H5'    A   5           H5'      ADE   5 -15.790 -26.978 -17.773
   47   H5''    A   5          H5''      ADE   5 -14.383 -25.980 -18.198
   48    H4'    A   5           H4'      ADE   5 -16.328 -25.119 -19.344
   49    H3'    A   5           H3'      ADE   5 -15.534 -23.305 -17.050
   50    H2'    A   5           H2'      ADE   5 -17.206 -21.838 -17.864
   51   HO2'    A   5          H2''      ADE   5 -18.278 -23.105 -19.937
   52    H1'    A   5           H1'      ADE   5 -19.115 -23.780 -18.241
   53    H8     A   5           H8       ADE   5 -16.999 -24.571 -15.169
   54    H61    A   5           H61      ADE   5 -20.863 -21.184 -11.967
   55    H62    A   5           H62      ADE   5 -19.125 -21.364 -11.998
   56    H2     A   5           H2       ADE   5 -21.687 -20.352 -16.397
   57    H5'    G   6           H5'      GUA   6 -15.812 -21.204 -20.407
   58   H5''    G   6          H5''      GUA   6 -14.554 -19.975 -20.655
   59    H4'    G   6           H4'      GUA   6 -16.778 -18.964 -20.700
   60    H3'    G   6           H3'      GUA   6 -15.138 -18.216 -18.236
   61    H2'    G   6           H2'      GUA   6 -16.892 -16.720 -17.682
   62   HO2'    G   6          H2''      GUA   6 -17.194 -16.603 -20.346
   63    H1'    G   6           H1'      GUA   6 -18.961 -18.421 -18.391
   64    H8     G   6           H8       GUA   6 -16.153 -20.289 -16.630
   65    H1     G   6           H1       GUA   6 -19.983 -17.177 -12.553
   66    H21    G   6           H21      GUA   6 -21.186 -15.638 -13.700
   67    H22    G   6           H22      GUA   6 -21.573 -15.955 -15.374
   68    H5'    U   7           H5'      URI   7 -16.590 -14.861 -19.614
   69   H5''    U   7          H5''      URI   7 -15.342 -13.739 -20.192
   70    H4'    U   7           H4'      URI   7 -16.958 -12.528 -18.846
   71    H3'    U   7           H3'      URI   7 -14.112 -12.565 -18.221
   72    H2'    U   7           H2'      URI   7 -14.285 -13.490 -16.103
   73   HO2'    U   7          H2''      URI   7 -14.812 -10.816 -15.929
   74    H1'    U   7           H1'      URI   7 -17.086 -12.506 -15.665
   75    H3     U   7           H3       URI   7 -17.787 -15.184 -12.171
   76    H5     U   7           H5       URI   7 -14.988 -17.373 -14.444
   77    H6     U   7           H6       URI   7 -15.030 -15.586 -16.089
   78    H5'    A   8           H5'      ADE   8 -12.442  -8.328 -15.756
   79   H5''    A   8          H5''      ADE   8 -11.512  -9.549 -16.650
   80    H4'    A   8           H4'      ADE   8 -10.759  -9.536 -14.359
   81    H3'    A   8           H3'      ADE   8 -11.660 -11.811 -15.589
   82    H2'    A   8           H2'      ADE   8 -13.641 -12.224 -14.443
   83   HO2'    A   8          H2''      ADE   8 -11.788 -13.584 -13.390
   84    H1'    A   8           H1'      ADE   8 -12.780 -10.899 -11.910
   85    H8     A   8           H8       ADE   8 -15.115  -9.359 -14.541
   86    H61    A   8           H61      ADE   8 -19.513 -10.180 -10.315
   87    H62    A   8           H62      ADE   8 -19.262  -9.878 -12.021
   88    H2     A   8           H2       ADE   8 -15.801 -12.281  -8.868
   89    H5'    C   9           H5'      CYT   9  -8.211 -11.555 -15.147
   90   H5''    C   9          H5''      CYT   9  -7.088 -11.606 -13.773
   91    H4'    C   9           H4'      CYT   9  -5.996 -10.534 -15.663
   92    H3'    C   9           H3'      CYT   9  -6.048  -9.225 -13.142
   93    H2'    C   9           H2'      CYT   9  -7.643  -7.583 -13.798
   94   HO2'    C   9          H2''      CYT   9  -6.055  -5.909 -14.992
   95    H1'    C   9           H1'      CYT   9  -6.341  -7.564 -16.545
   96    H41    C   9           H41      CYT   9 -11.437  -4.075 -18.162
   97    H42    C   9           H42      CYT   9 -12.487  -5.220 -17.358
   98    H5     C   9           H5       CYT   9 -11.000  -5.373 -15.042
   99    H6     C   9           H6       CYT   9  -9.053  -6.673 -14.320
  100    H5'    G  10           H5'      GUA  10  -2.582  -4.853 -14.731
  101   H5''    G  10          H5''      GUA  10  -2.963  -5.441 -13.098
  102    H4'    G  10           H4'      GUA  10  -5.008  -4.114 -14.900
  103    H3'    G  10           H3'      GUA  10  -2.991  -2.914 -12.948
  104    H2'    G  10           H2'      GUA  10  -4.680  -1.380 -12.251
  105   HO2'    G  10          H2''      GUA  10  -5.439  -1.278 -14.639
  106    H1'    G  10           H1'      GUA  10  -6.714  -3.183 -12.106
  107    H8     G  10           H8       GUA  10  -3.566  -4.982 -10.962
  108    H1     G  10           H1       GUA  10  -6.042  -0.989  -6.599
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  110    H22    G  10           H22      GUA  10  -7.849   0.316  -9.213
  111    H5'    G  11           H5'      GUA  11  -4.633   0.403 -14.454
  112   H5''    G  11          H5''      GUA  11  -3.404   1.470 -15.159
  113    H4'    G  11           H4'      GUA  11  -4.805   2.785 -13.721
  114    H3'    G  11           H3'      GUA  11  -2.155   2.149 -12.415
  115    H2'    G  11           H2'      GUA  11  -2.785   3.712 -10.732
  116   HO2'    G  11          H2''      GUA  11  -4.069   4.886 -12.742
  117    H1'    G  11           H1'      GUA  11  -5.439   2.870 -10.635
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  119    H1     G  11           H1       GUA  11  -3.144   2.617  -5.051
  120    H21    G  11           H21      GUA  11  -3.902   5.195  -5.954
  121    H22    G  11           H22      GUA  11  -5.452   4.421  -5.725
  122    H5'    C  12           H5'      CYT  12  -2.681   6.169 -12.349
  123   H5''    C  12          H5''      CYT  12  -1.242   7.106 -12.795
  124    H4'    C  12           H4'      CYT  12  -2.097   7.912 -10.685
  125    H3'    C  12           H3'      CYT  12   0.526   6.427 -10.252
  126    H2'    C  12           H2'      CYT  12   0.323   7.067  -7.983
  127   HO2'    C  12          H2''      CYT  12  -1.605   8.544  -7.500
  128    H1'    C  12           H1'      CYT  12  -2.400   6.635  -7.751
  129    H41    C  12           H41      CYT  12   0.689   1.405  -5.680
  130    H42    C  12           H42      CYT  12   0.495   0.710  -7.274
  131    H5     C  12           H5       CYT  12   0.076   2.101  -9.210
  132    H6     C  12           H6       CYT  12  -0.858   4.228  -9.963
  133    H5'    C  13           H5'      CYT  13   0.419  10.089  -8.389
  134   H5''    C  13          H5''      CYT  13   1.659  11.184  -9.033
  135    H4'    C  13           H4'      CYT  13   1.536  11.416  -6.623
  136    H3'    C  13           H3'      CYT  13   3.878  10.905  -7.954
  137    H2'    C  13           H2'      CYT  13   4.373   8.751  -7.191
  138   HO2'    C  13          H2''      CYT  13   4.788   9.474  -4.588
  139    H1'    C  13           H1'      CYT  13   2.912   9.022  -4.608
  140    H41    C  13           H41      CYT  13   3.039   2.738  -5.549
  141    H42    C  13           H42      CYT  13   1.842   2.901  -6.816
  142    H5     C  13           H5       CYT  13   2.680   4.976  -8.225
  143    H6     C  13           H6       CYT  13   2.826   7.411  -7.972
  144    H5'    G  14           H5'      GUA  14   4.823  11.632  -3.566
  145   H5''    G  14          H5''      GUA  14   6.246  12.676  -3.368
  146    H4'    G  14           H4'      GUA  14   6.476  10.718  -1.961
  147    H3'    G  14           H3'      GUA  14   8.351  10.511  -4.381
  148    H2'    G  14           H2'      GUA  14   9.285   8.666  -3.130
  149   HO2'    G  14          H2''      GUA  14   9.048   8.537  -1.022
  150    H1'    G  14           H1'      GUA  14   6.867   7.518  -2.735
  151    H8     G  14           H8       GUA  14   7.153   9.663  -5.944
  152    H1     G  14           H1       GUA  14   9.560   3.770  -6.531
  153    H21    G  14           H21      GUA  14   9.672   2.819  -4.493
  154    H22    G  14           H22      GUA  14   8.573   3.328  -3.235
  155    H5'    C  15           H5'      CYT  15  12.349  12.553  -5.063
  156   H5''    C  15          H5''      CYT  15  10.883  12.185  -5.992
  157    H4'    C  15           H4'      CYT  15  12.655  10.863  -6.919
  158    H3'    C  15           H3'      CYT  15  10.367   9.734  -6.037
  159    H2'    C  15           H2'      CYT  15  11.015   8.993  -3.912
  160   HO2'    C  15          H2''      CYT  15  12.441   6.880  -5.056
  161    H1'    C  15           H1'      CYT  15  13.804   8.239  -4.687
  162    H41    C  15           H41      CYT  15  15.139  10.487   1.169
  163    H42    C  15           H42      CYT  15  13.504  10.045   1.609
  164    H5     C  15           H5       CYT  15  12.208  11.252  -0.463
  165    H6     C  15           H6       CYT  15  11.731  10.694  -2.797
  166    H5'    A  16           H5'      ADE  16  15.031   6.525  -5.522
  167   H5''    A  16          H5''      ADE  16  14.587   5.365  -6.787
  168    H4'    A  16           H4'      ADE  16  14.868   4.171  -4.718
  169    H3'    A  16           H3'      ADE  16  12.395   4.032  -6.102
  170    H2'    A  16           H2'      ADE  16  11.081   4.926  -4.375
  171   HO2'    A  16          H2''      ADE  16  11.550   2.686  -2.797
  172    H1'    A  16           H1'      ADE  16  13.051   3.944  -2.309
  173    H8     A  16           H8       ADE  16  10.827   6.932  -3.432
  174    H61    A  16           H61      ADE  16  10.461   8.165   2.607
  175    H62    A  16           H62      ADE  16   9.692   8.445   1.060
  176    H2     A  16           H2       ADE  16  13.066   4.533   2.083
  177    H5'    A  17           H5'      ADE  17  11.065  -0.842  -2.839
  178   H5''    A  17          H5''      ADE  17  10.383   0.787  -3.032
  179    H4'    A  17           H4'      ADE  17  12.365  -0.040  -0.889
  180    H3'    A  17           H3'      ADE  17   9.358   0.295  -0.817
  181    H2'    A  17           H2'      ADE  17   9.510   1.309   1.331
  182   HO2'    A  17          H2''      ADE  17  11.351  -0.316   1.846
  183    H1'    A  17           H1'      ADE  17  11.629   2.916   0.785
  184    H8     A  17           H8       ADE  17   9.628   2.634  -2.409
  185    H61    A  17           H61      ADE  17   5.765   6.833  -0.127
  186    H62    A  17           H62      ADE  17   6.480   6.275  -1.625
  187    H2     A  17           H2       ADE  17   8.818   5.901   3.064
  188    H5'    G  18           H5'      GUA  18   9.306  -0.418   2.497
  189   H5''    G  18          H5''      GUA  18   7.986  -1.459   3.066
  190    H4'    G  18           H4'      GUA  18   7.690   0.915   3.727
  191    H3'    G  18           H3'      GUA  18   5.603  -0.241   1.843
  192    H2'    G  18           H2'      GUA  18   4.453   1.861   1.955
  193   HO2'    G  18          H2''      GUA  18   5.669   2.020   4.358
  194    H1'    G  18           H1'      GUA  18   6.654   3.402   1.600
  195    H8     G  18           H8       GUA  18   7.245   0.219  -0.354
  196    H1     G  18           H1       GUA  18   3.242   4.257  -3.305
  197    H21    G  18           H21      GUA  18   3.188   6.224  -1.915
  198    H22    G  18           H22      GUA  18   2.798   5.700  -0.293
  199    H5'    G  19           H5'      GUA  19   3.727   1.907   4.502
  200   H5''    G  19          H5''      GUA  19   2.229   1.241   5.184
  201    H4'    G  19           H4'      GUA  19   1.846   3.461   4.232
  202    H3'    G  19           H3'      GUA  19   0.547   1.238   2.594
  203    H2'    G  19           H2'      GUA  19  -0.493   3.017   1.376
  204   HO2'    G  19          H2''      GUA  19   0.551   5.203   2.536
  205    H1'    G  19           H1'      GUA  19   1.802   4.490   1.124
  206    H8     G  19           H8       GUA  19   2.453   0.731   1.094
  207    H1     G  19           H1       GUA  19   0.453   2.986  -4.553
  208    H21    G  19           H21      GUA  19  -0.751   5.054  -3.960
  209    H22    G  19           H22      GUA  19   0.469   6.033  -3.175
  210    H5'    U  20           H5'      URI  20  -2.319   3.906   3.381
  211   H5''    U  20          H5''      URI  20  -3.835   3.174   3.942
  212    H4'    U  20           H4'      URI  20  -4.290   4.618   2.054
  213    H3'    U  20           H3'      URI  20  -4.512   1.674   1.400
  214    H2'    U  20           H2'      URI  20  -5.263   2.304  -0.747
  215   HO2'    U  20          H2''      URI  20  -5.657   4.852   0.449
  216    H1'    U  20           H1'      URI  20  -3.455   4.355  -1.122
  217    H3     U  20           H3       URI  20  -2.176   0.959  -3.901
  218    H5     U  20           H5       URI  20  -0.993  -0.319  -0.057
  219    H6     U  20           H6       URI  20  -2.082   1.647   0.856
  220    H5'    U  21           H5'      URI  21  -7.739   3.460  -0.022
  221   H5''    U  21          H5''      URI  21  -9.244   2.894   0.732
  222    H4'    U  21           H4'      URI  21  -9.488   2.999  -1.703
  223    H3'    U  21           H3'      URI  21 -10.164   0.819  -0.180
  224    H2'    U  21           H2'      URI  21  -8.452  -0.642  -0.863
  225   HO2'    U  21          H2''      URI  21 -10.442  -0.686  -2.879
  226    H1'    U  21           H1'      URI  21  -8.436   0.567  -3.623
  227    H3     U  21           H3       URI  21  -4.661  -1.379  -4.923
  228    H5     U  21           H5       URI  21  -4.067  -0.945  -0.770
  229    H6     U  21           H6       URI  21  -6.278   0.052  -0.628
  230    H5'    A  22           H5'      ADE  22 -13.773  -1.762  -2.975
  231   H5''    A  22          H5''      ADE  22 -13.476  -2.195  -1.280
  232    H4'    A  22           H4'      ADE  22 -13.303  -4.199  -2.614
  233    H3'    A  22           H3'      ADE  22 -11.222  -3.352  -0.990
  234    H2'    A  22           H2'      ADE  22  -9.849  -2.634  -2.818
  235   HO2'    A  22          H2''      ADE  22  -9.343  -5.402  -2.369
  236    H1'    A  22           H1'      ADE  22 -10.923  -5.119  -4.195
  237    H8     A  22           H8       ADE  22  -8.887  -1.908  -4.699
  238    H61    A  22           H62      ADE  22  -8.688  -3.398 -10.614
  239    H62    A  22           H61      ADE  22  -7.564  -2.924  -9.358
  240    H2     A  22           H2       ADE  22 -11.275  -6.502  -8.510
  241    H5'    A  23           H5'      ADE  23 -13.063  -7.263  -0.481
  242   H5''    A  23          H5''      ADE  23 -12.457  -8.398   0.743
  243    H4'    A  23           H4'      ADE  23 -13.507  -9.779  -0.856
  244    H3'    A  23           H3'      ADE  23 -10.723  -9.793  -0.741
  245    H2'    A  23           H2'      ADE  23 -10.291  -9.178  -2.974
  246   HO2'    A  23          H2''      ADE  23 -10.735 -11.227  -4.365
  247    H1'    A  23           H1'      ADE  23 -12.959 -10.494  -3.592
  248    H8     A  23           H8       ADE  23 -10.653  -7.509  -4.622
  249    H61    A  23           H61      ADE  23 -13.879  -7.034  -9.460
  250    H62    A  23           H62      ADE  23 -12.313  -7.797  -9.637
  251    H2     A  23           H2       ADE  23 -15.511 -10.850  -7.185
  252    H5'    A  24           H5'      ADE  24 -14.125 -11.737   0.142
  253   H5''    A  24          H5''      ADE  24 -14.542 -13.369  -0.424
  254    H4'    A  24           H4'      ADE  24 -16.547 -12.282   0.427
  255    H3'    A  24           H3'      ADE  24 -16.535 -13.415  -2.138
  256    H2'    A  24           H2'      ADE  24 -16.480 -11.344  -3.333
  257   HO2'    A  24          H2''      ADE  24 -18.643 -10.824  -3.875
  258    H1'    A  24           H1'      ADE  24 -18.267 -10.171  -1.183
  259    H8     A  24           H8       ADE  24 -15.624  -9.443  -3.897
  260    H61    A  24           H61      ADE  24 -16.908  -3.482  -2.809
  261    H62    A  24           H62      ADE  24 -16.016  -4.595  -3.823
  262    H2     A  24           H2       ADE  24 -19.070  -5.954   0.257
  263    H5'    A  25           H5'      ADE  25 -20.208 -11.702  -2.426
  264   H5''    A  25          H5''      ADE  25 -21.547 -12.843  -2.191
  265    H4'    A  25           H4'      ADE  25 -21.960 -11.393  -4.123
  266    H3'    A  25           H3'      ADE  25 -21.447 -14.287  -4.905
  267    H2'    A  25           H2'      ADE  25 -21.970 -13.621  -7.118
  268   HO2'    A  25          H2''      ADE  25 -22.547 -11.009  -6.846
  269    H1'    A  25           H1'      ADE  25 -20.587 -11.242  -7.045
  270    H8     A  25           H8       ADE  25 -18.764 -14.113  -5.250
  271    H61    A  25           H61      ADE  25 -16.940 -16.046 -10.757
  272    H62    A  25           H62      ADE  25 -16.326 -15.860  -9.129
  273    H2     A  25           H2       ADE  25 -19.640 -12.476 -11.401
  274    H5'    C  26           H5'      CYT  26 -24.638 -12.551  -6.448
  275   H5''    C  26          H5''      CYT  26 -26.154 -13.461  -6.594
