*HEADER    DNA                                     18-AUG-13   2MCC              
*TITLE     STRUCTURAL STUDIES ON DINUCLEAR RUTHENIUM(II) COMPLEXES THAT BIND     
*TITLE    2 DIASTEREOSELECTIVELY TO AN ANTI-PARALLEL FOLDED HUMAN TELOMERE       
*TITLE    3 SEQUENCE                                                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HUMAN_TELOMERE_QUADRUPLEX;                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: STANDARD CHEMISTRY, HPLC PURIFIED                     
*KEYWDS    DNA, QUADRUPLEX, COMPLEX, RUTHENIUM                                   
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    5                                                                     
*AUTHOR    M.P.WILLIAMSON, T.WILSON, J.A.THOMAS, V.FELIX, P.J.COSTA              
*REVDAT   1   02-OCT-13 2MCC    0                                                


!
! NOE restraints between quadruplex and ligand
!


! coding for the dna

!vector identity (store1) (resid 231 and name CH3)
!vector identity (store2) (resid 230 and name H5')
!vector identity (store3) (resid 230 and name H5'')
!vector identity (store4) (resid 234 and name H2')
!vector identity (store5) (resid 234 and name H2'')
!vector identity (store6) (resid 231 and name H1')
!vector identity (store7) (resid 230 and name H1')
!vector identity (store8) (resid 234 and name H1')
!vector identity (store9) (resid 230 and name H1')
!vector identity (store10) (resid 22 and name H2')
!vector identity (store11) (resid 2 and name H3')
!vector identity (store12) (resid 22 and name H2')
!vector identity (store13) (resid 232 and name H1')
!vector identity (store14) (resid 232 and name H2')
!vector identity (store15) (resid 2 and name H1')

! coding for the TAPPHZ

!vector identity (store16) (resid 23 and name C65)
!vector identity (store17) (resid 23 and name C66)
!vector identity (store18) (resid 23 and name C67)
!vector identity (store19) (resid 23 and name C68)
!vector identity (store20) (resid 23 and name C69)
!vector identity (store21) (resid 23 and name C71)
!vector identity (store22) (resid 23 and name C72)
!vector identity (store23) (resid 23 and name C73)
!vector identity (store24) (resid 23 and name C74)
!vector identity (store25) (resid 23 and name C75)
!vector identity (store26) (resid 23 and name C70)
!vector identity (store27) (resid 23 and name C76)
!vector identity (store28) (resid 23 and name C97)
!vector identity (store29) (resid 23 and name C98)
!vector identity (store30) (resid 23 and name C99)
!vector identity (store31) (resid 23 and name C100)
!vector identity (store32) (resid 23 and name C101)
!vector identity (store33) (resid 23 and name C102)
!vector identity (store34) (resid 23 and name C103)
!vector identity (store35) (resid 23 and name C104)
!vector identity (store36) (resid 23 and name C105)
!vector identity (store37) (resid 23 and name C106)
!vector identity (store38) (resid 23 and name C107)
!vector identity (store39) (resid 23 and name C108)

! coding for the RU3 BIPY

!vector identity (store40) (resid 23 and name C77)
!vector identity (store41) (resid 23 and name C78)
!vector identity (store42) (resid 23 and name C79)
!vector identity (store43) (resid 23 and name C80)
!vector identity (store44) (resid 23 and name C81)
!vector identity (store45) (resid 23 and name C82)
!vector identity (store46) (resid 23 and name C83)
!vector identity (store47) (resid 23 and name C84)
!vector identity (store48) (resid 23 and name C85)
!vector identity (store49) (resid 23 and name C86)
!vector identity (store50) (resid 23 and name C87)
!vector identity (store51) (resid 23 and name C88)
!vector identity (store52) (resid 23 and name C89)
!vector identity (store53) (resid 23 and name C90)
!vector identity (store54) (resid 23 and name C91)
!vector identity (store55) (resid 23 and name C92)
!vector identity (store56) (resid 23 and name C93)
!vector identity (store57) (resid 23 and name C94)
!vector identity (store58) (resid 23 and name C95)
!vector identity (store59) (resid 23 and name C96)


! coding for the RU4 BIPY

!vector identity (store60) (resid 23 and name C109)
!vector identity (store61) (resid 23 and name C110)
!vector identity (store62) (resid 23 and name C111)
!vector identity (store63) (resid 23 and name C112)
!vector identity (store64) (resid 23 and name C113)
!vector identity (store65) (resid 23 and name C114)
!vector identity (store66) (resid 23 and name C115)
!vector identity (store67) (resid 23 and name C116)
!vector identity (store68) (resid 23 and name C117)
!vector identity (store69) (resid 23 and name C118)
!vector identity (store70) (resid 23 and name C119)
!vector identity (store71) (resid 23 and name C120)
!vector identity (store72) (resid 23 and name C121)
!vector identity (store73) (resid 23 and name C122)
!vector identity (store74) (resid 23 and name C123)
!vector identity (store75) (resid 23 and name C124)
!vector identity (store76) (resid 23 and name C125)
!vector identity (store77) (resid 23 and name C126)
!vector identity (store78) (resid 23 and name C127)
!vector identity (store79) (resid 23 and name C128)

! Test to try and get it throught the loop!