  276    H4'    C  26           H4'      CYT  26 -25.443 -12.308  -8.695
  277    H3'    C  26           H3'      CYT  26 -25.497 -15.389  -8.930
  278    H2'    C  26           H2'      CYT  26 -25.208 -14.970 -11.275
  279   HO2'    C  26          H2''      CYT  26 -25.108 -12.583 -11.857
  280    H1'    C  26           H1'      CYT  26 -23.279 -13.044 -10.889
  281    H41    C  26           H41      CYT  26 -19.730 -18.397 -10.848
  282    H42    C  26           H42      CYT  26 -21.194 -19.318 -10.590
  283    H5     C  26           H5       CYT  26 -21.818 -17.573  -8.413
  284    H6     C  26           H6       CYT  26 -23.111 -15.507  -8.265
  285    H5'    U  27           H5'      URI  27 -27.716 -14.051 -11.899
  286   H5''    U  27          H5''      URI  27 -29.178 -14.994 -12.243
  287    H4'    U  27           H4'      URI  27 -27.808 -14.819 -14.241
  288    H3'    U  27           H3'      URI  27 -27.692 -17.637 -13.064
  289    H2'    U  27           H2'      URI  27 -26.563 -18.219 -15.091
  290   HO2'    U  27          H2''      URI  27 -26.327 -16.075 -16.517
  291    H1'    U  27           H1'      URI  27 -24.938 -15.995 -15.075
  292    H3     U  27           H3       URI  27 -22.299 -19.558 -13.941
  293    H5     U  27           H5       URI  27 -24.502 -18.697 -10.443
  294    H6     U  27           H6       URI  27 -25.752 -17.057 -11.716
  295    H5'    C  28           H5'      CYT  28 -28.902 -17.954 -16.963
  296   H5''    C  28          H5''      CYT  28 -30.247 -19.091 -17.178
  297    H4'    C  28           H4'      CYT  28 -28.445 -19.621 -18.725
  298    H3'    C  28           H3'      CYT  28 -28.571 -21.651 -16.438
  299    H2'    C  28           H2'      CYT  28 -27.058 -22.928 -17.799
  300   HO2'    C  28          H2''      CYT  28 -26.589 -21.329 -19.872
  301    H1'    C  28           H1'      CYT  28 -25.445 -20.765 -18.307
  302    H41    C  28           H41      CYT  28 -23.323 -22.706 -12.523
  303    H42    C  28           H42      CYT  28 -24.751 -23.715 -12.429
  304    H5     C  28           H5       CYT  28 -26.271 -21.330 -13.014
  305    H6     C  28           H6       CYT  28 -27.120 -20.412 -15.113
  306    H5'    C  29           H5'      CYT  29 -28.788 -23.843 -19.688
  307   H5''    C  29          H5''      CYT  29 -30.052 -25.086 -19.638
  308    H4'    C  29           H4'      CYT  29 -27.924 -26.108 -20.178
  309    H3'    C  29           H3'      CYT  29 -28.809 -26.748 -17.336
  310    H2'    C  29           H2'      CYT  29 -26.954 -28.259 -17.272
  311   HO2'    C  29          H2''      CYT  29 -25.679 -28.122 -19.488
  312    H1'    C  29           H1'      CYT  29 -25.175 -26.489 -18.365
  313    H41    C  29           H41      CYT  29 -25.032 -25.512 -12.035
  314    H42    C  29           H42      CYT  29 -26.678 -24.920 -12.072
  315    H5     C  29           H5       CYT  29 -27.606 -24.135 -14.198
  316    H6     C  29           H6       CYT  29 -27.677 -24.602 -16.597
  317    H5'    C  30           H5'      CYT  30 -27.904 -30.244 -19.068
  318   H5''    C  30          H5''      CYT  30 -29.101 -31.529 -18.810
  319    H4'    C  30           H4'      CYT  30 -26.894 -32.303 -18.154
  320    H3'    C  30           H3'      CYT  30 -28.732 -31.886 -15.780
  321    H2'    C  30           H2'      CYT  30 -26.986 -32.779 -14.426
  322   HO2'    C  30          H2''      CYT  30 -25.539 -33.433 -16.791
  323    H1'    C  30           H1'      CYT  30 -24.939 -31.413 -15.659
  324    H41    C  30           H41      CYT  30 -26.776 -27.719 -10.782
  325    H42    C  30           H42      CYT  30 -28.189 -27.216 -11.679
  326    H5     C  30           H5       CYT  30 -28.507 -27.791 -13.997
  327    H6     C  30           H6       CYT  30 -27.869 -29.346 -15.770
  328    H5'    C  31           H5'      CYT  31 -26.851 -35.258 -15.486
  329   H5''    C  31          H5''      CYT  31 -27.760 -36.720 -15.058
  330    H4'    C  31           H4'      CYT  31 -25.792 -36.454 -13.626
  331    H3'    C  31           H3'      CYT  31 -28.437 -36.075 -12.163
  332   HO3'    C  31          H3T       CYT  31 -26.503 -38.162 -12.365
  333    H2'    C  31           H2'      CYT  31 -27.212 -35.805 -10.159
  334   HO2'    C  31          H2''      CYT  31 -24.855 -36.153 -10.228
  335    H1'    C  31           H1'      CYT  31 -25.238 -34.217 -11.212
  336    H41    C  31           H41      CYT  31 -29.669 -30.128  -9.094
  337    H42    C  31           H42      CYT  31 -30.705 -30.535 -10.444
  338    H5     C  31           H5       CYT  31 -30.042 -32.028 -12.198
  339    H6     C  31           H6       CYT  31 -28.413 -33.710 -12.886
  Start of MODEL    8
    1    H5'    G   1           H5'      GUA   1 -34.920 -19.430  -6.974
    2   H5''    G   1          H5''      GUA   1 -33.657 -18.728  -5.944
    3    H4'    G   1           H4'      GUA   1 -34.028 -21.022  -5.281
    4    H3'    G   1           H3'      GUA   1 -31.447 -20.628  -6.792
    5    H2'    G   1           H2'      GUA   1 -30.934 -22.898  -6.266
    6   HO2'    G   1          H2''      GUA   1 -33.046 -22.617  -4.389
    7    H1'    G   1           H1'      GUA   1 -33.450 -23.854  -6.833
    8    H8     G   1           H8       GUA   1 -32.508 -21.133  -9.302
    9    H1     G   1           H1       GUA   1 -29.345 -26.583 -10.335
   10    H21    G   1           H21      GUA   1 -30.282 -28.182  -8.751
   11    H22    G   1           H22      GUA   1 -30.114 -27.402  -7.196
   12   HO5'    G   1          H5T       GUA   1 -33.186 -18.152  -8.007
   13    H5'    G   2           H5'      GUA   2 -30.776 -22.690  -3.423
   14   H5''    G   2          H5''      GUA   2 -29.368 -22.140  -2.491
   15    H4'    G   2           H4'      GUA   2 -29.259 -24.547  -2.800
   16    H3'    G   2           H3'      GUA   2 -27.165 -23.113  -4.514
   17    H2'    G   2           H2'      GUA   2 -26.330 -25.302  -4.945
   18   HO2'    G   2          H2''      GUA   2 -28.223 -26.456  -3.183
   19    H1'    G   2           H1'      GUA   2 -28.799 -26.423  -5.398
   20    H8     G   2           H8       GUA   2 -28.710 -22.856  -6.694
   21    H1     G   2           H1       GUA   2 -25.600 -26.924 -10.523
   22    H21    G   2           H21      GUA   2 -25.421 -28.915  -9.543
   23    H22    G   2           H22      GUA   2 -26.175 -29.273  -8.007
   24    H5'    G   3           H5'      GUA   3 -25.299 -25.817  -2.389
   25   H5''    G   3          H5''      GUA   3 -23.770 -25.297  -1.654
   26    H4'    G   3           H4'      GUA   3 -23.432 -27.287  -3.016
   27    H3'    G   3           H3'      GUA   3 -22.285 -24.788  -4.316
   28    H2'    G   3           H2'      GUA   3 -21.293 -26.270  -5.917
   29   HO2'    G   3          H2''      GUA   3 -21.854 -28.216  -3.945
   30    H1'    G   3           H1'      GUA   3 -23.546 -27.860  -6.152
   31    H8     G   3           H8       GUA   3 -24.754 -24.352  -5.889
   32    H1     G   3           H1       GUA   3 -21.879 -25.396 -11.527
   33    H21    G   3           H21      GUA   3 -21.268 -27.749 -11.517
   34    H22    G   3           H22      GUA   3 -20.357 -28.016 -10.045
   35    H5'    G   4           H5'      GUA   4 -19.262 -27.694  -4.083
   36   H5''    G   4          H5''      GUA   4 -17.753 -27.024  -3.426
   37    H4'    G   4           H4'      GUA   4 -17.251 -28.267  -5.436
   38    H3'    G   4           H3'      GUA   4 -17.144 -25.278  -5.933
   39    H2'    G   4           H2'      GUA   4 -16.225 -25.849  -8.088
   40   HO2'    G   4          H2''      GUA   4 -16.258 -28.567  -7.214
   41    H1'    G   4           H1'      GUA   4 -18.152 -27.692  -8.617
   42    H8     G   4           H8       GUA   4 -19.620 -24.962  -6.417
   43    H1     G   4           H1       GUA   4 -18.757 -23.030 -12.456
   44    H21    G   4           H21      GUA   4 -17.622 -24.568 -13.594
   45    H22    G   4           H22      GUA   4 -17.154 -26.098 -12.892
   46    H5'    A   5           H5'      ADE   5 -13.686 -26.790  -7.322
   47   H5''    A   5          H5''      ADE   5 -12.254 -25.863  -6.832
   48    H4'    A   5           H4'      ADE   5 -12.204 -26.147  -9.224
   49    H3'    A   5           H3'      ADE   5 -12.896 -23.291  -8.464
   50    H2'    A   5           H2'      ADE   5 -12.791 -22.803 -10.787
   51   HO2'    A   5          H2''      ADE   5 -11.469 -25.304 -10.916
   52    H1'    A   5           H1'      ADE   5 -14.243 -24.967 -11.602
   53    H8     A   5           H8       ADE   5 -15.519 -23.787  -8.225
   54    H61    A   5           H61      ADE   5 -19.015 -19.823 -11.181
   55    H62    A   5           H62      ADE   5 -18.006 -19.739  -9.754
   56    H2     A   5           H2       ADE   5 -15.978 -21.470 -14.198
   57    H5'    G   6           H5'      GUA   6  -9.885 -23.324 -11.017
   58   H5''    G   6          H5''      GUA   6  -8.582 -22.165 -10.688
   59    H4'    G   6           H4'      GUA   6  -9.428 -21.814 -12.927
   60    H3'    G   6           H3'      GUA   6 -10.135 -19.613 -10.969
   61    H2'    G   6           H2'      GUA   6 -11.022 -18.425 -12.815
   62   HO2'    G   6          H2''      GUA   6 -10.329 -20.316 -14.741
   63    H1'    G   6           H1'      GUA   6 -12.302 -20.558 -13.983
   64    H8     G   6           H8       GUA   6 -12.418 -20.683 -10.169
   65    H1     G   6           H1       GUA   6 -16.643 -16.541 -12.587
   66    H21    G   6           H21      GUA   6 -16.171 -16.134 -14.718
   67    H22    G   6           H22      GUA   6 -15.245 -17.271 -15.670
   68    H5'    U   7           H5'      URI   7  -8.611 -17.939 -14.186
   69   H5''    U   7          H5''      URI   7  -7.118 -17.034 -13.853
   70    H4'    U   7           H4'      URI   7  -8.638 -15.686 -15.220
   71    H3'    U   7           H3'      URI   7  -7.472 -14.784 -12.855
   72    H2'    U   7           H2'      URI   7  -9.496 -14.910 -11.581
   73   HO2'    U   7          H2''      URI   7 -10.145 -12.427 -12.696
   74    H1'    U   7           H1'      URI   7 -10.829 -13.886 -14.107
   75    H3     U   7           H3       URI   7 -15.132 -14.062 -13.009
   76    H5     U   7           H5       URI   7 -13.343 -16.329  -9.933
   77    H6     U   7           H6       URI   7 -11.200 -16.009 -11.039
   78    H5'    A   8           H5'      ADE   8 -10.062 -11.383 -14.237
   79   H5''    A   8          H5''      ADE   8  -9.066  -9.944 -14.525
   80    H4'    A   8           H4'      ADE   8 -11.046  -9.237 -13.350
   81    H3'    A   8           H3'      ADE   8  -8.523  -8.707 -12.200
   82    H2'    A   8           H2'      ADE   8  -8.730 -10.234 -10.390
   83   HO2'    A   8          H2''      ADE   8  -9.616  -7.717  -9.802
   84    H1'    A   8           H1'      ADE   8 -11.694  -9.599 -10.343
   85    H8     A   8           H8       ADE   8  -9.424 -12.782 -10.361
   86    H61    A   8           H61      ADE   8 -12.663 -14.481  -5.506
   87    H62    A   8           H62      ADE   8 -12.186 -15.232  -7.013
   88    H2     A   8           H2       ADE   8 -14.443 -10.550  -7.038
   89    H5'    C   9           H5'      CYT   9 -11.727  -5.989 -13.206
   90   H5''    C   9          H5''      CYT   9 -10.668  -4.619 -13.603
   91    H4'    C   9           H4'      CYT   9 -12.960  -3.891 -13.718
   92    H3'    C   9           H3'      CYT   9 -11.115  -2.530 -12.080
   93    H2'    C   9           H2'      CYT   9 -12.017  -3.373 -10.023
   94   HO2'    C   9          H2''      CYT   9 -13.421  -1.745  -9.194
   95    H1'    C   9           H1'      CYT   9 -14.739  -3.065 -11.346
   96    H41    C   9           H42      CYT   9 -16.417  -6.746  -6.215
   97    H42    C   9           H41      CYT   9 -16.646  -5.076  -5.742
   98    H5     C   9           H5       CYT   9 -13.763  -4.957  -6.515
   99    H6     C   9           H6       CYT   9 -12.751  -4.069  -8.559
  100    H5'    G  10           H5'      GUA  10 -11.523   1.871 -10.538
  101   H5''    G  10          H5''      GUA  10 -10.647   0.332 -10.440
  102    H4'    G  10           H4'      GUA  10 -12.944   1.086  -8.600
  103    H3'    G  10           H3'      GUA  10  -9.921   1.318  -8.237
  104    H2'    G  10           H2'      GUA  10 -10.257   0.848  -5.918
  105   HO2'    G  10          H2''      GUA  10 -12.847   1.688  -6.509
  106    H1'    G  10           H1'      GUA  10 -12.010  -1.201  -6.345
  107    H8     G  10           H8       GUA  10  -9.340  -1.170  -9.058
  108    H1     G  10           H1       GUA  10  -7.193  -3.311  -3.420
  109    H21    G  10           H21      GUA  10  -8.827  -2.232  -1.806
  110    H22    G  10           H22      GUA  10 -10.272  -3.093  -2.285
  111    H5'    G  11           H5'      GUA  11 -11.308   3.331  -5.051
  112   H5''    G  11          H5''      GUA  11 -10.644   4.975  -4.979
  113    H4'    G  11           H4'      GUA  11 -10.381   3.929  -2.822
  114    H3'    G  11           H3'      GUA  11  -7.763   4.070  -4.356
  115    H2'    G  11           H2'      GUA  11  -6.699   3.308  -2.365
  116   HO2'    G  11          H2''      GUA  11  -8.625   3.000  -0.597
  117    H1'    G  11           H1'      GUA  11  -8.620   1.410  -1.785
  118    H8     G  11           H8       GUA  11  -8.032   1.558  -5.517
  119    H1     G  11           H1       GUA  11  -3.288  -1.435  -2.429
  120    H21    G  11           H21      GUA  11  -3.656  -0.120   0.041
  121    H22    G  11           H22      GUA  11  -4.779  -1.450   0.197
  122    H5'    C  12           H5'      CYT  12  -6.986   5.633  -0.764
  123   H5''    C  12          H5''      CYT  12  -6.078   7.156  -0.808
  124    H4'    C  12           H4'      CYT  12  -4.957   5.598   0.660
  125    H3'    C  12           H3'      CYT  12  -3.363   6.035  -1.887
  126    H2'    C  12           H2'      CYT  12  -1.737   4.587  -0.988
  127   HO2'    C  12          H2''      CYT  12  -1.611   4.093   1.183
  128    H1'    C  12           H1'      CYT  12  -3.471   2.746   0.133
  129    H41    C  12           H41      CYT  12  -1.740   0.661  -5.683
  130    H42    C  12           H42      CYT  12  -3.024   1.618  -6.388
  131    H5     C  12           H5       CYT  12  -4.330   3.194  -5.139
  132    H6     C  12           H6       CYT  12  -4.783   4.112  -2.927
  133    H5'    C  13           H5'      CYT  13  -1.107   6.217   1.384
  134   H5''    C  13          H5''      CYT  13  -0.273   7.765   1.635
  135    H4'    C  13           H4'      CYT  13   1.242   5.897   2.063
  136    H3'    C  13           H3'      CYT  13   1.867   8.012   0.433
  137    H2'    C  13           H2'      CYT  13   1.733   6.944  -1.643
  138   HO2'    C  13          H2''      CYT  13   4.128   5.632  -1.091
  139    H1'    C  13           H1'      CYT  13   2.704   4.328  -0.512
  140    H41    C  13           H41      CYT  13   0.134   2.207  -5.929
  141    H42    C  13           H42      CYT  13  -1.420   2.862  -5.458
  142    H5     C  13           H5       CYT  13  -1.144   5.110  -4.286
  143    H6     C  13           H6       CYT  13  -0.110   6.064  -2.274
  144    H5'    G  14           H5'      GUA  14   6.089   9.109  -1.010
  145   H5''    G  14          H5''      GUA  14   4.497   8.594  -1.603
  146    H4'    G  14           H4'      GUA  14   7.155   7.233  -2.157
  147    H3'    G  14           H3'      GUA  14   5.359   8.880  -4.034
  148    H2'    G  14           H2'      GUA  14   6.227   7.451  -5.777
  149   HO2'    G  14          H2''      GUA  14   8.118   6.522  -5.551
  150    H1'    G  14           H1'      GUA  14   5.655   5.177  -4.484
  151    H8     G  14           H8       GUA  14   3.355   8.042  -3.348
  152    H1     G  14           H1       GUA  14   1.627   5.471  -8.944
  153    H21    G  14           H21      GUA  14   3.222   4.077  -9.656
  154    H22    G  14           H22      GUA  14   4.427   3.445  -8.560
  155    H5'    C  15           H5'      CYT  15   7.329  12.748  -6.237
  156   H5''    C  15          H5''      CYT  15   5.636  12.585  -5.721
  157    H4'    C  15           H4'      CYT  15   5.633  12.865  -8.109
  158    H3'    C  15           H3'      CYT  15   4.328  10.813  -7.024
  159    H2'    C  15           H2'      CYT  15   6.113   9.236  -7.017
  160   HO2'    C  15          H2''      CYT  15   4.290   8.444  -8.311
  161    H1'    C  15           H1'      CYT  15   6.900   9.937  -9.840
  162    H41    C  15           H42      CYT  15  12.885   8.640  -8.069
  163    H42    C  15           H41      CYT  15  12.278   7.593  -6.805
  164    H5     C  15           H5       CYT  15  10.379   9.162  -5.735