   !ASSI (resid 10 and name N2) (resid 23 and name C75) 1.0 0.0 0.0
   !ASSI (resid 23 and name N16) (resid 12 and name P) 1.0 0.0 0.0
   !ASSI (resid 23 and name C102) (resid 2 and name O6) 2.0 0.0 0.0
   !ASSI (resid 23 and name C108) (resid 14 and name H1) 2.0 0.0 0.0
!following four pseudo-NOEs are very tight - col 1 relaxed by Mike from 1 to 3 A
! so that the distance ranges are now 1-4 A not 1-2 A
ASSI (resid 23 and name N23) (resid 2 and name N7) 3.0 2.0 1.0!
ASSI (resid 23 and name N24) (resid 14 and name N3) 3.0 2.0 1.0
ASSI (resid 23 and name N15) (resid 10 and name N3) 3.0 2.0 1.0
ASSI (resid 23 and name N17) (resid 22 and name N7) 3.0 2.0 1.0
!by contrast, the following were restrained as 8/0/5 ie between 8 and 13 A.
! Seems odd not to allow them to get closer than 8 so changed to 8/6/5 (ie 2-13 A)
ASSI (resid 23 and name C72) (resid 9 and name C5) 8.0 6.0 5.0
ASSI (resid 23 and name C66) (resid 9 and name C5) 8.0 6.0 5.0
ASSI (resid 23 and name C104) (resid 15 and name C6) 8.0 6.0 5.0
ASSI (resid 23 and name C98) (resid 15 and name C6) 8.0 6.0 5.0
!whereas these last 2 look OK
ASSI (resid 23 and name N16) (resid 12 and name C5) 3.0 2.0 0.0
ASSI (resid 23 and name N18) (resid 12 and name C5) 3.0 2.0 0.0


!
! Now for the NOEs
!

! T11 CH3 with any ligand proton


ASSI ((resid 11 and name H51) or (resid 11 and name H52) or (resid 11 and name H53)) (resid 23 and name *) 3.0 1.0 1.0


! G10 H5' or with any ligand proton

ASSI (resid 10 and name H5') (resid 23 and name *) 3.0 1.0 1.0


! G10 H5'' with any ligand proton

ASSI (resid 10 and name H5'') (resid 23 and name *) 3.0 1.0 1.0


! G14 H2' with any ligand proton

ASSI (resid 14 and name H2') (resid 23 and name *) 3.0 1.0 1.0


! G14 H2'' with any ligand proton

ASSI (resid 14 and name H2'') (resid 23 and name *) 3.0 1.0 1.0


! T11 H1' with any ligand proton

ASSI (resid 11 and name H1') (resid 23 and name *) 3.0 1.0 1.0


! G10 H1' with any ligand proton

ASSI (resid 10 and name H1') (resid 23 and name *) 3.0 1.0 1.0


! G14 H1' with any ligand proton

ASSI (resid 14 and name H1') (resid 23 and name *) 3.0 1.0 1.0


! G10 H1' with any ligand proton

ASSI (resid 10 and name H1') (resid 23 and name *) 3.0 1.0 1.0


! G22 H2' with any ligand proton

ASSI (resid 22 and name H2') (resid 23 and name *) 3.0 1.0 1.0


! G2 H3' with any ligand proton

ASSI (resid 2 and name H3') (resid 23 and name *) 3.0 1.0 1.0


! G22 H2' with any ligand proton

ASSI (resid 22 and name H2') (resid 23 and name *) 3.0 1.0 1.0


! G12 H1' with any ligand proton

ASSI (resid 12 and name H1') (resid 23 and name *) 3.0 1.0 1.0


! G12 H2' with any ligand proton

ASSI (resid 12 and name H2') (resid 23 and name *) 3.0 1.0 1.0


! G2 H1' with any ligand proton

ASSI (resid 2 and name H1') (resid 23 and name *) 3.0 1.0 1.0



restraints dihedral reset
 assign (resid 23 and name  C69) (resid 23 and name  N15)
        (resid 23 and name  Ru3) (resid 23 and name N21)   1.0 -90.0 15.0 2 !start of ligand dihedrals
 assign (resid 23 and name  C65) (resid 23 and name  N15)
       (resid 23 and name  Ru3) (resid 23 and name N21)   1.0 90.0 15.0 2
 assign (resid 23 and name  N15) (resid 23 and name  Ru3)
        (resid 23 and name N21) (resid 23 and name C87)   1.0 80.0 15.0 2
 assign (resid 23 and name  N15) (resid 23 and name  Ru3)
        (resid 23 and name N21) (resid 23 and name C91)   1.0 -100.0 15.0 2
 assign (resid 23 and name  C71) (resid 23 and name N17)
        (resid 23 and name Ru3) (resid 23 and name N21)   1.0 -90.0 15.0 2
 assign (resid 23 and name  C75) (resid 23 and name N17)
        (resid 23 and name Ru3) (resid 23 and name N21)   1.0 90.0 15.0 2
 assign (resid 23 and name  N17) (resid 23 and name Ru3)
        (resid 23 and name N21) (resid 23 and name C87)   1.0 0.0 15.0 2
 assign (resid 23 and name  N17) (resid 23 and name Ru3)
        (resid 23 and name N21) (resid 23 and name C91)   1.0 180.0 15.0 2
 assign (resid 23 and name  C69) (resid 23 and name  N15)
        (resid 23 and name  Ru3) (resid 23 and name N20)   1.0 90.0 15.0 2
 assign (resid 23 and name  C65) (resid 23 and name  N15)
        (resid 23 and name  Ru3) (resid 23 and name N20)   1.0 -90.0 15.0 2
 assign (resid 23 and name  N15) (resid 23 and name  Ru3)
        (resid 23 and name N20) (resid 23 and name C82)   1.0 0.0 15.0 2
 assign (resid 23 and name  N15) (resid 23 and name  Ru3)
        (resid 23 and name N20) (resid 23 and name C86)   1.0 180.0 15.0 2
 assign (resid 23 and name  C71) (resid 23 and name N17)
        (resid 23 and name Ru3) (resid 23 and name N20)   1.0 80.0 15.0 2
 assign (resid 23 and name  C75) (resid 23 and name N17)
        (resid 23 and name Ru3) (resid 23 and name N20)   1.0 -100.0 15.0 2
 assign (resid 23 and name  N17) (resid 23 and name Ru3)
        (resid 23 and name N20) (resid 23 and name C82)   1.0 80.0 15.0 2
 assign (resid 23 and name  N17) (resid 23 and name Ru3)
        (resid 23 and name N20) (resid 23 and name C86)   1.0 -100.0 15.0 2 ! end of left side, ring dihedrals
 assign (resid 23 and name  N22) (resid 23 and name Ru3)
        (resid 23 and name N19) (resid 23 and name C77)   1.0 80.0 15.0 2! left side, dipy rings
 assign (resid 23 and name  N22) (resid 23 and name Ru3)
        (resid 23 and name N19) (resid 23 and name C81)   1.0 -100.0 15.0 2
 assign (resid 23 and name  C92) (resid 23 and name N22)
        (resid 23 and name Ru3) (resid 23 and name N19)   1.0 90.0 15.0 2
 assign (resid 23 and name  C96) (resid 23 and name N22)
        (resid 23 and name Ru3) (resid 23 and name N19)   1.0 -90.0 15.0 2
 assign (resid 23 and name  C103) (resid 23 and name N24)
        (resid 23 and name Ru4) (resid 23 and name N28)   1.0 90.0 15.0 2! now the same again for the right side
 assign (resid 23 and name  C107) (resid 23 and name N24)
        (resid 23 and name Ru4) (resid 23 and name N28)   1.0 -90.0 15.0 2
 assign (resid 23 and name  N24) (resid 23 and name Ru4)
        (resid 23 and name N28) (resid 23 and name C124)   1.0 80.0 15.0 2
 assign (resid 23 and name  N24) (resid 23 and name Ru4)
        (resid 23 and name N28) (resid 23 and name C128)   1.0 -100.0 15.0 2
 assign (resid 23 and name  C97) (resid 23 and name N23)
        (resid 23 and name Ru4) (resid 23 and name N28)   1.0 -90.0 15.0 2
 assign (resid 23 and name  C101) (resid 23 and name N23)
        (resid 23 and name Ru4) (resid 23 and name N28)   1.0 90.0 15.0 2
 assign (resid 23 and name  N23) (resid 23 and name Ru4)
        (resid 23 and name N28) (resid 23 and name C124)   1.0 0.0 15.0 2 
 assign (resid 23 and name  N23) (resid 23 and name Ru4)
        (resid 23 and name N28) (resid 23 and name C128)   1.0 180.0 15.0 2
 assign (resid 23 and name  C103) (resid 23 and name N24)
        (resid 23 and name Ru4) (resid 23 and name N26)   1.0 -80.0 15.0 2
 assign (resid 23 and name  C107) (resid 23 and name N24)
        (resid 23 and name Ru4) (resid 23 and name N26)   1.0 100.0 15.0 2
 assign (resid 23 and name  N24) (resid 23 and name Ru4)
        (resid 23 and name N26) (resid 23 and name C114)   1.0 0.0 15.0 2
 assign (resid 23 and name  N24) (resid 23 and name Ru4)
        (resid 23 and name N26) (resid 23 and name C118)   1.0 180.0 15.0 2
 assign (resid 23 and name  C97) (resid 23 and name N23)
        (resid 23 and name Ru4) (resid 23 and name N26)   1.0 90.0 15.0 2
 assign (resid 23 and name  C101) (resid 23 and name N23)
        (resid 23 and name Ru4) (resid 23 and name N26)   1.0 -90.0 15.0 2
 assign (resid 23 and name  N23) (resid 23 and name Ru4)
        (resid 23 and name N26) (resid 23 and name C114)   1.0 90.0 15.0 2
 assign (resid 23 and name  N23) (resid 23 and name Ru4)
        (resid 23 and name N26) (resid 23 and name C118)   1.0 -90.0 15.0 2! end of right side, ring dihedrals
 assign (resid 23 and name  N25) (resid 23 and name Ru4)
        (resid 23 and name N27) (resid 23 and name C119)   1.0 80.0 15.0 2! right side, dipy rings
 assign (resid 23 and name  N25) (resid 23 and name Ru4)
        (resid 23 and name N27) (resid 23 and name C123)   1.0 -100.0 15.0 2
 assign (resid 23 and name  C109) (resid 23 and name N25)
        (resid 23 and name Ru4) (resid 23 and name N27)   1.0 90.0 15.0 2
 assign (resid 23 and name  C113) (resid 23 and name N25)
        (resid 23 and name Ru4) (resid 23 and name N27)   1.0 -90.0 15.0 2
end
restraints plane

!
! Ligand plane restraints - to keep TAPPHZ and Ru atoms in the same plane
!
! new file explicitly only containing central atoms
!added C73 which got missed last time
 group
 selection=
 ((name N17 or name C71 or name C72 or name C74 or name C75 or name N15 or name C65 or name C66
 or name C67 or name C68 or name C69 or name C70 or name C76 or name N16 or name N18 or name C102
 or name N23 or name C97 or name C98 or name C99 or name C100 or name C101 or name N24 or name C103
 or name C104 or name C105 or name C106 or name C107 or name C108 or name RU3 or name RU4 or name C73
 or name N19 or name N22 or name N27 or name N25 or name H45 or name H46 or name H47 or name H48
 or name H49 or name H50 or name H67 or name H68 or name H69 or name H70 or name H71 or name H72)
 and resid 23)

 weight=20.0
 end

!
! now keep bipy ligands in same plane
! new set of restraints based on above

        group
        selection=
        ((name N21 or name C87 or name C88 or name C89 or name C90 or name H59 or name H60 or name H61
        or name H62 or name C91 or name N22 or name C92 or name C93 or name C94 or name C95 or name C96
        or name name H63 or name H64 or name H65 or name H66 or name RU3 or name N17 or name N20)
        and resid 23)

        weight=20.0
        end

        group
        selection=
        ((name N20 or name C82 or name C83 or name C84 or name C85 or name C86 or name H55 or name H56 or name H57
        or name H58 or name N19 or name C77 or name C78 or name C79 or name C80 or name C81
        or name name H51 or name H52 or name H53 or name H54 or name RU3 or name N15 or name N21)
        and resid 23)

        weight=20.0
        end

        group
        selection=
        ((name N28 or name C124 or name C125 or name C126 or name C127 or name C128 or name H85 or name H86 or name H87
        or name H88 or name N27 or name C119 or name C120 or name C121 or name C122 or name C123
        or name name H81 or name H82 or name H83 or name H84 or name RU4 or name N23 or name N26)
        and resid 23)