  165    H6     C  15           H6       CYT  15   8.116   9.885  -6.296
  166    H5'    A  16           H5'      ADE  16   4.812   9.794 -11.572
  167   H5''    A  16          H5''      ADE  16   3.276   9.175 -12.218
  168    H4'    A  16           H4'      ADE  16   4.915   7.686 -13.035
  169    H3'    A  16           H3'      ADE  16   3.102   6.809 -11.186
  170    H2'    A  16           H2'      ADE  16   4.562   6.199  -9.472
  171   HO2'    A  16          H2''      ADE  16   5.148   4.142 -11.366
  172    H1'    A  16           H1'      ADE  16   6.743   5.711 -11.497
  173    H8     A  16           H8       ADE  16   5.913   7.197  -8.004
  174    H61    A  16           H61      ADE  16  11.739   5.587  -6.710
  175    H62    A  16           H62      ADE  16  10.185   5.979  -6.004
  176    H2     A  16           H2       ADE  16  10.907   4.560 -11.011
  177    H5'    A  17           H5'      ADE  17   5.662   4.071 -13.692
  178   H5''    A  17          H5''      ADE  17   5.106   2.435 -14.104
  179    H4'    A  17           H4'      ADE  17   7.522   2.456 -13.655
  180    H3'    A  17           H3'      ADE  17   5.773   1.080 -11.559
  181    H2'    A  17           H2'      ADE  17   7.766   0.369 -10.469
  182   HO2'    A  17          H2''      ADE  17   9.844   0.828 -11.578
  183    H1'    A  17           H1'      ADE  17   9.131   2.745 -10.847
  184    H8     A  17           H8       ADE  17   5.479   3.286  -9.938
  185    H61    A  17           H61      ADE  17   6.958   2.320  -4.090
  186    H62    A  17           H62      ADE  17   5.933   3.334  -5.085
  187    H2     A  17           H2       ADE  17  10.718   1.747  -6.549
  188    H5'    G  18           H5'      GUA  18   8.175  -1.471 -11.569
  189   H5''    G  18          H5''      GUA  18   7.565  -3.132 -11.457
  190    H4'    G  18           H4'      GUA  18   8.737  -2.523  -9.412
  191    H3'    G  18           H3'      GUA  18   5.736  -2.822  -9.098
  192    H2'    G  18           H2'      GUA  18   6.023  -2.410  -6.746
  193   HO2'    G  18          H2''      GUA  18   8.051  -2.347  -5.787
  194    H1'    G  18           H1'      GUA  18   7.654  -0.270  -7.048
  195    H8     G  18           H8       GUA  18   5.358  -0.340 -10.024
  196    H1     G  18           H1       GUA  18   2.403   1.765  -4.750
  197    H21    G  18           H21      GUA  18   4.023   1.810  -3.031
  198    H22    G  18           H22      GUA  18   4.963   0.336  -3.022
  199    H5'    G  19           H5'      GUA  19   7.394  -4.560  -6.052
  200   H5''    G  19          H5''      GUA  19   6.720  -6.108  -5.510
  201    H4'    G  19           H4'      GUA  19   6.745  -4.492  -3.682
  202    H3'    G  19           H3'      GUA  19   3.929  -5.112  -4.658
  203    H2'    G  19           H2'      GUA  19   3.201  -3.803  -2.779
  204   HO2'    G  19          H2''      GUA  19   5.151  -2.871  -1.502
  205    H1'    G  19           H1'      GUA  19   4.930  -1.750  -3.237
  206    H8     G  19           H8       GUA  19   3.937  -3.375  -6.510
  207    H1     G  19           H1       GUA  19  -0.597   0.518  -4.215
  208    H21    G  19           H21      GUA  19  -0.126   0.494  -1.745
  209    H22    G  19           H22      GUA  19   1.447   1.259  -1.724
  210    H5'    U  20           H5'      URI  20   3.970  -5.522  -0.717
  211   H5''    U  20          H5''      URI  20   3.106  -6.935  -0.080
  212    H4'    U  20           H4'      URI  20   2.261  -4.912   0.962
  213    H3'    U  20           H3'      URI  20   0.276  -6.195  -0.942
  214    H2'    U  20           H2'      URI  20  -1.274  -4.506  -0.321
  215   HO2'    U  20          H2''      URI  20  -0.447  -2.943   1.398
  216    H1'    U  20           H1'      URI  20   0.474  -2.412  -0.421
  217    H3     U  20           H3       URI  20  -2.172  -2.160  -4.153
  218    H5     U  20           H5       URI  20   0.651  -5.177  -5.022
  219    H6     U  20           H6       URI  20   1.471  -4.965  -2.754
  220    H5'    U  21           H5'      URI  21  -1.711  -4.989   2.195
  221   H5''    U  21          H5''      URI  21  -2.182  -6.350   3.236
  222    H4'    U  21           H4'      URI  21  -3.987  -4.754   3.226
  223    H3'    U  21           H3'      URI  21  -4.328  -7.245   2.672
  224    H2'    U  21           H2'      URI  21  -4.766  -7.224   0.370
  225   HO2'    U  21          H2''      URI  21  -6.809  -7.698   0.657
  226    H1'    U  21           H1'      URI  21  -5.959  -4.489   0.362
  227    H3     U  21           H3       URI  21  -5.278  -4.005  -4.013
  228    H5     U  21           H5       URI  21  -1.849  -6.142  -2.800
  229    H6     U  21           H6       URI  21  -2.753  -6.177  -0.546
  230    H5'    A  22           H5'      ADE  22  -7.972  -4.417   2.446
  231   H5''    A  22          H5''      ADE  22  -9.262  -4.994   3.521
  232    H4'    A  22           H4'      ADE  22 -10.314  -4.041   1.607
  233    H3'    A  22           H3'      ADE  22 -10.639  -6.837   2.189
  234    H2'    A  22           H2'      ADE  22  -9.644  -7.548   0.169
  235   HO2'    A  22          H2''      ADE  22 -12.218  -6.678  -0.711
  236    H1'    A  22           H1'      ADE  22 -10.702  -5.019  -1.122
  237    H8     A  22           H8       ADE  22  -7.494  -7.286  -1.058
  238    H61    A  22           H62      ADE  22  -7.677  -6.735  -7.184
  239    H62    A  22           H61      ADE  22  -6.682  -7.200  -5.820
  240    H2     A  22           H2       ADE  22 -11.241  -4.567  -5.497
  241    H5'    A  23           H5'      ADE  23 -13.624  -4.649  -0.815
  242   H5''    A  23          H5''      ADE  23 -15.185  -5.046  -0.069
  243    H4'    A  23           H4'      ADE  23 -15.578  -4.752  -2.410
  244    H3'    A  23           H3'      ADE  23 -16.085  -7.240  -1.174
  245    H2'    A  23           H2'      ADE  23 -14.644  -8.577  -2.446
  246   HO2'    A  23          H2''      ADE  23 -15.874  -9.517  -3.886
  247    H1'    A  23           H1'      ADE  23 -14.785  -6.669  -4.779
  248    H8     A  23           H8       ADE  23 -12.076  -8.173  -2.376
  249    H61    A  23           H62      ADE  23  -9.068  -9.605  -7.466
  250    H62    A  23           H61      ADE  23  -8.674  -8.803  -5.962
  251    H2     A  23           H2       ADE  23 -12.809  -7.255  -8.692
  252    H5'    A  24           H5'      ADE  24 -18.731  -5.383  -4.891
  253   H5''    A  24          H5''      ADE  24 -20.316  -5.944  -4.326
  254    H4'    A  24           H4'      ADE  24 -20.484  -5.525  -6.688
  255    H3'    A  24           H3'      ADE  24 -21.045  -8.071  -5.676
  256    H2'    A  24           H2'      ADE  24 -19.195  -9.171  -6.658
  257   HO2'    A  24          H2''      ADE  24 -20.665  -8.979  -9.059
  258    H1'    A  24           H1'      ADE  24 -19.430  -7.278  -9.009
  259    H8     A  24           H8       ADE  24 -16.843  -9.071  -6.691
  260    H61    A  24           H61      ADE  24 -13.393  -9.422 -11.772
  261    H62    A  24           H62      ADE  24 -13.731 -10.212 -10.247
  262    H2     A  24           H2       ADE  24 -17.260  -7.337 -12.857
  263    H5'    A  25           H5'      ADE  25 -22.117  -7.080 -10.167
  264   H5''    A  25          H5''      ADE  25 -23.615  -7.883 -10.678
  265    H4'    A  25           H4'      ADE  25 -22.071  -7.905 -12.540
  266    H3'    A  25           H3'      ADE  25 -22.274 -10.673 -11.335
  267    H2'    A  25           H2'      ADE  25 -20.793 -11.340 -13.049
  268   HO2'    A  25          H2''      ADE  25 -20.469  -9.519 -14.787
  269    H1'    A  25           H1'      ADE  25 -19.406  -8.882 -13.254
  270    H8     A  25           H8       ADE  25 -19.233 -10.075  -9.705
  271    H61    A  25           H62      ADE  25 -14.059 -11.909 -10.796
  272    H62    A  25           H61      ADE  25 -14.971 -13.394 -10.635
  273    H2     A  25           H2       ADE  25 -16.037 -11.382 -15.097
  274    H5'    C  26           H5'      CYT  26 -22.615 -10.447 -15.369
  275   H5''    C  26          H5''      CYT  26 -23.732 -11.585 -16.150
  276    H4'    C  26           H4'      CYT  26 -21.440 -11.608 -17.136
  277    H3'    C  26           H3'      CYT  26 -22.222 -14.245 -15.775
  278    H2'    C  26           H2'      CYT  26 -20.252 -15.089 -16.827
  279   HO2'    C  26          H2''      CYT  26 -19.061 -13.420 -18.198
  280    H1'    C  26           H1'      CYT  26 -18.721 -12.884 -16.173
  281    H41    C  26           H41      CYT  26 -18.172 -16.754 -11.034
  282    H42    C  26           H42      CYT  26 -19.551 -17.635 -11.654
  283    H5     C  26           H5       CYT  26 -20.914 -15.111 -11.799
  284    H6     C  26           H6       CYT  26 -21.180 -13.494 -13.613
  285    H5'    U  27           H5'      URI  27 -21.138 -15.045 -19.464
  286   H5''    U  27          H5''      URI  27 -22.105 -16.280 -20.291
  287    H4'    U  27           H4'      URI  27 -19.760 -16.885 -20.366
  288    H3'    U  27           H3'      URI  27 -21.346 -18.657 -18.479
  289    H2'    U  27           H2'      URI  27 -19.369 -19.962 -18.275
  290   HO2'    U  27          H2''      URI  27 -18.037 -18.410 -20.233
  291    H1'    U  27           H1'      URI  27 -17.654 -17.814 -18.066
  292    H3     U  27           H3       URI  27 -17.976 -19.745 -13.912
  293    H5     U  27           H5       URI  27 -21.525 -17.502 -14.353
  294    H6     U  27           H6       URI  27 -20.865 -17.035 -16.635
  295    H5'    C  28           H5'      CYT  28 -19.266 -20.977 -21.046
  296   H5''    C  28          H5''      CYT  28 -20.190 -22.331 -21.723
  297    H4'    C  28           H4'      CYT  28 -18.092 -23.132 -20.809
  298    H3'    C  28           H3'      CYT  28 -20.486 -23.884 -19.078
  299    H2'    C  28           H2'      CYT  28 -18.971 -25.267 -17.862
  300   HO2'    C  28          H2''      CYT  28 -16.956 -25.808 -18.622
  301    H1'    C  28           H1'      CYT  28 -16.953 -23.384 -17.794
  302    H41    C  28           H41      CYT  28 -20.453 -21.866 -12.594
  303    H42    C  28           H42      CYT  28 -21.734 -22.858 -13.255
  304    H5     C  28           H5       CYT  28 -21.566 -21.522 -15.733
  305    H6     C  28           H6       CYT  28 -20.267 -21.912 -17.759
  306    H5'    C  29           H5'      CYT  29 -18.764 -27.348 -19.667
  307   H5''    C  29          H5''      CYT  29 -19.871 -28.615 -20.229
  308    H4'    C  29           H4'      CYT  29 -18.716 -29.388 -18.259
  309    H3'    C  29           H3'      CYT  29 -21.601 -28.614 -17.730
  310    H2'    C  29           H2'      CYT  29 -21.329 -29.497 -15.524
  311   HO2'    C  29          H2''      CYT  29 -19.714 -30.880 -14.973
  312    H1'    C  29           H1'      CYT  29 -18.779 -28.468 -15.161
  313    H41    C  29           H41      CYT  29 -22.738 -24.197 -12.542
  314    H42    C  29           H42      CYT  29 -23.483 -23.903 -14.098
  315    H5     C  29           H5       CYT  29 -22.188 -24.451 -16.113
  316    H6     C  29           H6       CYT  29 -20.718 -26.141 -17.085
  317    H5'    C  30           H5'      CYT  30 -21.213 -32.406 -16.156
  318   H5''    C  30          H5''      CYT  30 -22.518 -33.488 -16.691
  319    H4'    C  30           H4'      CYT  30 -22.359 -33.564 -14.276
  320    H3'    C  30           H3'      CYT  30 -24.764 -31.948 -15.227
  321    H2'    C  30           H2'      CYT  30 -25.449 -31.849 -12.947
  322   HO2'    C  30          H2''      CYT  30 -23.398 -33.521 -12.016
  323    H1'    C  30           H1'      CYT  30 -22.875 -31.484 -11.940
  324    H41    C  30           H41      CYT  30 -25.705 -25.756 -12.347
  325    H42    C  30           H42      CYT  30 -25.240 -25.656 -14.030
  326    H5     C  30           H5       CYT  30 -24.289 -27.488 -15.242
  327    H6     C  30           H6       CYT  30 -23.410 -29.758 -15.074
  328    H5'    C  31           H5'      CYT  31 -26.454 -34.715 -12.756
  329   H5''    C  31          H5''      CYT  31 -27.823 -35.517 -13.549
  330    H4'    C  31           H4'      CYT  31 -28.528 -34.689 -11.395
  331    H3'    C  31           H3'      CYT  31 -29.538 -32.997 -13.678
  332   HO3'    C  31          H3T       CYT  31 -31.313 -34.426 -12.190
  333    H2'    C  31           H2'      CYT  31 -30.711 -31.650 -12.171
  334   HO2'    C  31          H2''      CYT  31 -31.861 -33.083 -10.984
  335    H1'    C  31           H1'      CYT  31 -28.857 -31.947 -10.041
  336    H41    C  31           H41      CYT  31 -28.360 -26.002 -12.391
  337    H42    C  31           H42      CYT  31 -27.411 -26.621 -13.724
  338    H5     C  31           H5       CYT  31 -26.994 -28.945 -14.082
  339    H6     C  31           H6       CYT  31 -27.394 -31.205 -13.256
  Start of MODEL    9
    1    H5'    G   1           H5'      GUA   1 -35.076 -21.033  -5.485
    2   H5''    G   1          H5''      GUA   1 -33.750 -20.185  -4.665
    3    H4'    G   1           H4'      GUA   1 -33.774 -22.485  -3.931
    4    H3'    G   1           H3'      GUA   1 -31.519 -21.861  -5.825
    5    H2'    G   1           H2'      GUA   1 -30.688 -24.054  -5.375
    6   HO2'    G   1          H2''      GUA   1 -32.005 -23.712  -3.043
    7    H1'    G   1           H1'      GUA   1 -33.129 -25.284  -5.591
    8    H8     G   1           H8       GUA   1 -32.886 -22.454  -8.104
    9    H1     G   1           H1       GUA   1 -29.272 -27.463  -9.714
   10    H21    G   1           H21      GUA   1 -29.439 -29.050  -8.106
   11    H22    G   1           H22      GUA   1 -29.834 -28.538  -6.482
   12   HO5'    G   1          H5T       GUA   1 -34.055 -19.883  -7.032
   13    H5'    G   2           H5'      GUA   2 -30.210 -23.793  -2.619
   14   H5''    G   2          H5''      GUA   2 -28.721 -23.150  -1.898
   15    H4'    G   2           H4'      GUA   2 -28.498 -25.546  -2.254
   16    H3'    G   2           H3'      GUA   2 -26.750 -23.942  -4.177
   17    H2'    G   2           H2'      GUA   2 -25.836 -26.055  -4.771
   18   HO2'    G   2          H2''      GUA   2 -26.283 -27.929  -3.599
   19    H1'    G   2           H1'      GUA   2 -28.247 -27.333  -4.996
   20    H8     G   2           H8       GUA   2 -28.565 -23.697  -6.071
   21    H1     G   2           H1       GUA   2 -25.591 -27.281 -10.446
   22    H21    G   2           H21      GUA   2 -25.130 -29.289  -9.609
   23    H22    G   2           H22      GUA   2 -25.751 -29.820  -8.062
   24    H5'    G   3           H5'      GUA   3 -24.555 -26.593  -2.368
   25   H5''    G   3          H5''      GUA   3 -22.980 -26.028  -1.780
   26    H4'    G   3           H4'      GUA   3 -22.705 -27.977  -3.217
   27    H3'    G   3           H3'      GUA   3 -21.757 -25.400  -4.522
   28    H2'    G   3           H2'      GUA   3 -20.925 -26.762  -6.294
   29   HO2'    G   3          H2''      GUA   3 -20.646 -28.572  -4.358
   30    H1'    G   3           H1'      GUA   3 -23.140 -28.395  -6.413
   31    H8     G   3           H8       GUA   3 -24.338 -24.927  -5.707
   32    H1     G   3           H1       GUA   3 -22.279 -25.545 -11.751
   33    H21    G   3           H21      GUA   3 -21.495 -27.682 -12.039
   34    H22    G   3           H22      GUA   3 -20.821 -28.490 -10.640
   35    H5'    G   4           H5'      GUA   4 -18.663 -28.244  -4.621
   36   H5''    G   4          H5''      GUA   4 -17.099 -27.562  -4.130
   37    H4'    G   4           H4'      GUA   4 -16.829 -28.756  -6.218
   38    H3'    G   4           H3'      GUA   4 -16.777 -25.757  -6.618
   39    H2'    G   4           H2'      GUA   4 -16.151 -26.234  -8.887
   40   HO2'    G   4          H2''      GUA   4 -15.614 -28.780  -7.815
   41    H1'    G   4           H1'      GUA   4 -18.114 -28.083  -9.248
   42    H8     G   4           H8       GUA   4 -19.306 -25.435  -6.790
   43    H1     G   4           H1       GUA   4 -19.247 -23.318 -12.824
   44    H21    G   4           H21      GUA   4 -18.286 -24.816 -14.154
   45    H22    G   4           H22      GUA   4 -17.648 -26.330 -13.555
   46    H5'    A   5           H5'      ADE   5 -13.557 -27.240  -8.477
   47   H5''    A   5          H5''      ADE   5 -12.048 -26.373  -8.128
   48    H4'    A   5           H4'      ADE   5 -12.314 -26.550 -10.523
   49    H3'    A   5           H3'      ADE   5 -12.748 -23.715  -9.539
   50    H2'    A   5           H2'      ADE   5 -13.024 -23.086 -11.800
   51   HO2'    A   5          H2''      ADE   5 -12.729 -25.059 -13.364
   52    H1'    A   5           H1'      ADE   5 -14.601 -25.200 -12.555
   53    H8     A   5           H8       ADE   5 -15.419 -24.127  -8.993
   54    H61    A   5           H61      ADE   5 -19.306 -20.139 -11.381
   55    H62    A   5           H62      ADE   5 -18.128 -20.069 -10.090
   56    H2     A   5           H2       ADE   5 -16.711 -21.702 -14.803
   57    H5'    G   6           H5'      GUA   6 -10.219 -23.707 -12.581
   58   H5''    G   6          H5''      GUA   6  -8.803 -22.647 -12.427
   59    H4'    G   6           H4'      GUA   6 -10.109 -22.096 -14.426
   60    H3'    G   6           H3'      GUA   6 -10.152 -19.959 -12.247
   61    H2'    G   6           H2'      GUA   6 -11.433 -18.610 -13.705
   62   HO2'    G   6          H2''      GUA   6 -11.660 -19.286 -15.970
   63    H1'    G   6           H1'      GUA   6 -12.946 -20.678 -14.815
   64    H8     G   6           H8       GUA   6 -12.651 -21.051 -11.064
   65    H1     G   6           H1       GUA   6 -17.059 -16.717 -12.737
   66    H21    G   6           H21      GUA   6 -16.703 -16.120 -14.915
   67    H22    G   6           H22      GUA   6 -16.126 -17.375 -15.986
   68    H5'    U   7           H5'      URI   7  -9.628 -18.167 -15.549
   69   H5''    U   7          H5''      URI   7  -8.129 -17.241 -15.764
   70    H4'    U   7           H4'      URI   7 -10.033 -15.906 -16.488
   71    H3'    U   7           H3'      URI   7  -8.148 -15.004 -14.680
   72    H2'    U   7           H2'      URI   7  -9.540 -15.200 -12.760
   73   HO2'    U   7          H2''      URI   7  -8.976 -12.966 -12.988
   74    H1'    U   7           H1'      URI   7 -11.814 -14.211 -14.518
   75    H3     U   7           H3       URI   7 -15.248 -14.853 -11.744
   76    H5     U   7           H5       URI   7 -12.194 -17.152  -9.959
   77    H6     U   7           H6       URI   7 -10.748 -16.540 -11.811
   78    H5'    A   8           H5'      ADE   8 -11.146 -11.621 -15.136
   79   H5''    A   8          H5''      ADE   8 -10.327 -10.088 -15.491
   80    H4'    A   8           H4'      ADE   8 -11.906  -9.630 -13.760
   81    H3'    A   8           H3'      ADE   8  -9.152  -9.342 -13.179
   82    H2'    A   8           H2'      ADE   8  -9.124 -10.987 -11.468
   83   HO2'    A   8          H2''      ADE   8  -8.699  -9.334 -10.133
   84    H1'    A   8           H1'      ADE   8 -12.001 -10.163 -10.972
   85    H8     A   8           H8       ADE   8 -10.034 -13.545 -11.215
   86    H61    A   8           H61      ADE   8 -13.590 -15.605  -7.391
   87    H62    A   8           H62      ADE   8 -12.222 -15.129  -6.409
   88    H2     A   8           H2       ADE   8 -14.549 -10.884  -7.516
   89    H5'    C   9           H5'      CYT   9 -11.736  -6.225 -13.887
   90   H5''    C   9          H5''      CYT   9 -10.395  -5.082 -14.123
   91    H4'    C   9           H4'      CYT   9 -12.488  -3.890 -14.388
   92    H3'    C   9           H3'      CYT   9 -10.556  -2.961 -12.484
   93    H2'    C   9           H2'      CYT   9 -11.818  -3.671 -10.589
   94   HO2'    C   9          H2''      CYT   9 -12.090  -1.732  -9.804
   95    H1'    C   9           H1'      CYT   9 -14.287  -2.816 -12.145
   96    H41    C   9           H41      CYT   9 -17.737  -5.216  -7.489
   97    H42    C   9           H42      CYT   9 -16.414  -6.177  -6.868
   98    H5     C   9           H5       CYT   9 -14.155  -5.171  -7.382
   99    H6     C   9           H6       CYT   9 -12.809  -4.310  -9.231
  100    H5'    G  10           H5'      GUA  10 -13.337  -0.269 -11.374
  101   H5''    G  10          H5''      GUA  10 -12.823   1.426 -11.494
  102    H4'    G  10           H4'      GUA  10 -13.593   0.953  -9.228
  103    H3'    G  10           H3'      GUA  10 -10.559   1.312  -9.434
  104    H2'    G  10           H2'      GUA  10 -10.537   1.197  -7.055
  105   HO2'    G  10          H2''      GUA  10 -13.370   1.202  -6.926
  106    H1'    G  10           H1'      GUA  10 -12.415  -0.814  -6.860
  107    H8     G  10           H8       GUA  10  -9.886  -1.477  -9.649
  108    H1     G  10           H1       GUA  10  -7.615  -2.555  -3.758
  109    H21    G  10           H21      GUA  10  -9.946  -0.634  -2.613
  110    H22    G  10           H22      GUA  10  -9.793  -2.356  -2.342
  111    H5'    G  11           H5'      GUA  11 -11.818   3.801  -6.392
  112   H5''    G  11          H5''      GUA  11 -11.224   5.453  -6.645
  113    H4'    G  11           H4'      GUA  11 -10.819   4.828  -4.356
  114    H3'    G  11           H3'      GUA  11  -8.267   4.728  -5.990
  115    H2'    G  11           H2'      GUA  11  -7.127   4.379  -3.909
  116   HO2'    G  11          H2''      GUA  11  -8.554   4.469  -1.930
  117    H1'    G  11           H1'      GUA  11  -9.053   2.654  -2.889
  118    H8     G  11           H8       GUA  11  -8.444   1.888  -6.530
  119    H1     G  11           H1       GUA  11  -3.740  -0.262  -2.752
  120    H21    G  11           H21      GUA  11  -4.443   0.228  -0.499
  121    H22    G  11           H22      GUA  11  -4.833   1.931  -0.458
  122    H5'    C  12           H5'      CYT  12  -7.534   7.021  -2.709
  123   H5''    C  12          H5''      CYT  12  -6.658   8.527  -3.046
  124    H4'    C  12           H4'      CYT  12  -5.528   7.318  -1.281
  125    H3'    C  12           H3'      CYT  12  -3.842   7.252  -3.823
  126    H2'    C  12           H2'      CYT  12  -2.245   6.051  -2.553
  127   HO2'    C  12          H2''      CYT  12  -2.851   5.826  -0.144
  128    H1'    C  12           H1'      CYT  12  -4.022   4.470  -1.146
  129    H41    C  12           H41      CYT  12  -2.096   1.064  -6.206
  130    H42    C  12           H42      CYT  12  -3.336   1.829  -7.172
  131    H5     C  12           H5       CYT  12  -4.672   3.658  -6.399
  132    H6     C  12           H6       CYT  12  -5.213   5.070  -4.489
  133    H5'    C  13           H5'      CYT  13  -1.662   8.250  -0.462
  134   H5''    C  13          H5''      CYT  13  -0.875   9.837  -0.593
  135    H4'    C  13           H4'      CYT  13   0.669   8.214   0.372
  136    H3'    C  13           H3'      CYT  13   1.238   9.793  -1.662
  137    H2'    C  13           H2'      CYT  13   1.362   8.256  -3.428
  138   HO2'    C  13          H2''      CYT  13   3.623   7.037  -2.827
  139    H1'    C  13           H1'      CYT  13   2.275   6.035  -1.627
  140    H41    C  13           H41      CYT  13   0.005   2.570  -6.429
  141    H42    C  13           H42      CYT  13  -1.575   3.300  -6.238
  142    H5     C  13           H5       CYT  13  -1.437   5.743  -5.586
  143    H6     C  13           H6       CYT  13  -0.497   7.198  -3.850
  144    H5'    G  14           H5'      GUA  14   5.063   7.474  -0.293
  145   H5''    G  14          H5''      GUA  14   6.464   8.558  -0.176
  146    H4'    G  14           H4'      GUA  14   7.085   6.544  -1.385
  147    H3'    G  14           H3'      GUA  14   6.890   8.895  -3.400
  148    H2'    G  14           H2'      GUA  14   7.921   7.276  -4.887
  149   HO2'    G  14          H2''      GUA  14   9.015   5.630  -4.117
  150    H1'    G  14           H1'      GUA  14   6.069   5.404  -4.362
  151    H8     G  14           H8       GUA  14   4.692   8.939  -3.772
  152    H1     G  14           H1       GUA  14   4.851   7.347  -9.962
  153    H21    G  14           H21      GUA  14   5.955   5.436 -10.229
  154    H22    G  14           H22      GUA  14   6.256   4.359  -8.887
  155    H5'    C  15           H5'      CYT  15  10.090  12.059  -4.295
  156   H5''    C  15          H5''      CYT  15   8.316  12.102  -4.196
  157    H4'    C  15           H4'      CYT  15   8.885  12.554  -6.470
  158    H3'    C  15           H3'      CYT  15   7.273  10.489  -5.862
  159    H2'    C  15           H2'      CYT  15   8.743   8.663  -6.012
  160   HO2'    C  15          H2''      CYT  15   8.996   8.464  -8.637
  161    H1'    C  15           H1'      CYT  15  10.398   9.785  -8.229
  162    H41    C  15           H42      CYT  15  14.938   6.410  -5.379
  163    H42    C  15           H41      CYT  15  14.050   6.392  -3.872
  164    H5     C  15           H5       CYT  15  12.123   7.801  -3.487
  165    H6     C  15           H6       CYT  15  10.377   9.121  -4.560
  166    H5'    A  16           H5'      ADE  16  10.449   9.969 -10.616
  167   H5''    A  16          H5''      ADE  16   9.032   9.976 -11.685
  168    H4'    A  16           H4'      ADE  16  10.230   7.902 -11.973
  169    H3'    A  16           H3'      ADE  16   7.573   8.012 -11.222
  170    H2'    A  16           H2'      ADE  16   7.770   6.940  -9.158
  171   HO2'    A  16          H2''      ADE  16   8.179   4.705 -10.894
  172    H1'    A  16           H1'      ADE  16  10.174   5.422 -10.185
  173    H8     A  16           H8       ADE  16   8.347   6.906  -7.157
  174    H61    A  16           H61      ADE  16  12.348   3.586  -3.813
  175    H62    A  16           H62      ADE  16  10.841   4.478  -3.766
  176    H2     A  16           H2       ADE  16  13.429   3.136  -8.155
  177    H5'    A  17           H5'      ADE  17   9.732   4.457 -12.798
  178   H5''    A  17          H5''      ADE  17   8.920   3.090 -13.584
  179    H4'    A  17           H4'      ADE  17  10.781   2.333 -12.180
  180    H3'    A  17           H3'      ADE  17   8.043   1.600 -11.071
  181    H2'    A  17           H2'      ADE  17   9.264   0.234  -9.506
  182   HO2'    A  17          H2''      ADE  17  11.794   0.649  -9.983
  183    H1'    A  17           H1'      ADE  17  11.065   2.190  -8.892
  184    H8     A  17           H8       ADE  17   7.710   3.738  -9.710
  185    H61    A  17           H61      ADE  17   5.672   2.099  -4.248
  186    H62    A  17           H62      ADE  17   5.695   3.520  -5.272
  187    H2     A  17           H2       ADE  17   9.922   0.490  -4.629
  188    H5'    G  18           H5'      GUA  18   7.625  -3.492 -10.626
  189   H5''    G  18          H5''      GUA  18   6.517  -2.112 -10.757
  190    H4'    G  18           H4'      GUA  18   8.627  -2.509  -8.612
  191    H3'    G  18           H3'      GUA  18   5.639  -2.852  -8.571
  192    H2'    G  18           H2'      GUA  18   5.612  -2.012  -6.338
  193   HO2'    G  18          H2''      GUA  18   8.272  -1.518  -6.000
  194    H1'    G  18           H1'      GUA  18   7.264   0.094  -6.794
  195    H8     G  18           H8       GUA  18   5.291  -0.530  -9.946
  196    H1     G  18           H1       GUA  18   1.793   2.307  -5.398
  197    H21    G  18           H21      GUA  18   3.284   2.727  -3.588
  198    H22    G  18           H22      GUA  18   4.167   1.261  -3.230
  199    H5'    G  19           H5'      GUA  19   7.129  -3.943  -5.145
  200   H5''    G  19          H5''      GUA  19   6.456  -5.398  -4.386
  201    H4'    G  19           H4'      GUA  19   6.315  -3.491  -2.871
  202    H3'    G  19           H3'      GUA  19   3.583  -4.352  -3.920
  203    H2'    G  19           H2'      GUA  19   2.711  -2.813  -2.313
  204   HO2'    G  19          H2''      GUA  19   5.086  -3.281  -1.091
  205    H1'    G  19           H1'      GUA  19   4.401  -0.791  -3.007
  206    H8     G  19           H8       GUA  19   3.608  -3.010  -5.992
  207    H1     G  19           H1       GUA  19  -1.064   1.164  -4.668
  208    H21    G  19           H21      GUA  19  -0.719   1.736  -2.332
  209    H22    G  19           H22      GUA  19   0.923   2.325  -2.208
  210    H5'    U  20           H5'      URI  20   3.302  -4.222   0.023
  211   H5''    U  20          H5''      URI  20   2.441  -5.595   0.742
  212    H4'    U  20           H4'      URI  20   1.417  -3.530   1.473
  213    H3'    U  20           H3'      URI  20  -0.283  -5.064  -0.501
  214    H2'    U  20           H2'      URI  20  -1.973  -3.425  -0.118
  215   HO2'    U  20          H2''      URI  20  -0.540  -3.050   2.221
  216    H1'    U  20           H1'      URI  20  -0.316  -1.263  -0.274
  217    H3     U  20           H3       URI  20  -2.638  -1.441  -4.201
  218    H5     U  20           H5       URI  20   0.320  -4.432  -4.564
  219    H6     U  20           H6       URI  20   0.957  -3.980  -2.275
  220    H5'    U  21           H5'      URI  21  -2.681  -3.840   2.334
  221   H5''    U  21          H5''      URI  21  -3.131  -5.181   3.414
  222    H4'    U  21           H4'      URI  21  -5.085  -3.786   3.018
  223    H3'    U  21           H3'      URI  21  -5.033  -6.457   2.583
  224    H2'    U  21           H2'      URI  21  -5.316  -6.590   0.280
  225   HO2'    U  21          H2''      URI  21  -7.477  -6.972   1.265
  226    H1'    U  21           H1'      URI  21  -6.718  -3.964   0.027
  227    H3     U  21           H3       URI  21  -5.707  -3.472  -4.282
  228    H5     U  21           H5       URI  21  -2.279  -5.416  -2.771
  229    H6     U  21           H6       URI  21  -3.360  -5.483  -0.597
  230    H5'    A  22           H5'      ADE  22  -9.393  -5.059   2.019
  231   H5''    A  22          H5''      ADE  22 -10.465  -6.102   2.974
  232    H4'    A  22           H4'      ADE  22 -11.508  -6.030   0.876
  233    H3'    A  22           H3'      ADE  22 -10.228  -8.517   1.464
  234    H2'    A  22           H2'      ADE  22  -8.772  -8.454  -0.409
  235   HO2'    A  22          H2''      ADE  22  -9.810 -10.096  -1.288
  236    H1'    A  22           H1'      ADE  22 -10.983  -6.836  -1.726
  237    H8     A  22           H8       ADE  22  -7.050  -6.897  -1.566
  238    H61    A  22           H62      ADE  22  -7.512  -5.330  -7.523
  239    H62    A  22           H61      ADE  22  -6.412  -5.849  -6.264
  240    H2     A  22           H2       ADE  22 -11.671  -5.841  -5.895
  241    H5'    A  23           H5'      ADE  23 -14.398  -8.184   1.566
  242   H5''    A  23          H5''      ADE  23 -15.393  -9.637   1.797
  243    H4'    A  23           H4'      ADE  23 -16.838  -7.900   0.986
  244    H3'    A  23           H3'      ADE  23 -16.598 -10.250  -0.403
  245    H2'    A  23           H2'      ADE  23 -15.288  -9.373  -2.199
  246   HO2'    A  23          H2''      ADE  23 -17.383  -8.334  -3.529
  247    H1'    A  23           H1'      ADE  23 -16.989  -6.872  -1.994
  248    H8     A  23           H8       ADE  23 -13.268  -7.976  -2.527
  249    H61    A  23           H61      ADE  23 -13.041  -3.836  -6.695
  250    H62    A  23           H62      ADE  23 -12.157  -3.623  -5.199
  251    H2     A  23           H2       ADE  23 -17.162  -3.256  -4.467
  252    H5'    A  24           H5'      ADE  24 -19.865  -7.593  -2.542
  253   H5''    A  24          H5''      ADE  24 -21.358  -8.533  -2.375
  254    H4'    A  24           H4'      ADE  24 -21.459  -7.390  -4.490
  255    H3'    A  24           H3'      ADE  24 -21.607 -10.196  -4.451
  256    H2'    A  24           H2'      ADE  24 -19.534 -10.626  -5.505
  257   HO2'    A  24          H2''      ADE  24 -21.165  -9.827  -7.707
  258    H1'    A  24           H1'      ADE  24 -19.864  -8.083  -7.115
  259    H8     A  24           H8       ADE  24 -17.219  -9.922  -4.886
  260    H61    A  24           H61      ADE  24 -13.475  -9.401  -9.389
  261    H62    A  24           H62      ADE  24 -13.259  -8.480  -7.917
  262    H2     A  24           H2       ADE  24 -17.343  -7.054 -10.633
  263    H5'    A  25           H5'      ADE  25 -22.123  -7.952  -8.469
  264   H5''    A  25          H5''      ADE  25 -23.619  -8.483  -9.263
  265    H4'    A  25           H4'      ADE  25 -21.938  -7.944 -10.947
  266    H3'    A  25           H3'      ADE  25 -22.378 -10.959 -10.707
  267    H2'    A  25           H2'      ADE  25 -21.016 -11.139 -12.654
  268   HO2'    A  25          H2''      ADE  25 -20.211  -8.810 -13.347
  269    H1'    A  25           H1'      ADE  25 -19.111  -9.391 -11.747
  270    H8     A  25           H8       ADE  25 -20.569 -11.459  -8.878
  271    H61    A  25           H61      ADE  25 -16.574 -15.800 -10.253
  272    H62    A  25           H62      ADE  25 -18.277 -15.770  -9.847
  273    H2     A  25           H2       ADE  25 -16.615 -12.810 -13.754
  274    H5'    C  26           H5'      CYT  26 -22.773 -10.016 -14.476
  275   H5''    C  26          H5''      CYT  26 -23.997 -10.922 -15.380
  276    H4'    C  26           H4'      CYT  26 -21.806 -11.113 -16.433
  277    H3'    C  26           H3'      CYT  26 -22.683 -13.746 -15.149
  278    H2'    C  26           H2'      CYT  26 -20.889 -14.661 -16.459
  279   HO2'    C  26          H2''      CYT  26 -19.743 -13.255 -17.947
  280    H1'    C  26           H1'      CYT  26 -19.152 -12.602 -15.815
  281    H41    C  26           H41      CYT  26 -18.339 -16.916 -11.055
  282    H42    C  26           H42      CYT  26 -19.795 -17.685 -11.653
  283    H5     C  26           H5       CYT  26 -20.994 -15.040 -11.389