        weight=20.0
        end

        group
        selection=
        ((name N25 or name C109 or name C110 or name C111 or name C112 or name C113 or name H73 or name H74 or name H75
        or name H76 or name N26 or name C114 or name C115 or name C116 or name C117 or name C118
        or name name H77 or name H78 or name H79 or name H80 or name RU4 or name N24 or name N28)
        and resid 23)

        weight=20.0
        end


! group
!  selection=(
!   (not(hydro or name 1 or name 3 or name 4 or name 5 or name 6 or name 7 or name 8 or name 9
!                        or name 10 or name 11 or name 12 or name 13 or name 14 or name 15 or name 16 or name 17 or
!                        name 18 or name 19 or name 20 or name 21 or name 22 or name 23 or name 24 or name 25 or name
!                        26 or name 27 or name 28 or name 29 or name 30 or name 31 or name 32 or name 33 or name 34
!                        or name 35 or name 36 or name 37 or name 38 or name 39 or name 40 or name 41 or name 42 or
!                        name 43 or name 44 or name 45 or name 46 or name 47 or name 48 or name 49 or name 50 or name
!                        51 or name 52 or name 53 or name 54 or name 55 or name 56 or name 69 or name 70 or name 71
!                        or name 72 or name 73 or name 74 or name 75 or name 76 or name 77 or name 78 or name 79 or
!                        name 80) and resid 23)) 
!
!                weight=10.0
!        end

  
!
! KEEPING ATOMS IN SAME BASE IN THE SAME PLANE
!

restraints plane

  for $1 in (1 2 3 4 5 6 7 8 9 10 11 12 13 14 15) loop plan
      group
            selection=(
            (not( hydro or name P or name O1P or name O2P or name O5' or name H5T or
                  name H1' or name H2' or name H3' or name H4' or name H5'
                  or name H2""" or name H5""" or
                  name O3' {or name C1'} or name C2' or name C3' or name O2'
                  or name C4' or name C5' or name O4' or name H3T)
                  and resid $1 ))
            weight=5.0
      end

  end loop plan


  for $1 in (16 17 18 19 20 21 22) loop plan
      group
            selection=(
            (not( hydro or name P or name O1P or name O2P or name O5' or name
H5T or
                  name H1' or name H2' or name H3' or name H4' or name H5'
                  or name H2""" or name H5""" or
                  name O3' {or name C1'} or name C2' or name C3' or name O2'
                  or name C4' or name C5' or name O4' or name H3T)
                  and resid $1 ))
            weight=5.0
      end

  end loop plan





!
! KEEPING EACH TETRAD PLANAR
!

! BASES 2 10 22 14
 
 group
  selection=(
   (not( hydro or name P or name O1P or name O2P or name O5' or name H5T or
                  name H1' or name H2' or name H3' or name H4' or name H5'
                  or name H2""" or name H5""" or
                  name O3' {or name C1'} or name C2' or name C3' or name O2'
                  or name C4' or name C5' or name O4' or name H3T)
                  and resid 2 )
       or  (not( hydro or name P or name O1P or name O2P or name O5' or name H5T or name
                   H1' or name H2' or name H3' or name H4' or name H5' or name H2""" or name H5""" or
                  name O3' {or name C1'} or name C2' or name C3' or name O2'
                  or name C4' or name C5' or name O4' or name H3T)
                  and resid 10 )
              or  (not( hydro or name P or name O1P or name O2P or name O5' or name H5T or
                  name H1' or name H2' or name H3' or name H4' or name H5'
                  or name H2""" or name H5""" or
                  name O3' {or name C1'} or name C2' or name C3' or name O2'
                  or name C4' or name C5' or name O4' or name H3T)
                  and resid 22 )
              or  (not( hydro or name P or name O1P or name O2P or name O5' or name H5T or
                  name H1' or name H2' or name H3' or name H4' or name H5'
                  or name H2""" or name H5""" or
                  name O3' {or name C1'} or name C2' or name C3' or name O2'
                  or name C4' or name C5' or name O4' or name H3T)
                  and resid 14 ))

 weight=200.0
     end


! BASES 3 9 21 15

 
        group
                selection=(
                        (not( hydro or name P or name O1P or name O2P or name O5' or name H5T or
                  name H1' or name H2' or name H3' or name H4' or name H5'
                  or name H2""" or name H5""" or
                  name O3' {or name C1'} or name C2' or name C3' or name O2'
                  or name C4' or name C5' or name O4' or name H3T)
                  and resid 3 )
               or  (not( hydro or name P or name O1P or name O2P or name O5' or name H5T or
                  name H1' or name H2' or name H3' or name H4' or name H5'
                  or name H2""" or name H5""" or
                  name O3' {or name C1'} or name C2' or name C3' or name O2'
                  or name C4' or name C5' or name O4' or name H3T)
                  and resid 9 )
              or   (not( hydro or name P or name O1P or name O2P or name O5' or name H5T or
                  name H1' or name H2' or name H3' or name H4' or name H5'
                  or name H2""" or name H5""" or
                  name O3' {or name C1'} or name C2' or name C3' or name O2'
                  or name C4' or name C5' or name O4' or name H3T)
                  and resid 21 )
              or  (not( hydro or name P or name O1P or name O2P or name O5' or name H5T or
                  name H1' or name H2' or name H3' or name H4' or name H5'
                  or name H2""" or name H5""" or
                  name O3' {or name C1'} or name C2' or name C3' or name O2'
                  or name C4' or name C5' or name O4' or name H3T)
                  and resid 15 ))