  284    H6     C  26           H6       CYT  26 -21.347 -13.268 -13.034
  285    H5'    U  27           H5'      URI  27 -21.884 -14.354 -18.894
  286   H5''    U  27          H5''      URI  27 -22.895 -15.514 -19.774
  287    H4'    U  27           H4'      URI  27 -20.559 -16.143 -19.945
  288    H3'    U  27           H3'      URI  27 -22.112 -18.047 -18.140
  289    H2'    U  27           H2'      URI  27 -20.123 -19.392 -18.219
  290   HO2'    U  27          H2''      URI  27 -19.110 -17.576 -20.170
  291    H1'    U  27           H1'      URI  27 -18.408 -17.281 -17.840
  292    H3     U  27           H3       URI  27 -18.536 -19.657 -13.930
  293    H5     U  27           H5       URI  27 -22.081 -17.362 -13.931
  294    H6     U  27           H6       URI  27 -21.537 -16.650 -16.175
  295    H5'    C  28           H5'      CYT  28 -20.187 -20.182 -20.976
  296   H5''    C  28          H5''      CYT  28 -21.214 -21.380 -21.784
  297    H4'    C  28           H4'      CYT  28 -19.142 -22.417 -21.071
  298    H3'    C  28           H3'      CYT  28 -21.489 -23.227 -19.300
  299    H2'    C  28           H2'      CYT  28 -19.999 -24.859 -18.372
  300   HO2'    C  28          H2''      CYT  28 -18.224 -24.159 -20.499
  301    H1'    C  28           H1'      CYT  28 -17.875 -23.097 -18.206
  302    H41    C  28           H41      CYT  28 -21.028 -22.050 -12.661
  303    H42    C  28           H42      CYT  28 -22.318 -23.031 -13.321
  304    H5     C  28           H5       CYT  28 -22.100 -21.122 -15.558
  305    H6     C  28           H6       CYT  28 -20.944 -21.304 -17.697
  306    H5'    C  29           H5'      CYT  29 -19.879 -26.631 -20.332
  307   H5''    C  29          H5''      CYT  29 -21.013 -27.888 -20.864
  308    H4'    C  29           H4'      CYT  29 -19.626 -28.727 -19.055
  309    H3'    C  29           H3'      CYT  29 -22.482 -28.170 -18.147
  310    H2'    C  29           H2'      CYT  29 -21.882 -29.206 -16.078
  311   HO2'    C  29          H2''      CYT  29 -19.784 -30.254 -15.898
  312    H1'    C  29           H1'      CYT  29 -19.381 -28.015 -15.946
  313    H41    C  29           H41      CYT  29 -23.333 -24.284 -12.550
  314    H42    C  29           H42      CYT  29 -24.326 -24.028 -13.969
  315    H5     C  29           H5       CYT  29 -23.200 -24.257 -16.161
  316    H6     C  29           H6       CYT  29 -21.735 -25.739 -17.430
  317    H5'    C  30           H5'      CYT  30 -21.675 -31.976 -16.972
  318   H5''    C  30          H5''      CYT  30 -22.968 -33.112 -17.395
  319    H4'    C  30           H4'      CYT  30 -22.427 -33.381 -15.070
  320    H3'    C  30           H3'      CYT  30 -25.048 -31.890 -15.473
  321    H2'    C  30           H2'      CYT  30 -25.354 -32.080 -13.108
  322   HO2'    C  30          H2''      CYT  30 -23.077 -33.799 -13.034
  323    H1'    C  30           H1'      CYT  30 -22.725 -31.495 -12.474
  324    H41    C  30           H41      CYT  30 -26.056 -26.041 -12.190
  325    H42    C  30           H42      CYT  30 -25.912 -25.875 -13.924
  326    H5     C  30           H5       CYT  30 -24.948 -27.534 -15.332
  327    H6     C  30           H6       CYT  30 -23.849 -29.707 -15.405
  328    H5'    C  31           H5'      CYT  31 -26.068 -34.993 -13.060
  329   H5''    C  31          H5''      CYT  31 -27.478 -35.869 -13.686
  330    H4'    C  31           H4'      CYT  31 -27.890 -35.254 -11.390
  331    H3'    C  31           H3'      CYT  31 -29.380 -33.520 -13.355
  332   HO3'    C  31          H3T       CYT  31 -31.031 -34.962 -12.799
  333    H2'    C  31           H2'      CYT  31 -30.461 -32.467 -11.551
  334   HO2'    C  31          H2''      CYT  31 -30.448 -33.361  -9.441
  335    H1'    C  31           H1'      CYT  31 -28.234 -32.523  -9.842
  336    H41    C  31           H41      CYT  31 -28.748 -26.584 -12.168
  337    H42    C  31           H42      CYT  31 -28.053 -27.108 -13.683
  338    H5     C  31           H5       CYT  31 -27.368 -29.371 -14.106
  339    H6     C  31           H6       CYT  31 -27.371 -31.657 -13.246
  Start of MODEL   10
    1    H5'    G   1           H5'      GUA   1 -31.284 -24.636  -0.714
    2   H5''    G   1          H5''      GUA   1 -29.707 -24.032  -0.161
    3    H4'    G   1           H4'      GUA   1 -29.603 -26.445  -0.373
    4    H3'    G   1           H3'      GUA   1 -28.106 -25.006  -2.571
    5    H2'    G   1           H2'      GUA   1 -27.363 -27.134  -3.333
    6   HO2'    G   1          H2''      GUA   1 -27.894 -29.042  -1.987
    7    H1'    G   1           H1'      GUA   1 -29.775 -28.428  -2.917
    8    H8     G   1           H8       GUA   1 -30.398 -25.002  -4.383
    9    H1     G   1           H1       GUA   1 -28.220 -29.189  -8.695
   10    H21    G   1           H21      GUA   1 -27.744 -31.139  -7.661
   11    H22    G   1           H22      GUA   1 -27.384 -31.121  -5.950
   12   HO5'    G   1          H5T       GUA   1 -30.975 -23.097  -2.129
   13    H5'    G   2           H5'      GUA   2 -25.823 -27.950  -1.038
   14   H5''    G   2          H5''      GUA   2 -24.142 -27.487  -0.699
   15    H4'    G   2           H4'      GUA   2 -24.184 -29.546  -2.000
   16    H3'    G   2           H3'      GUA   2 -23.188 -27.198  -3.699
   17    H2'    G   2           H2'      GUA   2 -22.716 -28.848  -5.338
   18   HO2'    G   2          H2''      GUA   2 -22.473 -30.450  -3.148
   19    H1'    G   2           H1'      GUA   2 -25.050 -30.295  -4.954
   20    H8     G   2           H8       GUA   2 -25.735 -26.576  -4.753
   21    H1     G   2           H1       GUA   2 -25.049 -28.619 -10.776
   22    H21    G   2           H21      GUA   2 -24.241 -30.694 -10.790
   23    H22    G   2           H22      GUA   2 -24.150 -31.661  -9.337
   24    H5'    G   3           H5'      GUA   3 -20.618 -30.106  -3.995
   25   H5''    G   3          H5''      GUA   3 -18.905 -29.654  -3.894
   26    H4'    G   3           H4'      GUA   3 -19.350 -30.883  -5.951
   27    H3'    G   3           H3'      GUA   3 -18.734 -27.922  -6.492
   28    H2'    G   3           H2'      GUA   3 -18.914 -28.399  -8.798
   29   HO2'    G   3          H2''      GUA   3 -18.459 -31.088  -7.997
   30    H1'    G   3           H1'      GUA   3 -20.926 -30.349  -8.551
   31    H8     G   3           H8       GUA   3 -21.969 -27.375  -6.559
   32    H1     G   3           H1       GUA   3 -22.733 -26.390 -12.842
   33    H21    G   3           H21      GUA   3 -21.961 -28.195 -13.975
   34    H22    G   3           H22      GUA   3 -20.689 -29.157 -13.258
   35    H5'    G   4           H5'      GUA   4 -16.190 -30.269  -8.952
   36   H5''    G   4          H5''      GUA   4 -14.531 -29.629  -8.975
   37    H4'    G   4           H4'      GUA   4 -15.304 -29.983 -11.253
   38    H3'    G   4           H3'      GUA   4 -15.304 -27.031 -10.572
   39    H2'    G   4           H2'      GUA   4 -15.748 -26.698 -12.907
   40   HO2'    G   4          H2''      GUA   4 -14.530 -29.105 -13.138
   41    H1'    G   4           H1'      GUA   4 -17.694 -28.632 -12.995
   42    H8     G   4           H8       GUA   4 -17.794 -26.874  -9.622
   43    H1     G   4           H1       GUA   4 -20.379 -23.403 -14.331
   44    H21    G   4           H21      GUA   4 -20.020 -24.405 -16.296
   45    H22    G   4           H22      GUA   4 -19.087 -25.877 -16.432
   46    H5'    A   5           H5'      ADE   5 -13.251 -27.444 -14.024
   47   H5''    A   5          H5''      ADE   5 -11.735 -26.522 -14.056
   48    H4'    A   5           H4'      ADE   5 -13.010 -25.997 -16.040
   49    H3'    A   5           H3'      ADE   5 -13.037 -23.688 -14.066
   50    H2'    A   5           H2'      ADE   5 -14.221 -22.463 -15.718
   51   HO2'    A   5          H2''      ADE   5 -13.904 -22.822 -17.783
   52    H1'    A   5           H1'      ADE   5 -15.931 -24.492 -16.445
   53    H8     A   5           H8       ADE   5 -15.168 -24.508 -12.695
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  296   H5''    C  28          H5''      CYT  28 -26.183 -20.006 -20.928
  297    H4'    C  28           H4'      CYT  28 -23.932 -20.810 -21.388
  298    H3'    C  28           H3'      CYT  28 -25.248 -22.366 -19.102
  299    H2'    C  28           H2'      CYT  28 -23.400 -23.878 -19.300
  300   HO2'    C  28          H2''      CYT  28 -21.861 -22.976 -21.196
  301    H1'    C  28           H1'      CYT  28 -21.533 -21.849 -19.579
  302    H41    C  28           H41      CYT  28 -21.924 -22.477 -13.162
  303    H42    C  28           H42      CYT  28 -23.335 -23.477 -13.429
  304    H5     C  28           H5       CYT  28 -24.271 -21.203 -15.006
  305    H6     C  28           H6       CYT  28 -24.197 -20.783 -17.408
  306    H5'    C  29           H5'      CYT  29 -24.202 -25.197 -21.599
  307   H5''    C  29          H5''      CYT  29 -25.457 -26.426 -21.850
  308    H4'    C  29           H4'      CYT  29 -23.413 -27.501 -21.138
  309    H3'    C  29           H3'      CYT  29 -25.485 -27.376 -18.931
  310    H2'    C  29           H2'      CYT  29 -24.051 -28.851 -17.715
  311   HO2'    C  29          H2''      CYT  29 -22.324 -29.907 -18.669
  312    H1'    C  29           H1'      CYT  29 -21.749 -27.461 -18.345
  313    H41    C  29           H41      CYT  29 -23.994 -25.071 -12.827
  314    H42    C  29           H42      CYT  29 -25.450 -24.540 -13.636
  315    H5     C  29           H5       CYT  29 -25.417 -24.246 -16.069
  316    H6     C  29           H6       CYT  29 -24.571 -25.217 -18.146
  317    H5'    C  30           H5'      CYT  30 -24.413 -31.261 -19.275
  318   H5''    C  30          H5''      CYT  30 -25.813 -32.346 -19.372
  319    H4'    C  30           H4'      CYT  30 -24.335 -33.185 -17.686
  320    H3'    C  30           H3'      CYT  30 -26.790 -31.834 -16.510
  321    H2'    C  30           H2'      CYT  30 -26.028 -32.633 -14.389
  322   HO2'    C  30          H2''      CYT  30 -24.322 -34.159 -14.246
  323    H1'    C  30           H1'      CYT  30 -23.365 -32.031 -14.797
  324    H41    C  30           H41      CYT  30 -25.918 -27.013 -11.782
  325    H42    C  30           H42      CYT  30 -26.902 -26.644 -13.180
  326    H5     C  30           H5       CYT  30 -26.545 -27.709 -15.309
  327    H6     C  30           H6       CYT  30 -25.628 -29.682 -16.419
  328    H5'    C  31           H5'      CYT  31 -26.791 -35.601 -14.854
  329   H5''    C  31          H5''      CYT  31 -28.376 -36.379 -15.014
  330    H4'    C  31           H4'      CYT  31 -27.667 -36.475 -12.704
  331    H3'    C  31           H3'      CYT  31 -29.827 -34.416 -13.176
  332   HO3'    C  31          H3T       CYT  31 -29.999 -36.901 -11.828
  333    H2'    C  31           H2'      CYT  31 -29.894 -34.000 -10.865
  334   HO2'    C  31          H2''      CYT  31 -29.156 -35.446  -9.336
  335    H1'    C  31           H1'      CYT  31 -27.135 -34.366 -10.439
  336    H41    C  31           H41      CYT  31 -28.694 -28.106 -10.518
  337    H42    C  31           H42      CYT  31 -27.899 -28.023 -12.073
  338    H5     C  31           H5       CYT  31 -28.109 -30.056 -13.486
  339    H6     C  31           H6       CYT  31 -27.887 -32.487 -13.429
  Start of MODEL   11
    1    H5'    G   1           H5'      GUA   1 -35.741 -21.304  -6.415
    2   H5''    G   1          H5''      GUA   1 -34.476 -20.527  -5.441
    3    H4'    G   1           H4'      GUA   1 -34.598 -22.868  -4.848
    4    H3'    G   1           H3'      GUA   1 -32.178 -22.183  -6.504
    5    H2'    G   1           H2'      GUA   1 -31.423 -24.416  -6.136
    6   HO2'    G   1          H2''      GUA   1 -33.537 -24.629  -4.226
    7    H1'    G   1           H1'      GUA   1 -33.887 -25.580  -6.554
    8    H8     G   1           H8       GUA   1 -33.409 -22.710  -8.978
    9    H1     G   1           H1       GUA   1 -29.928 -27.836 -10.548
   10    H21    G   1           H21      GUA   1 -30.204 -29.436  -8.982
   11    H22    G   1           H22      GUA   1 -30.704 -28.975  -7.372
   12   HO5'    G   1          H5T       GUA   1 -34.701 -20.720  -8.115
   13    H5'    G   2           H5'      GUA   2 -31.153 -24.374  -3.362
   14   H5''    G   2          H5''      GUA   2 -29.728 -23.816  -2.464
   15    H4'    G   2           H4'      GUA   2 -29.522 -26.188  -2.994
   16    H3'    G   2           H3'      GUA   2 -27.554 -24.513  -4.633
   17    H2'    G   2           H2'      GUA   2 -26.670 -26.607  -5.331
   18   HO2'    G   2          H2''      GUA   2 -26.913 -28.423  -4.196
   19    H1'    G   2           H1'      GUA   2 -29.118 -27.793  -5.768
   20    H8     G   2           H8       GUA   2 -29.264 -24.134  -6.734
   21    H1     G   2           H1       GUA   2 -26.237 -27.671 -11.118
   22    H21    G   2           H21      GUA   2 -25.801 -29.696 -10.293
   23    H22    G   2           H22      GUA   2 -26.584 -30.280  -8.843
   24    H5'    G   3           H5'      GUA   3 -25.610 -27.421  -2.891
   25   H5''    G   3          H5''      GUA   3 -24.050 -27.001  -2.158
   26    H4'    G   3           H4'      GUA   3 -23.781 -28.828  -3.743
   27    H3'    G   3           H3'      GUA   3 -22.599 -26.211  -4.760
   28    H2'    G   3           H2'      GUA   3 -21.741 -27.467  -6.595
   29   HO2'    G   3          H2''      GUA   3 -22.041 -29.839  -6.537
   30    H1'    G   3           H1'      GUA   3 -24.013 -29.016  -6.936
   31    H8     G   3           H8       GUA   3 -25.092 -25.513  -6.154
   32    H1     G   3           H1       GUA   3 -22.861 -26.035 -12.132
   33    H21    G   3           H21      GUA   3 -22.026 -28.096 -12.456
   34    H22    G   3           H22      GUA   3 -21.630 -29.125 -11.095
   35    H5'    G   4           H5'      GUA   4 -19.631 -29.231  -4.916
   36   H5''    G   4          H5''      GUA   4 -18.069 -28.657  -4.290
   37    H4'    G   4           H4'      GUA   4 -17.737 -29.689  -6.465
   38    H3'    G   4           H3'      GUA   4 -17.575 -26.672  -6.637
   39    H2'    G   4           H2'      GUA   4 -16.822 -27.024  -8.893
   40   HO2'    G   4          H2''      GUA   4 -16.226 -29.530  -7.905
   41    H1'    G   4           H1'      GUA   4 -18.828 -28.782  -9.479
   42    H8     G   4           H8       GUA   4 -20.064 -26.198  -6.961
   43    H1     G   4           H1       GUA   4 -19.551 -23.831 -12.880
   44    H21    G   4           H21      GUA   4 -18.605 -25.334 -14.225
   45    H22    G   4           H22      GUA   4 -18.022 -26.873 -13.637
   46    H5'    A   5           H5'      ADE   5 -14.289 -28.137  -8.426
   47   H5''    A   5          H5''      ADE   5 -12.778 -27.344  -7.940
   48    H4'    A   5           H4'      ADE   5 -12.929 -27.362 -10.355
   49    H3'    A   5           H3'      ADE   5 -13.350 -24.589  -9.231
   50    H2'    A   5           H2'      ADE   5 -13.481 -23.827 -11.468
   51   HO2'    A   5          H2''      ADE   5 -13.111 -26.085 -12.902
   52    H1'    A   5           H1'      ADE   5 -15.052 -25.884 -12.417
   53    H8     A   5           H8       ADE   5 -16.081 -24.907  -8.872
   54    H61    A   5           H61      ADE   5 -19.596 -20.642 -11.326
   55    H62    A   5           H62      ADE   5 -18.486 -20.677  -9.974
   56    H2     A   5           H2       ADE   5 -16.819 -22.178 -14.642
   57    H5'    G   6           H5'      GUA   6 -10.701 -24.597 -12.163
   58   H5''    G   6          H5''      GUA   6  -9.241 -23.610 -11.956
   59    H4'    G   6           H4'      GUA   6 -10.415 -23.020 -14.018
   60    H3'    G   6           H3'      GUA   6 -10.505 -20.930 -11.863
   61    H2'    G   6           H2'      GUA   6 -11.560 -19.497 -13.425
   62   HO2'    G   6          H2''      GUA   6 -11.083 -21.409 -15.479
   63    H1'    G   6           H1'      GUA   6 -13.221 -21.434 -14.520
   64    H8     G   6           H8       GUA   6 -12.873 -21.796 -10.743
   65    H1     G   6           H1       GUA   6 -16.790 -17.004 -12.388
   66    H21    G   6           H21      GUA   6 -16.577 -16.592 -14.595
   67    H22    G   6           H22      GUA   6 -15.981 -17.839 -15.662
   68    H5'    U   7           H5'      URI   7  -7.373 -17.203 -13.885
   69   H5''    U   7          H5''      URI   7  -8.404 -17.111 -12.447
   70    H4'    U   7           H4'      URI   7  -9.158 -16.404 -15.298
   71    H3'    U   7           H3'      URI   7  -8.013 -14.886 -13.277
   72    H2'    U   7           H2'      URI   7  -9.882 -14.505 -11.956
   73   HO2'    U   7          H2''      URI   7 -11.069 -12.741 -12.631
   74    H1'    U   7           H1'      URI   7 -11.850 -14.901 -14.174
   75    H3     U   7           H3       URI   7 -15.078 -15.153 -11.069
   76    H5     U   7           H5       URI   7 -12.078 -17.692  -9.531
   77    H6     U   7           H6       URI   7 -10.667 -17.040 -11.399
   78    H5'    A   8           H5'      ADE   8 -10.373 -11.700 -14.680
   79   H5''    A   8          H5''      ADE   8  -9.393 -10.267 -15.046
   80    H4'    A   8           H4'      ADE   8 -10.987  -9.577 -13.416
   81    H3'    A   8           H3'      ADE   8  -8.268  -9.483 -12.699
   82    H2'    A   8           H2'      ADE   8  -8.389 -11.122 -10.986
   83   HO2'    A   8          H2''      ADE   8  -8.000  -9.104  -9.887
   84    H1'    A   8           H1'      ADE   8 -11.225 -10.154 -10.493
   85    H8     A   8           H8       ADE   8  -8.856 -13.228 -10.349
   86    H61    A   8           H62      ADE   8 -13.399 -15.955  -7.272
   87    H62    A   8           H61      ADE   8 -11.654 -15.824  -7.223
   88    H2     A   8           H2       ADE   8 -14.850 -11.869  -8.538
   89    H5'    C   9           H5'      CYT   9 -10.704  -6.224 -13.449
   90   H5''    C   9          H5''      CYT   9  -9.288  -5.170 -13.644
   91    H4'    C   9           H4'      CYT   9 -11.281  -3.858 -14.031
   92    H3'    C   9           H3'      CYT   9  -9.395  -3.056 -12.054
   93    H2'    C   9           H2'      CYT   9 -10.803  -3.713 -10.241
   94   HO2'    C   9          H2''      CYT   9 -11.358  -1.850  -9.324
   95    H1'    C   9           H1'      CYT   9 -13.051  -2.596 -11.956
   96    H41    C   9           H42      CYT   9 -16.914  -4.038  -7.253
   97    H42    C   9           H41      CYT   9 -16.570  -5.750  -7.370
   98    H5     C   9           H5       CYT   9 -13.775  -4.775  -7.147
   99    H6     C   9           H6       CYT   9 -12.097  -4.176  -8.839
  100    H5'    G  10           H5'      GUA  10 -12.261  -0.205 -11.258
  101   H5''    G  10          H5''      GUA  10 -11.723   1.482 -11.414
  102    H4'    G  10           H4'      GUA  10 -12.774   1.113  -9.242
  103    H3'    G  10           H3'      GUA  10  -9.736   1.371  -9.059
  104    H2'    G  10           H2'      GUA  10 -10.075   1.510  -6.682
  105   HO2'    G  10          H2''      GUA  10 -11.852   2.376  -5.961
  106    H1'    G  10           H1'      GUA  10 -11.803  -0.618  -6.640
  107    H8     G  10           H8       GUA  10  -9.137  -1.113  -9.307
  108    H1     G  10           H1       GUA  10  -6.907  -2.115  -3.397
  109    H21    G  10           H21      GUA  10  -8.859  -0.418  -2.113
  110    H22    G  10           H22      GUA  10  -9.592  -2.004  -2.130
  111    H5'    G  11           H5'      GUA  11 -11.124   4.035  -6.385
  112   H5''    G  11          H5''      GUA  11 -10.458   5.661  -6.639
  113    H4'    G  11           H4'      GUA  11 -10.257   5.063  -4.300
  114    H3'    G  11           H3'      GUA  11  -7.591   4.895  -5.740
  115    H2'    G  11           H2'      GUA  11  -6.613   4.613  -3.573
  116   HO2'    G  11          H2''      GUA  11  -8.855   4.686  -2.030
  117    H1'    G  11           H1'      GUA  11  -8.535   2.828  -2.715
  118    H8     G  11           H8       GUA  11  -7.756   2.264  -6.373
  119    H1     G  11           H1       GUA  11  -3.105   0.087  -2.556
  120    H21    G  11           H21      GUA  11  -3.524   1.767  -0.454
  121    H22    G  11           H22      GUA  11  -4.791   0.649  -0.008
  122    H5'    C  12           H5'      CYT  12  -7.012   7.182  -2.517
  123   H5''    C  12          H5''      CYT  12  -6.132   8.692  -2.829
  124    H4'    C  12           H4'      CYT  12  -5.067   7.508  -1.012
  125    H3'    C  12           H3'      CYT  12  -3.328   7.488  -3.504
  126    H2'    C  12           H2'      CYT  12  -1.723   6.315  -2.221
  127   HO2'    C  12          H2''      CYT  12  -2.002   6.102   0.094
  128    H1'    C  12           H1'      CYT  12  -3.464   4.639  -0.894
  129    H41    C  12           H41      CYT  12  -1.419   1.539  -6.108
  130    H42    C  12           H42      CYT  12  -2.678   2.309  -7.049
  131    H5     C  12           H5       CYT  12  -4.086   4.052  -6.189
  132    H6     C  12           H6       CYT  12  -4.683   5.351  -4.212
  133    H5'    C  13           H5'      CYT  13  -1.253   8.395  -0.168
  134   H5''    C  13          H5''      CYT  13  -0.551  10.027  -0.175
  135    H4'    C  13           H4'      CYT  13   1.071   8.423   0.700
  136    H3'    C  13           H3'      CYT  13   1.532  10.161  -1.254
  137    H2'    C  13           H2'      CYT  13   1.723   8.752  -3.103
  138   HO2'    C  13          H2''      CYT  13   4.132   8.938  -1.793
  139    H1'    C  13           H1'      CYT  13   2.791   6.474  -1.460
  140    H41    C  13           H41      CYT  13   0.635   3.289  -6.539
  141    H42    C  13           H42      CYT  13  -1.002   3.746  -6.120
  142    H5     C  13           H5       CYT  13  -0.831   6.302  -5.517
  143    H6     C  13           H6       CYT  13   0.050   7.688  -3.697
  144    H5'    G  14           H5'      GUA  14   5.614   8.280  -0.306
  145   H5''    G  14          H5''      GUA  14   6.937   9.448  -0.468
  146    H4'    G  14           H4'      GUA  14   7.458   7.498  -1.783
  147    H3'    G  14           H3'      GUA  14   6.617   9.710  -3.764
  148    H2'    G  14           H2'      GUA  14   7.584   8.137  -5.353
  149   HO2'    G  14          H2''      GUA  14   8.980   6.652  -4.711
  150    H1'    G  14           H1'      GUA  14   6.096   6.092  -4.393
  151    H8     G  14           H8       GUA  14   4.502   9.558  -3.863
  152    H1     G  14           H1       GUA  14   3.683   7.340  -9.797
  153    H21    G  14           H21      GUA  14   4.836   5.473 -10.088
  154    H22    G  14           H22      GUA  14   5.604   4.625  -8.771
  155    H5'    C  15           H5'      CYT  15   9.171  13.118  -5.461
  156   H5''    C  15          H5''      CYT  15   7.455  12.947  -5.039
  157    H4'    C  15           H4'      CYT  15   7.528  13.243  -7.405
  158    H3'    C  15           H3'      CYT  15   6.403  11.056  -6.361
  159    H2'    C  15           H2'      CYT  15   8.077   9.443  -6.666
  160   HO2'    C  15          H2''      CYT  15   6.535   9.600  -8.956
  161    H1'    C  15           H1'      CYT  15   9.131  10.570  -9.223
  162    H41    C  15           H42      CYT  15  14.327   7.708  -7.026
  163    H42    C  15           H41      CYT  15  14.152   8.459  -5.456
  164    H5     C  15           H5       CYT  15  11.930   9.247  -4.769
  165    H6     C  15           H6       CYT  15   9.844  10.233  -5.580
  166    H5'    A  16           H5'      ADE  16   8.654  10.461 -11.634
  167   H5''    A  16          H5''      ADE  16   7.067  10.207 -12.388
  168    H4'    A  16           H4'      ADE  16   8.468   8.274 -12.780
  169    H3'    A  16           H3'      ADE  16   6.012   8.147 -11.565
  170    H2'    A  16           H2'      ADE  16   6.692   7.272  -9.507
  171   HO2'    A  16          H2''      ADE  16   5.736   5.444 -10.770
  172    H1'    A  16           H1'      ADE  16   9.052   5.965 -10.864
  173    H8     A  16           H8       ADE  16   7.653   7.582  -7.658
  174    H61    A  16           H61      ADE  16  12.513   4.954  -4.894
  175    H62    A  16           H62      ADE  16  10.953   5.703  -4.631
  176    H2     A  16           H2       ADE  16  12.817   4.156  -9.310
  177    H5'    A  17           H5'      ADE  17   8.214   4.678 -13.404
  178   H5''    A  17          H5''      ADE  17   7.426   3.161 -13.883
  179    H4'    A  17           H4'      ADE  17   9.604   2.741 -12.825
  180    H3'    A  17           H3'      ADE  17   7.182   1.899 -11.132
  181    H2'    A  17           H2'      ADE  17   8.761   0.856  -9.667
  182   HO2'    A  17          H2''      ADE  17  10.636   1.313 -11.776
  183    H1'    A  17           H1'      ADE  17  10.529   2.966  -9.706
  184    H8     A  17           H8       ADE  17   6.899   4.123  -9.790
  185    H61    A  17           H61      ADE  17   6.521   3.011  -3.826
  186    H62    A  17           H62      ADE  17   6.037   4.240  -4.975
  187    H2     A  17           H2       ADE  17  10.693   1.817  -5.137
  188    H5'    G  18           H5'      GUA  18   9.157  -1.065 -10.764
  189   H5''    G  18          H5''      GUA  18   8.272  -2.595 -10.597
  190    H4'    G  18           H4'      GUA  18   9.354  -1.889  -8.491
  191    H3'    G  18           H3'      GUA  18   6.338  -2.084  -8.493
  192    H2'    G  18           H2'      GUA  18   6.345  -1.457  -6.184
  193   HO2'    G  18          H2''      GUA  18   8.422  -1.174  -5.107
  194    H1'    G  18           H1'      GUA  18   8.045   0.625  -6.446
  195    H8     G  18           H8       GUA  18   6.220   0.302  -9.735
  196    H1     G  18           H1       GUA  18   2.594   2.967  -5.185
  197    H21    G  18           H21      GUA  18   3.956   3.160  -3.260
  198    H22    G  18           H22      GUA  18   4.818   1.669  -2.965
  199    H5'    G  19           H5'      GUA  19   7.764  -3.470  -5.212
  200   H5''    G  19          H5''      GUA  19   7.071  -4.935  -4.484
  201    H4'    G  19           H4'      GUA  19   6.997  -3.068  -2.908
  202    H3'    G  19           H3'      GUA  19   4.234  -3.854  -3.920
  203    H2'    G  19           H2'      GUA  19   3.413  -2.318  -2.277
  204   HO2'    G  19          H2''      GUA  19   6.035  -2.552  -1.283
  205    H1'    G  19           H1'      GUA  19   5.102  -0.308  -2.980
  206    H8     G  19           H8       GUA  19   4.300  -2.508  -5.978
  207    H1     G  19           H1       GUA  19  -0.412   1.590  -4.566
  208    H21    G  19           H21      GUA  19  -0.051   2.105  -2.192
  209    H22    G  19           H22      GUA  19   1.562   2.779  -2.130
  210    H5'    U  20           H5'      URI  20   4.076  -3.734   0.048
  211   H5''    U  20          H5''      URI  20   3.237  -5.102   0.803
  212    H4'    U  20           H4'      URI  20   2.260  -3.030   1.585
  213    H3'    U  20           H3'      URI  20   0.448  -4.553  -0.300
  214    H2'    U  20           H2'      URI  20  -1.207  -2.901   0.113
  215   HO2'    U  20          H2''      URI  20   0.361  -2.409   2.375
  216    H1'    U  20           H1'      URI  20   0.445  -0.748  -0.153
  217    H3     U  20           H3       URI  20  -2.018  -1.126  -4.007
  218    H5     U  20           H5       URI  20   1.016  -4.040  -4.368
  219    H6     U  20           H6       URI  20   1.715  -3.488  -2.114
  220    H5'    U  21           H5'      URI  21  -1.611  -3.236   2.683
  221   H5''    U  21          H5''      URI  21  -2.227  -4.493   3.777
  222    H4'    U  21           H4'      URI  21  -3.927  -2.780   3.424
  223    H3'    U  21           H3'      URI  21  -4.446  -5.439   3.171
  224    H2'    U  21           H2'      URI  21  -4.688  -5.594   0.851
  225   HO2'    U  21          H2''      URI  21  -6.788  -5.950   1.333
  226    H1'    U  21           H1'      URI  21  -5.735  -2.819   0.517
  227    H3     U  21           H3       URI  21  -5.001  -2.942  -3.875
  228    H5     U  21           H5       URI  21  -1.598  -4.889  -2.315
  229    H6     U  21           H6       URI  21  -2.562  -4.641  -0.099
  230    H5'    A  22           H5'      ADE  22 -10.058  -5.073   2.804
  231   H5''    A  22          H5''      ADE  22  -8.919  -6.095   1.903
  232    H4'    A  22           H4'      ADE  22 -10.027  -3.478   0.839
  233    H3'    A  22           H3'      ADE  22 -11.527  -5.887   0.969
  234    H2'    A  22           H2'      ADE  22 -10.379  -6.918  -0.845
  235   HO2'    A  22          H2''      ADE  22 -11.592  -6.618  -2.644
  236    H1'    A  22           H1'      ADE  22 -10.026  -4.088  -1.873
  237    H8     A  22           H8       ADE  22  -7.023  -6.406  -1.509
  238    H61    A  22           H62      ADE  22  -7.148  -6.675  -7.690
  239    H62    A  22           H61      ADE  22  -6.225  -7.063  -6.255
  240    H2     A  22           H2       ADE  22 -10.933  -4.683  -6.309
  241    H5'    A  23           H5'      ADE  23 -12.885  -4.303  -2.755
  242   H5''    A  23          H5''      ADE  23 -14.350  -3.354  -2.418
  243    H4'    A  23           H4'      ADE  23 -14.656  -4.513  -4.524
  244    H3'    A  23           H3'      ADE  23 -16.449  -4.807  -2.414
  245    H2'    A  23           H2'      ADE  23 -15.929  -7.033  -1.841
  246   HO2'    A  23          H2''      ADE  23 -17.252  -7.954  -4.100
  247    H1'    A  23           H1'      ADE  23 -15.349  -7.667  -4.740
  248    H8     A  23           H8       ADE  23 -13.570  -7.920  -1.260
  249    H61    A  23           H61      ADE  23 -11.604 -13.179  -3.129
  250    H62    A  23           H62      ADE  23 -12.690 -13.014  -1.763
  251    H2     A  23           H2       ADE  23 -14.760 -11.758  -6.270
  252    H5'    A  24           H5'      ADE  24 -18.303  -7.127  -5.993
  253   H5''    A  24          H5''      ADE  24 -19.954  -6.517  -6.229
  254    H4'    A  24           H4'      ADE  24 -20.077  -8.907  -6.360
  255    H3'    A  24           H3'      ADE  24 -21.527  -7.584  -4.401
  256    H2'    A  24           H2'      ADE  24 -20.184  -8.276  -2.553
  257   HO2'    A  24          H2''      ADE  24 -22.287 -10.033  -3.074
  258    H1'    A  24           H1'      ADE  24 -19.921 -10.919  -4.027
  259    H8     A  24           H8       ADE  24 -18.421  -8.689  -1.269
  260    H61    A  24           H62      ADE  24 -14.291 -13.173  -0.535
  261    H62    A  24           H61      ADE  24 -15.247 -12.042   0.398
  262    H2     A  24           H2       ADE  24 -16.889 -14.250  -4.073
  263    H5'    A  25           H5'      ADE  25 -23.909 -10.148  -8.518
  264   H5''    A  25          H5''      ADE  25 -22.483 -10.984  -7.870
  265    H4'    A  25           H4'      ADE  25 -22.335  -8.763  -9.934
  266    H3'    A  25           H3'      ADE  25 -22.448 -11.786 -10.328
  267    H2'    A  25           H2'      ADE  25 -20.967 -11.499 -12.181
  268   HO2'    A  25          H2''      ADE  25 -20.352  -9.335 -12.833
  269    H1'    A  25           H1'      ADE  25 -19.261  -9.836 -10.892
  270    H8     A  25           H8       ADE  25 -20.716 -12.299  -8.378
  271    H61    A  25           H61      ADE  25 -16.307 -16.152  -9.913
  272    H62    A  25           H62      ADE  25 -18.024 -16.321  -9.629
  273    H2     A  25           H2       ADE  25 -16.332 -12.810 -13.056
  274    H5'    C  26           H5'      CYT  26 -22.527 -10.448 -13.891
  275   H5''    C  26          H5''      CYT  26 -23.750 -11.164 -14.954
  276    H4'    C  26           H4'      CYT  26 -21.523 -11.339 -15.942
  277    H3'    C  26           H3'      CYT  26 -22.554 -14.059 -14.975
  278    H2'    C  26           H2'      CYT  26 -20.672 -14.978 -16.146
  279   HO2'    C  26          H2''      CYT  26 -20.576 -12.416 -17.398
  280    H1'    C  26           H1'      CYT  26 -18.941 -12.948 -15.343
  281    H41    C  26           H41      CYT  26 -18.160 -17.285 -10.683
  282    H42    C  26           H42      CYT  26 -19.611 -18.089 -11.240
  283    H5     C  26           H5       CYT  26 -20.876 -15.497 -11.054
  284    H6     C  26           H6       CYT  26 -21.221 -13.722 -12.691
  285    H5'    U  27           H5'      URI  27 -21.457 -14.506 -18.716
  286   H5''    U  27          H5''      URI  27 -22.486 -15.535 -19.729
  287    H4'    U  27           H4'      URI  27 -20.199 -16.337 -19.786
  288    H3'    U  27           H3'      URI  27 -21.973 -18.199 -18.155
  289    H2'    U  27           H2'      URI  27 -20.075 -19.665 -18.129
  290   HO2'    U  27          H2''      URI  27 -18.136 -18.637 -19.399
  291    H1'    U  27           H1'      URI  27 -18.250 -17.662 -17.618
  292    H3     U  27           H3       URI  27 -18.701 -20.128 -13.780
  293    H5     U  27           H5       URI  27 -22.098 -17.620 -13.878
  294    H6     U  27           H6       URI  27 -21.408 -16.890 -16.084
  295    H5'    C  28           H5'      CYT  28 -19.953 -20.346 -20.941
  296   H5''    C  28          H5''      CYT  28 -20.975 -21.470 -21.857
  297    H4'    C  28           H4'      CYT  28 -18.987 -22.612 -21.054
  298    H3'    C  28           H3'      CYT  28 -21.466 -23.407 -19.460
  299    H2'    C  28           H2'      CYT  28 -20.087 -25.135 -18.531
  300   HO2'    C  28          H2''      CYT  28 -17.752 -25.039 -19.475
  301    H1'    C  28           H1'      CYT  28 -17.916 -23.453 -18.168
  302    H41    C  28           H41      CYT  28 -21.330 -22.515 -12.754
  303    H42    C  28           H42      CYT  28 -22.607 -23.437 -13.516