        weight=200.0
     end


! 4 8 20 16
 
        group
                selection=(
                        (not( hydro or name P or name O1P or name O2P or name O5' or name H5T or
                  name H1' or name H2' or name H3' or name H4' or name H5'
                  or name H2""" or name H5""" or
                  name O3' {or name C1'} or name C2' or name C3' or name O2'
                  or name C4' or name C5' or name O4' or name H3T)
                  and resid 4 )
              or  (not( hydro or name P or name O1P or name O2P or name O5' or name H5T or
                  name H1' or name H2' or name H3' or name H4' or name H5'
                  or name H2""" or name H5""" or
                  name O3' {or name C1'} or name C2' or name C3' or name O2'
                  or name C4' or name C5' or name O4' or name H3T)
                  and resid 8 )
              or (not( hydro or name P or name O1P or name O2P or name O5' or name H5T or
                  name H1' or name H2' or name H3' or name H4' or name H5'
                  or name H2""" or name H5""" or
                  name O3' {or name C1'} or name C2' or name C3' or name O2'
                  or name C4' or name C5' or name O4' or name H3T)
                  and resid 20 )
             or  (not( hydro or name P or name O1P or name O2P or name O5' or name H5T or
                  name H1' or name H2' or name H3' or name H4' or name H5'
                  or name H2""" or name H5""" or
                  name O3' {or name C1'} or name C2' or name C3' or name O2'
                  or name C4' or name C5' or name O4' or name H3T)
                  and resid 16 ))

        weight=200.0
     end

!
! KEEPING H-BOND DISTANCES BETWEEN in the tetrads
!


! FOR TETRAD 2 10 22 14

 ASSI (resid 22 and name H21) (resid 14 and name N7) 1.9 0.1 0.1
 ASSI (resid 22 and name H1)  (resid 14 and name O6) 1.9 0.1 0.1
 ASSI (resid 14 and name H21) (resid 2 and name N7)  1.9 0.1 0.1
 ASSI (resid 14 and name H1)  (resid 2 and name O6)  1.9 0.1 0.1
 ASSI (resid 2 and name H21)  (resid 10 and name N7) 1.9 0.1 0.1
 ASSI (resid 2 and name H1)   (resid 10 and name O6) 1.9 0.1 0.1
 ASSI (resid 10 and name H21) (resid 22 and name N7) 1.9 0.1 0.1
 ASSI (resid 10 and name H1)  (resid 22 and name O6) 1.9 0.1 0.1

! FOR TETRAD 3 9 21 15

 ASSI (resid 15 and name H21) (resid 21 and name N7) 1.9 0.1 0.1
        ASSI (resid 15 and name H1)  (resid 21 and name O6) 1.9 0.1 0.1
        ASSI (resid 21 and name H21) (resid 9 and name N7)  1.9 0.1 0.1
        ASSI (resid 21 and name H1)  (resid 9 and name O6)  1.9 0.1 0.1
        ASSI (resid 9 and name H21)  (resid 3 and name N7)  1.9 0.1 0.1
        ASSI (resid 9 and name H1)   (resid 3 and name O6)  1.9 0.1 0.1
        ASSI (resid 3 and name H21)  (resid 15 and name N7) 1.9 0.1 0.1
        ASSI (resid 3 and name H1)   (resid 15 and name O6) 1.9 0.1 0.1

! FOR TETRAD 4 8 20 16

 ASSI (resid 20 and name H21) (resid 16 and name N7) 1.9 0.1 0.1
        ASSI (resid 20 and name H1)  (resid 16 and name O6) 1.9 0.1 0.1
        ASSI (resid 16 and name H21) (resid 4 and name N7)  1.9 0.1 0.1
        ASSI (resid 16 and name H1)  (resid 4 and name O6)  1.9 0.1 0.1
        ASSI (resid 4 and name H21)  (resid 8 and name N7)  1.9 0.1 0.1
        ASSI (resid 4 and name H1)   (resid 8 and name O6)  1.9 0.1 0.1
        ASSI (resid 8 and name H21)  (resid 20 and name N7) 1.9 0.1 0.1
        ASSI (resid 8 and name H1)   (resid 20 and name O6) 1.9 0.1 0.1