  304    H5     C  28           H5       CYT  28 -22.207 -21.438 -15.657
  305    H6     C  28           H6       CYT  28 -20.952 -21.584 -17.745
  306    H5'    C  29           H5'      CYT  29 -19.923 -26.815 -20.579
  307   H5''    C  29          H5''      CYT  29 -21.074 -28.010 -21.210
  308    H4'    C  29           H4'      CYT  29 -19.798 -28.966 -19.375
  309    H3'    C  29           H3'      CYT  29 -22.658 -28.324 -18.571
  310    H2'    C  29           H2'      CYT  29 -22.190 -29.495 -16.539
  311   HO2'    C  29          H2''      CYT  29 -19.994 -30.511 -16.385
  312    H1'    C  29           H1'      CYT  29 -19.676 -28.369 -16.221
  313    H41    C  29           H41      CYT  29 -23.762 -24.672 -12.935
  314    H42    C  29           H42      CYT  29 -24.685 -24.381 -14.393
  315    H5     C  29           H5       CYT  29 -23.418 -24.531 -16.524
  316    H6     C  29           H6       CYT  29 -21.891 -25.986 -17.756
  317    H5'    C  30           H5'      CYT  30 -22.028 -32.220 -17.539
  318   H5''    C  30          H5''      CYT  30 -23.327 -33.297 -18.090
  319    H4'    C  30           H4'      CYT  30 -22.938 -33.684 -15.745
  320    H3'    C  30           H3'      CYT  30 -25.498 -32.116 -16.242
  321    H2'    C  30           H2'      CYT  30 -25.941 -32.348 -13.910
  322   HO2'    C  30          H2''      CYT  30 -23.731 -34.160 -13.769
  323    H1'    C  30           H1'      CYT  30 -23.334 -31.869 -13.096
  324    H41    C  30           H41      CYT  30 -26.312 -26.225 -12.810
  325    H42    C  30           H42      CYT  30 -26.459 -26.191 -14.552
  326    H5     C  30           H5       CYT  30 -25.305 -27.761 -15.960
  327    H6     C  30           H6       CYT  30 -24.266 -29.967 -16.045
  328    H5'    C  31           H5'      CYT  31 -26.703 -35.277 -13.952
  329   H5''    C  31          H5''      CYT  31 -28.091 -36.110 -14.678
  330    H4'    C  31           H4'      CYT  31 -28.601 -35.586 -12.376
  331    H3'    C  31           H3'      CYT  31 -30.005 -33.755 -14.323
  332   HO3'    C  31          H3T       CYT  31 -31.690 -35.178 -13.934
  333    H2'    C  31           H2'      CYT  31 -31.128 -32.740 -12.520
  334   HO2'    C  31          H2''      CYT  31 -31.163 -33.716 -10.431
  335    H1'    C  31           H1'      CYT  31 -28.967 -32.890 -10.738
  336    H41    C  31           H41      CYT  31 -29.488 -26.943 -13.122
  337    H42    C  31           H42      CYT  31 -28.284 -27.366 -14.317
  338    H5     C  31           H5       CYT  31 -27.863 -29.677 -14.898
  339    H6     C  31           H6       CYT  31 -27.959 -31.980 -14.086
  Start of MODEL   12
    1    H5'    G   1           H5'      GUA   1 -24.600 -30.541   1.069
    2   H5''    G   1          H5''      GUA   1 -22.869 -30.175   0.931
    3    H4'    G   1           H4'      GUA   1 -23.331 -32.172  -0.332
    4    H3'    G   1           H3'      GUA   1 -22.836 -29.766  -2.103
    5    H2'    G   1           H2'      GUA   1 -22.943 -31.260  -3.955
    6   HO2'    G   1          H2''      GUA   1 -22.794 -33.368  -2.028
    7    H1'    G   1           H1'      GUA   1 -25.074 -32.733  -3.011
    8    H8     G   1           H8       GUA   1 -25.584 -29.039  -2.287
    9    H1     G   1           H1       GUA   1 -26.394 -30.525  -8.449
   10    H21    G   1           H21      GUA   1 -26.109 -32.891  -8.618
   11    H22    G   1           H22      GUA   1 -24.674 -33.353  -7.733
   12   HO5'    G   1          H5T       GUA   1 -23.439 -28.316   0.215
   13    H5'    G   2           H5'      GUA   2 -20.499 -32.880  -3.331
   14   H5''    G   2          H5''      GUA   2 -18.838 -32.401  -3.737
   15    H4'    G   2           H4'      GUA   2 -19.791 -33.701  -5.560
   16    H3'    G   2           H3'      GUA   2 -19.566 -30.747  -6.352
   17    H2'    G   2           H2'      GUA   2 -20.138 -31.527  -8.538
   18   HO2'    G   2          H2''      GUA   2 -19.160 -33.901  -7.544
   19    H1'    G   2           H1'      GUA   2 -22.183 -33.145  -7.668
   20    H8     G   2           H8       GUA   2 -21.951 -30.035  -5.512
   21    H1     G   2           H1       GUA   2 -24.709 -28.897 -11.172
   22    H21    G   2           H21      GUA   2 -24.371 -30.650 -12.536
   23    H22    G   2           H22      GUA   2 -23.906 -32.210 -11.896
   24    H5'    G   3           H5'      GUA   3 -17.805 -32.817  -9.125
   25   H5''    G   3          H5''      GUA   3 -16.253 -32.167  -9.687
   26    H4'    G   3           H4'      GUA   3 -17.783 -32.473 -11.559
   27    H3'    G   3           H3'      GUA   3 -17.371 -29.539 -10.862
   28    H2'    G   3           H2'      GUA   3 -18.587 -29.061 -12.865
   29   HO2'    G   3          H2''      GUA   3 -19.050 -31.645 -13.680
   30    H1'    G   3           H1'      GUA   3 -20.496 -31.009 -12.433
   31    H8     G   3           H8       GUA   3 -19.752 -29.550  -9.089
   32    H1     G   3           H1       GUA   3 -23.026 -25.427 -12.746
   33    H21    G   3           H21      GUA   3 -23.330 -26.380 -14.822
   34    H22    G   3           H22      GUA   3 -22.061 -27.447 -15.399
   35    H5'    G   4           H5'      GUA   4 -16.615 -30.083 -14.896
   36   H5''    G   4          H5''      GUA   4 -15.106 -29.311 -15.423
   37    H4'    G   4           H4'      GUA   4 -16.888 -28.703 -16.945
   38    H3'    G   4           H3'      GUA   4 -16.166 -26.398 -15.131
   39    H2'    G   4           H2'      GUA   4 -17.616 -25.084 -16.528
   40   HO2'    G   4          H2''      GUA   4 -17.083 -27.061 -18.329
   41    H1'    G   4           H1'      GUA   4 -19.651 -26.887 -16.427
   42    H8     G   4           H8       GUA   4 -17.682 -27.065 -13.182
   43    H1     G   4           H1       GUA   4 -21.408 -21.881 -13.492
   44    H21    G   4           H21      GUA   4 -22.349 -21.729 -15.501
   45    H22    G   4           H22      GUA   4 -21.916 -22.802 -16.812
   46    H5'    A   5           H5'      ADE   5 -16.212 -25.162 -18.905
   47   H5''    A   5          H5''      ADE   5 -14.901 -24.071 -19.393
   48    H4'    A   5           H4'      ADE   5 -17.059 -23.084 -19.926
   49    H3'    A   5           H3'      ADE   5 -15.670 -21.626 -17.630
   50    H2'    A   5           H2'      ADE   5 -17.444 -20.052 -17.786
   51   HO2'    A   5          H2''      ADE   5 -17.672 -21.115 -20.346
   52    H1'    A   5           H1'      ADE   5 -19.451 -21.912 -17.984
   53    H8     A   5           H8       ADE   5 -16.672 -23.185 -15.710
   54    H61    A   5           H61      ADE   5 -19.511 -20.553 -11.135
   55    H62    A   5           H62      ADE   5 -17.837 -20.415 -11.623
   56    H2     A   5           H2       ADE   5 -21.403 -18.898 -15.021
   57    H5'    G   6           H5'      GUA   6 -16.750 -18.983 -20.208
   58   H5''    G   6          H5''      GUA   6 -15.571 -17.705 -20.574
   59    H4'    G   6           H4'      GUA   6 -17.650 -16.735 -19.748
   60    H3'    G   6           H3'      GUA   6 -15.298 -16.480 -17.824
   61    H2'    G   6           H2'      GUA   6 -16.702 -15.260 -16.380
   62   HO2'    G   6          H2''      GUA   6 -17.879 -14.538 -18.730
   63    H1'    G   6           H1'      GUA   6 -19.038 -16.703 -16.866
   64    H8     G   6           H8       GUA   6 -16.023 -18.964 -16.379
   65    H1     G   6           H1       GUA   6 -18.289 -16.760 -10.811
   66    H21    G   6           H21      GUA   6 -19.619 -14.980 -11.200
   67    H22    G   6           H22      GUA   6 -20.472 -14.865 -12.722
   68    H5'    U   7           H5'      URI   7 -17.022 -13.006 -17.857
   69   H5''    U   7          H5''      URI   7 -16.029 -11.667 -18.477
   70    H4'    U   7           H4'      URI   7 -17.115 -10.978 -16.409
   71    H3'    U   7           H3'      URI   7 -14.296 -10.802 -16.770
   72    H2'    U   7           H2'      URI   7 -13.800 -12.594 -15.284
   73   HO2'    U   7          H2''      URI   7 -14.153 -10.907 -13.130
   74    H1'    U   7           H1'      URI   7 -16.091 -11.590 -13.565
   75    H3     U   7           H3       URI   7 -16.085 -14.775 -10.468
   76    H5     U   7           H5       URI   7 -14.202 -16.692 -13.723
   77    H6     U   7           H6       URI   7 -14.499 -14.648 -15.009
   78    H5'    A   8           H5'      ADE   8 -11.665  -8.088 -13.678
   79   H5''    A   8          H5''      ADE   8 -11.710  -9.779 -14.214
   80    H4'    A   8           H4'      ADE   8 -12.124  -8.814 -11.352
   81    H3'    A   8           H3'      ADE   8  -9.680  -9.299 -12.719
   82    H2'    A   8           H2'      ADE   8  -9.800 -11.657 -12.614
   83   HO2'    A   8          H2''      ADE   8  -8.180 -11.814 -11.282
   84    H1'    A   8           H1'      ADE   8 -11.360 -11.302 -10.040
   85    H8     A   8           H8       ADE   8 -12.889 -13.166 -12.957
   86    H61    A   8           H62      ADE   8 -11.618 -18.294 -10.122
   87    H62    A   8           H61      ADE   8 -13.182 -17.552 -10.377
   88    H2     A   8           H2       ADE   8  -9.912 -14.831  -7.522
   89    H5'    C   9           H5'      CYT   9  -8.203 -10.600  -9.109
   90   H5''    C   9          H5''      CYT   9  -6.959  -9.508  -8.465
   91    H4'    C   9           H4'      CYT   9  -6.013 -11.732  -8.539
   92    H3'    C   9           H3'      CYT   9  -4.780  -9.605  -9.921
   93    H2'    C   9           H2'      CYT   9  -5.138 -10.268 -12.097
   94   HO2'    C   9          H2''      CYT   9  -3.313 -12.356 -11.490
   95    H1'    C   9           H1'      CYT   9  -5.244 -13.201 -11.568
   96    H41    C   9           H42      CYT   9  -8.365 -12.324 -17.048
   97    H42    C   9           H41      CYT   9  -9.778 -11.835 -16.141
   98    H5     C   9           H5       CYT   9  -8.469 -10.018 -14.515
   99    H6     C   9           H6       CYT   9  -7.131 -10.162 -12.469
  100    H5'    G  10           H5'      GUA  10  -2.839 -10.344 -11.720
  101   H5''    G  10          H5''      GUA  10  -1.295  -9.473 -11.659
  102    H4'    G  10           H4'      GUA  10  -2.964  -8.551 -13.315
  103    H3'    G  10           H3'      GUA  10  -1.949  -6.744 -11.071
  104    H2'    G  10           H2'      GUA  10  -3.065  -4.978 -12.235
  105   HO2'    G  10          H2''      GUA  10  -2.679  -6.552 -14.374
  106    H1'    G  10           H1'      GUA  10  -5.392  -6.341 -12.526
  107    H8     G  10           H8       GUA  10  -3.659  -7.466  -9.348
  108    H1     G  10           H1       GUA  10  -6.489  -1.780  -8.656
  109    H21    G  10           H21      GUA  10  -7.928  -1.732 -10.936
  110    H22    G  10           H22      GUA  10  -6.428  -1.296 -11.722
  111    H5'    G  11           H5'      GUA  11  -1.576  -4.691 -14.414
  112   H5''    G  11          H5''      GUA  11   0.100  -4.180 -14.685
  113    H4'    G  11           H4'      GUA  11  -1.426  -2.320 -15.097
  114    H3'    G  11           H3'      GUA  11   0.101  -1.999 -12.483
  115    H2'    G  11           H2'      GUA  11  -0.803   0.210 -12.396
  116   HO2'    G  11          H2''      GUA  11  -1.648   1.232 -14.133
  117    H1'    G  11           H1'      GUA  11  -3.338  -0.567 -13.175
  118    H8     G  11           H8       GUA  11  -1.813  -3.173 -10.912
  119    H1     G  11           H1       GUA  11  -3.734   1.999  -7.675
  120    H21    G  11           H21      GUA  11  -3.511   3.817  -9.720
  121    H22    G  11           H22      GUA  11  -5.068   3.198 -10.215
  122    H5'    C  12           H5'      CYT  12   0.537   1.400 -14.562
  123   H5''    C  12          H5''      CYT  12   2.194   2.032 -14.660
  124    H4'    C  12           H4'      CYT  12   0.698   3.779 -13.898
  125    H3'    C  12           H3'      CYT  12   2.565   2.883 -11.668
  126    H2'    C  12           H2'      CYT  12   1.538   4.511 -10.315
  127   HO2'    C  12          H2''      CYT  12   0.693   6.311 -11.107
  128    H1'    C  12           H1'      CYT  12  -1.062   4.129 -11.173
  129    H41    C  12           H41      CYT  12  -0.158   0.652  -5.858
  130    H42    C  12           H42      CYT  12   0.394  -0.681  -6.849
  131    H5     C  12           H5       CYT  12   0.880  -0.459  -9.193
  132    H6     C  12           H6       CYT  12   0.734   1.008 -11.139
  133    H5'    C  13           H5'      CYT  13   2.245   6.858 -11.969
  134   H5''    C  13          H5''      CYT  13   3.761   7.721 -12.299
  135    H4'    C  13           H4'      CYT  13   2.490   8.897 -10.583
  136    H3'    C  13           H3'      CYT  13   5.076   8.257 -10.343
  137    H2'    C  13           H2'      CYT  13   4.886   6.456  -8.825
  138   HO2'    C  13          H2''      CYT  13   4.492   8.556  -6.949
  139    H1'    C  13           H1'      CYT  13   2.583   7.813  -7.430
  140    H41    C  13           H41      CYT  13   1.918   1.980  -5.025
  141    H42    C  13           H42      CYT  13   1.689   1.322  -6.630
  142    H5     C  13           H5       CYT  13   3.213   2.485  -8.304
  143    H6     C  13           H6       CYT  13   3.658   4.713  -9.228
  144    H5'    G  14           H5'      GUA  14   7.877  10.252  -7.132
  145   H5''    G  14          H5''      GUA  14   7.244   8.681  -7.663
  146    H4'    G  14           H4'      GUA  14   6.987   9.863  -4.878
  147    H3'    G  14           H3'      GUA  14   8.786   7.553  -5.826
  148    H2'    G  14           H2'      GUA  14   8.533   6.763  -3.541
  149   HO2'    G  14          H2''      GUA  14   7.990   8.104  -1.977
  150    H1'    G  14           H1'      GUA  14   5.860   6.871  -3.623
  151    H8     G  14           H8       GUA  14   7.320   6.536  -7.166
  152    H1     G  14           H1       GUA  14   7.152   0.984  -3.996
  153    H21    G  14           H21      GUA  14   6.680   1.370  -1.839
  154    H22    G  14           H22      GUA  14   5.842   2.826  -1.363
  155    H5'    C  15           H5'      CYT  15  13.392   7.491  -5.634
  156   H5''    C  15          H5''      CYT  15  12.223   6.961  -6.859
  157    H4'    C  15           H4'      CYT  15  13.308   4.990  -6.048
  158    H3'    C  15           H3'      CYT  15  10.624   5.235  -5.920
  159    H2'    C  15           H2'      CYT  15  10.313   5.858  -3.682
  160   HO2'    C  15          H2''      CYT  15   9.381   3.767  -3.728
  161    H1'    C  15           H1'      CYT  15  12.552   4.205  -2.592
  162    H41    C  15           H42      CYT  15  11.875   8.855   1.715
  163    H42    C  15           H41      CYT  15  12.777   9.923   0.662
  164    H5     C  15           H5       CYT  15  11.554   9.460  -1.681
  165    H6     C  15           H6       CYT  15  11.493   7.697  -3.373
  166    H5'    A  16           H5'      ADE  16  13.079   2.008  -1.842
  167   H5''    A  16          H5''      ADE  16  12.312   0.516  -2.419
  168    H4'    A  16           H4'      ADE  16  11.623   0.922  -0.144
  169    H3'    A  16           H3'      ADE  16   9.820   0.679  -2.225
  170    H2'    A  16           H2'      ADE  16   8.820   2.791  -2.040
  171   HO2'    A  16          H2''      ADE  16   7.792   1.596   0.340
  172    H1'    A  16           H1'      ADE  16   9.519   2.831   0.899
  173    H8     A  16           H8       ADE  16   8.989   4.890  -2.316
  174    H61    A  16           H61      ADE  16   8.486   9.679   1.563
  175    H62    A  16           H62      ADE  16   8.204   9.136  -0.076
  176    H2     A  16           H2       ADE  16   9.547   6.040   3.962
  177    H5'    A  17           H5'      ADE  17   8.958   0.356   2.147
  178   H5''    A  17          H5''      ADE  17   7.578  -0.549   2.803
  179    H4'    A  17           H4'      ADE  17   7.973   1.523   4.067
  180    H3'    A  17           H3'      ADE  17   5.397   1.506   2.394
  181    H2'    A  17           H2'      ADE  17   4.857   3.576   3.453
  182   HO2'    A  17          H2''      ADE  17   5.666   4.178   5.356
  183    H1'    A  17           H1'      ADE  17   7.408   4.615   3.297
  184    H8     A  17           H8       ADE  17   6.501   2.656   0.165
  185    H61    A  17           H61      ADE  17   3.365   7.506  -1.784
  186    H62    A  17           H62      ADE  17   4.488   6.309  -2.394
  187    H2     A  17           H2       ADE  17   4.974   8.518   2.336
  188    H5'    G  18           H5'      GUA  18   3.900   2.873   5.248
  189   H5''    G  18          H5''      GUA  18   2.246   2.347   5.615
  190    H4'    G  18           H4'      GUA  18   2.270   4.680   4.894
  191    H3'    G  18           H3'      GUA  18   0.992   2.780   2.913
  192    H2'    G  18           H2'      GUA  18   0.398   4.730   1.624
  193   HO2'    G  18          H2''      GUA  18   1.451   6.294   3.774