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H5'   DA   1           H5'        A   1  -2.267  12.891  10.683
    2   H5''   DA   1          H5''        A   1  -1.890  14.489  10.006
    3    H4'   DA   1           H4'        A   1  -4.695  13.424   9.785
    4    H3'   DA   1           H3'        A   1  -2.346  12.165   8.606
    5    H2'   DA   1           H2'        A   1  -2.432  12.922   6.506
    6   H2''   DA   1          H2''        A   1  -4.212  12.591   6.428
    7    H1'   DA   1           H1'        A   1  -4.607  14.776   6.573
    8    H8    DA   1           H8         A   1  -1.430  15.889   8.270
    9    H61   DA   1           H61        A   1   0.306  18.170   2.821
   10    H62   DA   1           H62        A   1   0.638  18.147   4.539
   11    H2    DA   1           H2         A   1  -3.304  15.576   2.159
   12   HO5'   DA   1          H5T         A   1  -2.540  14.975  11.983
   13    H5'   DG   2           H5'        G   2  -1.705   8.372   7.784
   14   H5''   DG   2          H5''        G   2  -1.674  10.091   8.298
   15    H4'   DG   2           H4'        G   2  -3.172  10.644   6.483
   16    H3'   DG   2           H3'        G   2  -3.396   7.663   6.121
   17    H2'   DG   2           H2'        G   2  -3.303   7.841   3.836
   18   H2''   DG   2          H2''        G   2  -4.091   9.499   3.846
   19    H1'   DG   2           H1'        G   2  -2.125  10.476   3.771
   20    H8    DG   2           H8         G   2   0.685   8.687   4.833
   21    H1    DG   2           H1         G   2  -0.448   7.459  -1.292
   22    H21   DG   2           H21        G   2  -2.651   7.880  -1.847
   23    H22   DG   2           H22        G   2  -3.755   8.467  -0.606
   24    H5'   DG   3           H5'        G   3  -6.204   4.789   5.385
   25   H5''   DG   3          H5''        G   3  -4.683   5.704   5.196
   26    H4'   DG   3           H4'        G   3  -6.421   6.768   3.272
   27    H3'   DG   3           H3'        G   3  -6.885   3.816   3.525
   28    H2'   DG   3           H2'        G   3  -6.656   3.544   1.300
   29   H2''   DG   3          H2''        G   3  -7.441   5.164   0.957
   30    H1'   DG   3           H1'        G   3  -5.518   6.229   0.961
   31    H8    DG   3           H8         G   3  -5.537   4.303  -1.195
   32    H1    DG   3           H1         G   3   0.474   3.447   0.679
   33    H21   DG   3           H21        G   3   0.716   3.931   2.853
   34    H22   DG   3           H22        G   3  -0.632   4.494   3.828
   35    H5'   DG   4           H5'        G   4  -9.290   1.638   2.241
   36   H5''   DG   4          H5''        G   4 -10.496   1.135   3.472
   37    H4'   DG   4           H4'        G   4  -8.879  -0.066   4.392
   38    H3'   DG   4           H3'        G   4  -7.979   2.672   5.046
   39    H2'   DG   4           H2'        G   4  -5.776   2.226   4.560
   40   H2''   DG   4          H2''        G   4  -5.853   0.995   5.894
   41    H1'   DG   4           H1'        G   4  -6.474  -0.686   4.472
   42    H8    DG   4           H8         G   4  -3.522   0.262   4.796
   43    H1    DG   4           H1         G   4  -3.593  -1.789  -1.242
   44    H21   DG   4           H21        G   4  -5.756  -1.475  -2.039
   45    H22   DG   4           H22        G   4  -7.059  -0.922  -1.046
   46    H5'   DT   5           H5'       DT   5 -11.878  -1.137   6.757
   47   H5''   DT   5          H5''       DT   5 -10.227  -1.385   7.362
   48    H4'   DT   5           H4'       DT   5  -9.706  -2.243   4.966
   49    H3'   DT   5           H3'       DT   5 -12.537  -1.674   4.725
   50    H2'   DT   5           H2'       DT   5 -13.457  -3.697   4.933
   51   H2''   DT   5          H2''       DT   5 -12.284  -4.368   3.727
   52    H1'   DT   5           H1'       DT   5 -11.202  -5.410   5.369
   53    H3    DT   5           H3        DT   5 -13.242  -4.073   9.956
   54    H71   DT   5           H53       DT   5 -15.954  -7.177   6.769
   55    H72   DT   5           H51       DT   5 -14.674  -8.320   7.207
   56    H73   DT   5           H52       DT   5 -15.741  -7.661   8.466
   57    H6    DT   5           H6        DT   5 -13.512  -6.426   5.774
   58    H5'   DT   6           H5'       DT   6 -12.546  -3.562  -0.616
   59   H5''   DT   6          H5''       DT   6 -11.430  -4.485   0.411
   60    H4'   DT   6           H4'       DT   6 -10.338  -2.593  -1.665
   61    H3'   DT   6           H3'       DT   6 -11.964  -4.927  -2.243
   62    H2'   DT   6           H2'       DT   6 -10.423  -6.492  -2.651
   63   H2''   DT   6          H2''       DT   6  -9.513  -5.346  -3.718
   64    H1'   DT   6           H1'       DT   6  -7.954  -5.142  -2.142
   65    H3    DT   6           H3        DT   6  -9.866  -7.697   2.022
   66    H71   DT   6           H53       DT   6  -6.976 -10.601  -0.114
   67    H72   DT   6           H51       DT   6  -5.911  -9.420  -0.904
   68    H73   DT   6           H52       DT   6  -7.240 -10.154  -1.815
   69    H6    DT   6           H6        DT   6  -7.467  -7.533  -2.138
   70    H5'   DA   7           H5'        A   7 -12.008  -5.238  -7.402
   71   H5''   DA   7          H5''        A   7 -10.841  -6.565  -7.177
   72    H4'   DA   7           H4'        A   7 -10.354  -3.727  -8.040
   73    H3'   DA   7           H3'        A   7 -10.288  -6.115  -9.312
   74    H2'   DA   7           H2'        A   7  -8.695  -7.325  -8.232
   75   H2''   DA   7          H2''        A   7  -7.496  -6.276  -9.083
   76    H1'   DA   7           H1'        A   7  -6.907  -5.352  -7.153
   77    H8    DA   7           H8         A   7  -6.758  -5.743  -4.462
   78    H61   DA   7           H61        A   7 -10.385 -10.379  -2.674
   79    H62   DA   7           H62        A   7  -9.124  -9.268  -2.190
   80    H2    DA   7           H2         A   7 -11.349  -9.450  -6.969
   81    H5'   DG   8           H5'        G   8  -5.782  -2.045 -10.046
   82   H5''   DG   8          H5''        G   8  -5.450  -3.803  -9.875
   83    H4'   DG   8           H4'        G   8  -7.762  -3.705  -8.601
   84    H3'   DG   8           H3'        G   8  -6.807  -0.846  -8.440
   85    H2'   DG   8           H2'        G   8  -7.351  -0.792  -6.203
   86   H2''   DG   8          H2''        G   8  -8.667  -2.065  -6.396
   87    H1'   DG   8           H1'        G   8  -7.248  -3.637  -5.826
   88    H8    DG   8           H8         G   8  -6.982  -1.740  -3.729
   89    H1    DG   8           H1         G   8  -0.808  -2.980  -4.384
   90    H21   DG   8           H21        G   8  -0.310  -3.689  -6.367
   91    H22   DG   8           H22        G   8  -1.504  -3.954  -7.619
   92    H5'   DG   9           H5'        G   9  -8.222   1.984  -7.367
   93   H5''   DG   9          H5''        G   9  -9.034   3.135  -8.486
   94    H4'   DG   9           H4'        G   9  -7.062   3.658  -9.312
   95    H3'   DG   9           H3'        G   9  -7.123   0.811 -10.120
   96    H2'   DG   9           H2'        G   9  -4.965   0.428  -9.465
   97   H2''   DG   9          H2''        G   9  -4.481   1.671 -10.717
   98    H1'   DG   9           H1'        G   9  -4.631   3.372  -9.243
   99    H8    DG   9           H8         G   9  -2.106   1.508  -9.388
  100    H1    DG   9           H1         G   9  -2.259   3.095  -3.206
  101    H21   DG   9           H21        G   9  -4.387   3.690  -2.691
  102    H22   DG   9           H22        G   9  -5.687   3.681  -3.840
  103    H5'   DG  10           H5'        G  10  -7.443   6.376  -9.610
  104   H5''   DG  10          H5''        G  10  -6.749   6.507 -11.253
  105    H4'   DG  10           H4'        G  10  -5.363   7.885 -10.053
  106    H3'   DG  10           H3'        G  10  -4.267   5.210 -10.383
  107    H2'   DG  10           H2'        G  10  -3.684   5.016  -8.135
  108   H2''   DG  10          H2''        G  10  -2.366   6.175  -8.602
  109    H1'   DG  10           H1'        G  10  -3.733   8.007  -8.143
  110    H8    DG  10           H8         G  10  -5.603   7.747  -5.328
  111    H1    DG  10           H1         G  10   0.489   6.571  -3.914
  112    H21   DG  10           H21        G  10   1.541   5.850  -5.708
  113    H22   DG  10           H22        G  10   0.729   5.626  -7.234
  114    H5'   DT  11           H5'       DT  11   0.696   5.784 -11.056
  115   H5''   DT  11          H5''       DT  11   0.638   6.013  -9.298
  116    H4'   DT  11           H4'       DT  11   2.559   7.121 -10.714
  117    H3'   DT  11           H3'       DT  11   1.161   7.897  -8.285
  118    H2'   DT  11           H2'       DT  11   0.936  10.103  -8.567
  119   H2''   DT  11          H2''       DT  11   2.668  10.234  -9.081
  120    H1'   DT  11           H1'       DT  11   2.013  10.536 -11.186
  121    H3    DT  11           H3        DT  11  -1.356  13.506 -11.157
  122    H71   DT  11           H53       DT  11  -4.278   9.801 -10.026
  123    H72   DT  11           H51       DT  11  -4.211   9.685 -11.793
  124    H73   DT  11           H52       DT  11  -3.370   8.480 -10.791
  125    H6    DT  11           H6        DT  11  -1.130   8.738 -10.606
  126    H5'   DT  12           H5'       DT  12   5.581  10.811  -7.053
  127   H5''   DT  12          H5''       DT  12   5.725  10.476  -8.791
  128    H4'   DT  12           H4'       DT  12   7.862   9.150  -8.144
  129    H3'   DT  12           H3'       DT  12   7.048  10.152  -5.548
  130    H2'   DT  12           H2'       DT  12   8.415  11.892  -5.251
  131   H2''   DT  12          H2''       DT  12   9.834  10.877  -5.739
  132    H1'   DT  12           H1'       DT  12   9.932  11.966  -7.681
  133    H3    DT  12           H3        DT  12   9.280  16.186  -5.932
  134    H71   DT  12           H53       DT  12   5.616  15.271  -9.512
  135    H72   DT  12           H51       DT  12   4.700  14.737  -8.093
  136    H73   DT  12           H52       DT  12   5.264  16.421  -8.205
  137    H6    DT  12           H6        DT  12   6.644  12.983  -8.358
  138    H5'   DA  13           H5'        A  13   9.783   5.535  -4.710
  139   H5''   DA  13          H5''        A  13   9.508   5.990  -3.018
  140    H4'   DA  13           H4'        A  13  11.547   4.922  -2.833
  141    H3'   DA  13           H3'        A  13  11.736   7.808  -2.933
  142    H2'   DA  13           H2'        A  13  13.528   8.140  -4.225
  143   H2''   DA  13          H2''        A  13  14.463   6.919  -3.268
  144    H1'   DA  13           H1'        A  13  14.321   5.498  -4.976
  145    H8    DA  13           H8         A  13  11.221   6.935  -6.609
  146    H61   DA  13           H61        A  13  14.948   8.996 -11.054
  147    H62   DA  13           H62        A  13  13.285   8.713 -10.593
  148    H2    DA  13           H2         A  13  17.505   7.570  -7.644
  149    H5'   DG  14           H5'        G  14  11.993   3.406   0.619
  150   H5''   DG  14          H5''        G  14  11.491   4.547  -0.664
  151    H4'   DG  14           H4'        G  14  12.045   5.892   1.871
  152    H3'   DG  14           H3'        G  14  10.248   3.497   1.952
  153    H2'   DG  14           H2'        G  14   8.483   4.629   2.917
  154   H2''   DG  14          H2''        G  14   9.590   5.922   3.610
  155    H1'   DG  14           H1'        G  14   8.993   7.173   1.909
  156    H8    DG  14           H8         G  14   8.881   5.130  -1.090
  157    H1    DG  14           H1         G  14   3.132   7.076   0.832
  158    H21   DG  14           H21        G  14   3.162   7.606   2.976
  159    H22   DG  14           H22        G  14   4.614   7.483   3.952
  160    H5'   DG  15           H5'        G  15   8.877   0.652   3.435
  161   H5''   DG  15          H5''        G  15   8.708   1.952   2.229
  162    H4'   DG  15           H4'        G  15   9.089   3.216   4.761
  163    H3'   DG  15           H3'        G  15   7.281   0.821   4.936
  164    H2'   DG  15           H2'        G  15   5.593   2.085   5.941
  165   H2''   DG  15          H2''        G  15   6.786   3.349   6.532
  166    H1'   DG  15           H1'        G  15   6.212   4.549   4.786
  167    H8    DG  15           H8         G  15   3.422   3.877   4.960