  194    H1'    G  18           H1'      GUA  18   2.869   5.829   1.720
  195    H8     G  18           H8       GUA  18   3.288   2.083   1.923
  196    H1     G  18           H1       GUA  18   1.788   3.999  -3.984
  197    H21    G  18           H21      GUA  18   1.733   6.402  -3.909
  198    H22    G  18           H22      GUA  18   0.680   6.843  -2.584
  199    H5'    G  19           H5'      GUA  19  -1.166   5.900   3.226
  200   H5''    G  19          H5''      GUA  19  -2.926   5.742   3.382
  201    H4'    G  19           H4'      GUA  19  -2.337   7.242   1.542
  202    H3'    G  19           H3'      GUA  19  -3.495   4.589   0.570
  203    H2'    G  19           H2'      GUA  19  -3.495   5.602  -1.601
  204   HO2'    G  19          H2''      GUA  19  -2.983   8.000  -0.150
  205    H1'    G  19           H1'      GUA  19  -0.953   6.572  -1.389
  206    H8     G  19           H8       GUA  19  -1.338   3.307   0.527
  207    H1     G  19           H1       GUA  19  -0.543   2.460  -5.775
  208    H21    G  19           H21      GUA  19  -1.234   4.617  -6.756
  209    H22    G  19           H22      GUA  19  -0.184   5.794  -5.997
  210    H5'    U  20           H5'      URI  20  -5.574   7.428  -1.268
  211   H5''    U  20          H5''      URI  20  -7.331   7.175  -1.262
  212    H4'    U  20           H4'      URI  20  -6.573   7.501  -3.535
  213    H3'    U  20           H3'      URI  20  -7.315   4.644  -2.918
  214    H2'    U  20           H2'      URI  20  -7.023   4.191  -5.230
  215   HO2'    U  20          H2''      URI  20  -6.778   5.854  -6.751
  216    H1'    U  20           H1'      URI  20  -4.690   5.637  -5.499
  217    H3     U  20           H3       URI  20  -3.580   1.178  -5.608
  218    H5     U  20           H5       URI  20  -4.350   2.004  -1.539
  219    H6     U  20           H6       URI  20  -5.036   4.235  -2.194
  220    H5'    U  21           H5'      URI  21  -8.986   5.567  -6.218
  221   H5''    U  21          H5''      URI  21 -10.763   5.616  -6.199
  222    H4'    U  21           H4'      URI  21  -9.968   4.415  -8.177
  223    H3'    U  21           H3'      URI  21 -11.845   3.408  -6.396
  224    H2'    U  21           H2'      URI  21 -10.518   1.704  -5.443
  225   HO2'    U  21          H2''      URI  21 -12.166   0.793  -7.132
  226    H1'    U  21           H1'      URI  21  -9.113   1.308  -8.092
  227    H3     U  21           H3       URI  21  -5.900  -1.355  -6.554
  228    H5     U  21           H5       URI  21  -6.813   0.993  -3.169
  229    H6     U  21           H6       URI  21  -8.492   2.136  -4.503
  230    H5'    A  22           H5'      ADE  22 -15.036   0.025  -8.557
  231   H5''    A  22          H5''      ADE  22 -15.062   0.735  -6.930
  232    H4'    A  22           H4'      ADE  22 -15.171  -1.691  -6.732
  233    H3'    A  22           H3'      ADE  22 -13.268  -0.195  -5.449
  234    H2'    A  22           H2'      ADE  22 -11.380  -0.855  -6.711
  235   HO2'    A  22          H2''      ADE  22 -11.840  -3.014  -4.900
  236    H1'    A  22           H1'      ADE  22 -12.603  -3.601  -7.053
  237    H8     A  22           H8       ADE  22 -10.797  -0.737  -9.025
  238    H61    A  22           H62      ADE  22  -8.303  -5.414 -12.222
  239    H62    A  22           H61      ADE  22  -8.407  -3.674 -12.074
  240    H2     A  22           H2       ADE  22 -11.219  -7.137  -9.269
  241    H5'    A  23           H5'      ADE  23 -13.824  -3.824  -1.380
  242   H5''    A  23          H5''      ADE  23 -12.120  -4.300  -1.250
  243    H4'    A  23           H4'      ADE  23 -13.482  -6.301  -1.190
  244    H3'    A  23           H3'      ADE  23 -11.415  -6.124  -2.998
  245    H2'    A  23           H2'      ADE  23 -12.761  -5.608  -4.899
  246   HO2'    A  23          H2''      ADE  23 -13.332  -7.829  -5.811
  247    H1'    A  23           H1'      ADE  23 -14.840  -7.573  -3.915
  248    H8     A  23           H8       ADE  23 -14.534  -3.903  -5.218
  249    H61    A  23           H62      ADE  23 -19.404  -5.188  -8.613
  250    H62    A  23           H61      ADE  23 -17.858  -4.395  -8.835
  251    H2     A  23           H2       ADE  23 -18.168  -9.047  -6.492
  252    H5'    A  24           H5'      ADE  24 -12.006  -9.386  -0.308
  253   H5''    A  24          H5''      ADE  24 -10.963 -10.816  -0.195
  254    H4'    A  24           H4'      ADE  24 -13.162 -11.394   0.628
  255    H3'    A  24           H3'      ADE  24 -12.041 -12.943  -1.402
  256    H2'    A  24           H2'      ADE  24 -13.446 -12.001  -3.130
  257   HO2'    A  24          H2''      ADE  24 -13.796 -14.348  -2.848
  258    H1'    A  24           H1'      ADE  24 -15.617 -12.120  -1.007
  259    H8     A  24           H8       ADE  24 -14.635 -10.526  -4.395
  260    H61    A  24           H62      ADE  24 -19.930  -8.069  -4.517
  261    H62    A  24           H61      ADE  24 -19.698  -9.520  -5.466
  262    H2     A  24           H2       ADE  24 -19.787 -10.752  -0.589
  263    H5'    A  25           H5'      ADE  25 -16.146 -13.965   0.078
  264   H5''    A  25          H5''      ADE  25 -16.865 -15.583  -0.057
  265    H4'    A  25           H4'      ADE  25 -18.202 -13.673  -1.075
  266    H3'    A  25           H3'      ADE  25 -17.516 -16.086  -2.771
  267    H2'    A  25           H2'      ADE  25 -18.734 -15.064  -4.523
  268   HO2'    A  25          H2''      ADE  25 -19.756 -12.868  -3.806
  269    H1'    A  25           H1'      ADE  25 -17.797 -12.524  -4.182
  270    H8     A  25           H8       ADE  25 -15.301 -15.447  -3.636
  271    H61    A  25           H61      ADE  25 -14.761 -15.795  -9.541
  272    H62    A  25           H62      ADE  25 -13.495 -15.384  -8.405
  273    H2     A  25           H2       ADE  25 -17.638 -12.293  -8.711
  274    H5'    C  26           H5'      CYT  26 -21.256 -14.546  -2.684
  275   H5''    C  26          H5''      CYT  26 -22.662 -15.562  -3.046
  276    H4'    C  26           H4'      CYT  26 -22.371 -13.434  -4.432
  277    H3'    C  26           H3'      CYT  26 -22.717 -16.132  -5.857
  278    H2'    C  26           H2'      CYT  26 -22.893 -14.829  -7.853
  279   HO2'    C  26          H2''      CYT  26 -23.439 -12.760  -7.852
  280    H1'    C  26           H1'      CYT  26 -20.730 -13.264  -7.313
  281    H41    C  26           H41      CYT  26 -17.961 -18.572  -9.712
  282    H42    C  26           H42      CYT  26 -19.495 -19.383  -9.485
  283    H5     C  26           H5       CYT  26 -19.437 -18.456  -6.766
  284    H6     C  26           H6       CYT  26 -20.351 -16.469  -5.685
  285    H5'    U  27           H5'      URI  27 -25.346 -13.825  -7.521
  286   H5''    U  27          H5''      URI  27 -26.945 -14.556  -7.757
  287    H4'    U  27           H4'      URI  27 -26.094 -13.777  -9.880
  288    H3'    U  27           H3'      URI  27 -26.053 -16.800  -9.641
  289    H2'    U  27           H2'      URI  27 -25.423 -16.836 -11.942
  290   HO2'    U  27          H2''      URI  27 -25.378 -14.154 -12.452
  291    H1'    U  27           H1'      URI  27 -23.582 -14.805 -11.738
  292    H3     U  27           H3       URI  27 -21.317 -18.769 -12.177
  293    H5     U  27           H5       URI  27 -22.411 -18.571  -8.103
  294    H6     U  27           H6       URI  27 -23.689 -16.575  -8.617
  295    H5'    C  28           H5'      CYT  28 -27.854 -15.796 -13.105
  296   H5''    C  28          H5''      CYT  28 -29.336 -16.694 -13.485
  297    H4'    C  28           H4'      CYT  28 -27.763 -16.800 -15.350
  298    H3'    C  28           H3'      CYT  28 -27.991 -19.472 -13.885
  299    H2'    C  28           H2'      CYT  28 -26.683 -20.377 -15.657
  300   HO2'    C  28          H2''      CYT  28 -27.758 -18.248 -17.039
  301    H1'    C  28           H1'      CYT  28 -24.955 -18.201 -15.806
  302    H41    C  28           H41      CYT  28 -22.000 -21.927 -11.464
  303    H42    C  28           H42      CYT  28 -23.457 -22.896 -11.402
  304    H5     C  28           H5       CYT  28 -24.922 -20.479 -10.931
  305    H6     C  28           H6       CYT  28 -26.061 -18.926 -12.430
  306    H5'    C  29           H5'      CYT  29 -28.559 -20.360 -17.670
  307   H5''    C  29          H5''      CYT  29 -29.916 -21.457 -17.996
  308    H4'    C  29           H4'      CYT  29 -27.870 -22.374 -18.922
  309    H3'    C  29           H3'      CYT  29 -28.784 -23.855 -16.406
  310    H2'    C  29           H2'      CYT  29 -27.048 -25.428 -16.849
  311   HO2'    C  29          H2''      CYT  29 -25.865 -24.757 -19.043
  312    H1'    C  29           H1'      CYT  29 -25.179 -23.525 -17.634
  313    H41    C  29           H41      CYT  29 -23.956 -24.513 -11.447
  314    H42    C  29           H42      CYT  29 -25.584 -24.030 -11.021
  315    H5     C  29           H5       CYT  29 -26.809 -22.605 -12.605
  316    H6     C  29           H6       CYT  29 -27.295 -22.301 -14.978
  317    H5'    C  30           H5'      CYT  30 -28.347 -26.894 -19.129
  318   H5''    C  30          H5''      CYT  30 -29.778 -27.943 -19.155
  319    H4'    C  30           H4'      CYT  30 -27.807 -29.307 -18.849
  320    H3'    C  30           H3'      CYT  30 -29.379 -28.964 -16.253
  321    H2'    C  30           H2'      CYT  30 -27.917 -30.552 -15.266
  322   HO2'    C  30          H2''      CYT  30 -27.078 -32.140 -16.387
  323    H1'    C  30           H1'      CYT  30 -25.627 -29.622 -16.565
  324    H41    C  30           H41      CYT  30 -25.657 -26.995 -10.722
  325    H42    C  30           H42      CYT  30 -26.865 -25.845 -11.251
  326    H5     C  30           H5       CYT  30 -27.754 -25.798 -13.477
  327    H6     C  30           H6       CYT  30 -27.844 -26.956 -15.622
  328    H5'    C  31           H5'      CYT  31 -29.347 -33.021 -16.387
  329   H5''    C  31          H5''      CYT  31 -30.998 -33.639 -16.199
  330    H4'    C  31           H4'      CYT  31 -29.581 -34.684 -14.550
  331    H3'    C  31           H3'      CYT  31 -31.310 -32.516 -13.388
  332   HO3'    C  31          H3T       CYT  31 -32.294 -34.602 -12.595
  333    H2'    C  31           H2'      CYT  31 -30.508 -33.008 -11.247
  334   HO2'    C  31          H2''      CYT  31 -29.128 -35.333 -11.794
  335    H1'    C  31           H1'      CYT  31 -27.926 -33.826 -12.125
  336    H41    C  31           H41      CYT  31 -27.310 -28.182  -9.148
  337    H42    C  31           H42      CYT  31 -27.871 -27.369 -10.592
  338    H5     C  31           H5       CYT  31 -28.683 -28.531 -12.530
  339    H6     C  31           H6       CYT  31 -29.105 -30.720 -13.528
  Start of MODEL   13
    1    H5'    G   1           H5'      GUA   1 -34.725 -19.538  -6.272
    2   H5''    G   1          H5''      GUA   1 -33.493 -18.769  -5.252
    3    H4'    G   1           H4'      GUA   1 -33.645 -21.108  -4.666
    4    H3'    G   1           H3'      GUA   1 -31.157 -20.440  -6.233
    5    H2'    G   1           H2'      GUA   1 -30.442 -22.679  -5.853
    6   HO2'    G   1          H2''      GUA   1 -32.279 -22.531  -3.751
    7    H1'    G   1           H1'      GUA   1 -32.914 -23.824  -6.314
    8    H8     G   1           H8       GUA   1 -32.309 -21.010  -8.776
    9    H1     G   1           H1       GUA   1 -28.881 -26.235 -10.120
   10    H21    G   1           H21      GUA   1 -29.249 -27.795  -8.531
   11    H22    G   1           H22      GUA   1 -29.771 -27.277  -6.945
   12   HO5'    G   1          H5T       GUA   1 -32.584 -18.174  -7.018
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   16    H3'    G   2           H3'      GUA   2 -26.633 -22.771  -4.160
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  272    H62    A  25           H62      ADE  25 -17.391 -15.061  -9.714
  273    H2     A  25           H2       ADE  25 -15.389 -12.004 -13.396
  274    H5'    C  26           H5'      CYT  26 -21.462  -9.298 -14.663
  275   H5''    C  26          H5''      CYT  26 -22.631 -10.165 -15.674
  276    H4'    C  26           H4'      CYT  26 -20.357 -10.391 -16.541
  277    H3'    C  26           H3'      CYT  26 -21.395 -13.027 -15.368
  278    H2'    C  26           H2'      CYT  26 -19.500 -13.982 -16.478
  279   HO2'    C  26          H2''      CYT  26 -18.932 -11.461 -17.668
  280    H1'    C  26           H1'      CYT  26 -17.792 -11.941 -15.696
  281    H41    C  26           H41      CYT  26 -17.422 -16.175 -10.846
  282    H42    C  26           H42      CYT  26 -18.901 -16.890 -11.451
  283    H5     C  26           H5       CYT  26 -20.084 -14.292 -11.443
  284    H6     C  26           H6       CYT  26 -20.271 -12.562 -13.158
  285    H5'    U  27           H5'      URI  27 -20.302 -13.705 -19.034
  286   H5''    U  27          H5''      URI  27 -21.291 -14.843 -19.969
  287    H4'    U  27           H4'      URI  27 -18.965 -15.560 -19.930
  288    H3'    U  27           H3'      URI  27 -20.716 -17.388 -18.218
  289    H2'    U  27           H2'      URI  27 -18.773 -18.768 -18.046
  290   HO2'    U  27          H2''      URI  27 -17.031 -17.299 -19.550
  291    H1'    U  27           H1'      URI  27 -17.029 -16.675 -17.628
  292    H3     U  27           H3       URI  27 -17.457 -18.875 -13.639
  293    H5     U  27           H5       URI  27 -21.017 -16.635 -14.019
  294    H6     U  27           H6       URI  27 -20.295 -15.991 -16.241
  295    H5'    C  28           H5'      CYT  28 -18.603 -19.694 -20.781
  296   H5''    C  28          H5''      CYT  28 -19.591 -20.891 -21.638
  297    H4'    C  28           H4'      CYT  28 -17.617 -21.951 -20.692
  298    H3'    C  28           H3'      CYT  28 -20.162 -22.663 -19.142
  299    H2'    C  28           H2'      CYT  28 -18.821 -24.277 -17.990
  300   HO2'    C  28          H2''      CYT  28 -16.718 -24.790 -18.679
  301    H1'    C  28           H1'      CYT  28 -16.666 -22.568 -17.691
  302    H41    C  28           H41      CYT  28 -20.227 -21.116 -12.510
  303    H42    C  28           H42      CYT  28 -21.521 -22.047 -13.232
  304    H5     C  28           H5       CYT  28 -21.020 -20.296 -15.544
  305    H6     C  28           H6       CYT  28 -19.707 -20.665 -17.570
  306    H5'    C  29           H5'      CYT  29 -18.590 -26.077 -19.897
  307   H5''    C  29          H5''      CYT  29 -19.728 -27.316 -20.455
  308    H4'    C  29           H4'      CYT  29 -18.523 -28.145 -18.537
  309    H3'    C  29           H3'      CYT  29 -21.396 -27.412 -17.890
  310    H2'    C  29           H2'      CYT  29 -21.006 -28.437 -15.758
  311   HO2'    C  29          H2''      CYT  29 -18.460 -29.252 -15.941
  312    H1'    C  29           H1'      CYT  29 -18.498 -27.332 -15.411
  313    H41    C  29           H41      CYT  29 -22.639 -23.399 -12.539
  314    H42    C  29           H42      CYT  29 -23.410 -23.057 -14.070
  315    H5     C  29           H5       CYT  29 -22.155 -23.463 -16.135
  316    H6     C  29           H6       CYT  29 -20.608 -25.020 -17.210
  317    H5'    C  30           H5'      CYT  30 -20.808 -31.213 -16.589
  318   H5''    C  30          H5''      CYT  30 -22.086 -32.327 -17.111
  319    H4'    C  30           H4'      CYT  30 -21.771 -32.556 -14.732
  320    H3'    C  30           H3'      CYT  30 -24.323 -31.032 -15.407
  321    H2'    C  30           H2'      CYT  30 -24.834 -31.113 -13.087
  322   HO2'    C  30          H2''      CYT  30 -23.210 -32.412 -11.745
  323    H1'    C  30           H1'      CYT  30 -22.238 -30.620 -12.222
  324    H41    C  30           H41      CYT  30 -25.177 -24.946 -12.229
  325    H42    C  30           H42      CYT  30 -25.337 -25.013 -13.969
  326    H5     C  30           H5       CYT  30 -24.085 -26.606 -15.278
  327    H6     C  30           H6       CYT  30 -23.058 -28.821 -15.251
  328    H5'    C  31           H5'      CYT  31 -25.609 -34.047 -12.962
  329   H5''    C  31          H5''      CYT  31 -26.980 -34.918 -13.676
  330    H4'    C  31           H4'      CYT  31 -27.551 -34.243 -11.425
  331    H3'    C  31           H3'      CYT  31 -28.893 -32.544 -13.525
  332   HO3'    C  31          H3T       CYT  31 -30.629 -33.992 -12.337
  333    H2'    C  31           H2'      CYT  31 -30.056 -31.397 -11.836
  334   HO2'    C  31          H2''      CYT  31 -29.757 -32.419  -9.558
  335    H1'    C  31           H1'      CYT  31 -27.977 -31.524  -9.935
  336    H41    C  31           H41      CYT  31 -28.096 -25.558 -12.263
  337    H42    C  31           H42      CYT  31 -27.280 -26.115 -13.706
  338    H5     C  31           H5       CYT  31 -26.673 -28.396 -14.082
  339    H6     C  31           H6       CYT  31 -26.842 -30.681 -13.242