  168    H1    DG  15           H1         G  15   4.317   2.182  -1.140
  169    H21   DG  15           H21        G  15   6.482   1.626  -1.428
  170    H22   DG  15           H22        G  15   7.647   1.678  -0.133
  171    H5'   DG  16           H5'        G  16   7.382  -2.538   7.015
  172   H5''   DG  16          H5''        G  16   8.132  -1.501   5.774
  173    H4'   DG  16           H4'        G  16   6.026   0.022   6.557
  174    H3'   DG  16           H3'        G  16   5.123  -2.786   7.033
  175    H2'   DG  16           H2'        G  16   3.163  -2.245   5.965
  176   H2''   DG  16          H2''        G  16   3.209  -0.521   6.595
  177    H1'   DG  16           H1'        G  16   4.302   0.220   4.836
  178    H8    DG  16           H8         G  16   5.335  -2.041   2.379
  179    H1    DG  16           H1         G  16  -0.961  -1.019   2.115
  180    H21   DG  16           H21        G  16  -1.641  -0.288   4.130
  181    H22   DG  16           H22        G  16  -0.534  -0.078   5.455
  182    H5'   DT  17           H5'       DT  17   6.978  -3.954  10.364
  183   H5''   DT  17          H5''       DT  17   7.563  -3.983   8.689
  184    H4'   DT  17           H4'       DT  17   7.473  -6.247   9.134
  185    H3'   DT  17           H3'       DT  17   5.192  -5.244   7.664
  186    H2'   DT  17           H2'       DT  17   3.484  -6.318   8.626
  187   H2''   DT  17          H2''       DT  17   4.368  -7.889   8.446
  188    H1'   DT  17           H1'       DT  17   4.765  -7.920  10.636
  189    H3    DT  17           H3        DT  17   0.700  -6.879  12.358
  190    H71   DT  17           H53       DT  17   2.232  -2.653  13.456
  191    H72   DT  17           H51       DT  17   3.977  -2.795  13.146
  192    H73   DT  17           H52       DT  17   2.895  -2.226  11.864
  193    H6    DT  17           H6        DT  17   4.635  -4.365  11.224
  194    H5'   DT  18           H5'       DT  18   6.917  -9.120   6.484
  195   H5''   DT  18          H5''       DT  18   8.464  -8.790   5.678
  196    H4'   DT  18           H4'       DT  18   8.183 -10.524   4.285
  197    H3'   DT  18           H3'       DT  18   5.915  -8.892   3.524
  198    H2'   DT  18           H2'       DT  18   4.216 -10.333   3.703
  199   H2''   DT  18          H2''       DT  18   5.129 -11.526   2.691
  200    H1'   DT  18           H1'       DT  18   5.546 -12.771   4.490
  201    H3    DT  18           H3        DT  18   1.252 -12.804   6.103
  202    H71   DT  18           H53       DT  18   2.915  -9.377   9.171
  203    H72   DT  18           H51       DT  18   3.307 -10.905   9.978
  204    H73   DT  18           H52       DT  18   4.602  -9.925   9.251
  205    H6    DT  18           H6        DT  18   5.318 -10.472   7.165
  206    H5'   DA  19           H5'        A  19   9.726  -8.530  -1.064
  207   H5''   DA  19          H5''        A  19   9.514  -7.618   0.445
  208    H4'   DA  19           H4'        A  19   7.247  -8.217  -1.481
  209    H3'   DA  19           H3'        A  19   9.358  -6.161  -1.555
  210    H2'   DA  19           H2'        A  19   8.098  -4.306  -1.257
  211   H2''   DA  19          H2''        A  19   6.647  -5.053  -2.034
  212    H1'   DA  19           H1'        A  19   5.878  -5.229   0.082
  213    H8    DA  19           H8         A  19   8.659  -6.465   2.115
  214    H61   DA  19           H61        A  19   9.612  -0.764   4.214
  215    H62   DA  19           H62        A  19   9.953  -2.461   4.461
  216    H2    DA  19           H2         A  19   6.904  -0.492   0.632
  217    H5'   DG  20           H5'        G  20   8.796  -3.298  -4.899
  218   H5''   DG  20          H5''        G  20   8.184  -4.222  -3.502
  219    H4'   DG  20           H4'        G  20   7.448  -5.749  -5.677
  220    H3'   DG  20           H3'        G  20   7.239  -2.826  -6.443
  221    H2'   DG  20           H2'        G  20   5.122  -3.214  -7.248
  222   H2''   DG  20          H2''        G  20   5.536  -4.940  -7.731
  223    H1'   DG  20           H1'        G  20   4.857  -5.743  -5.805
  224    H8    DG  20           H8         G  20   2.644  -4.337  -7.022
  225    H1    DG  20           H1         G  20   1.620  -2.444  -1.094
  226    H21   DG  20           H21        G  20   4.964  -2.850  -0.570
  227    H22   DG  20           H22        G  20   3.406  -2.409   0.026
  228    H5'   DG  21           H5'        G  21   7.162  -2.014  -8.485
  229   H5''   DG  21          H5''        G  21   7.936  -0.895  -9.657
  230    H4'   DG  21           H4'        G  21   8.547   0.530  -8.054
  231    H3'   DG  21           H3'        G  21   9.293  -1.790  -6.420
  232    H2'   DG  21           H2'        G  21   7.991  -1.169  -4.693
  233   H2''   DG  21          H2''        G  21   9.070   0.290  -4.571
  234    H1'   DG  21           H1'        G  21   7.731   1.531  -5.984
  235    H8    DG  21           H8         G  21   7.400   1.012  -2.965
  236    H1    DG  21           H1         G  21   1.339   1.941  -4.655
  237    H21   DG  21           H21        G  21   1.001   1.480  -6.823
  238    H22   DG  21           H22        G  21   2.316   0.923  -7.853
  239    H5'   DG  22           H5'        G  22   9.828   4.054  -8.628
  240   H5''   DG  22          H5''        G  22   8.979   3.678  -7.099
  241    H4'   DG  22           H4'        G  22   7.948   2.171  -9.385
  242    H3'   DG  22           H3'        G  22   8.126   5.155  -9.662
  243   HO3'   DG  22          H3T         G  22   8.888   3.040 -11.045
  244    H2'   DG  22           H2'        G  22   5.890   5.315 -10.197
  245   H2''   DG  22          H2''        G  22   5.887   3.645 -10.970
  246    H1'   DG  22           H1'        G  22   5.139   2.734  -9.121
  247    H8    DG  22           H8         G  22   2.997   4.567  -9.250
  248    H1    DG  22           H1         G  22   4.638   5.696  -3.202
  249    H21   DG  22           H21        G  22   6.792   5.219  -2.914
  250    H22   DG  22           H22        G  22   7.814   4.638  -4.204
  251    H45  RUL 101           H45      RUL  23  -0.382  -5.268   5.334
  252    H46  RUL 101           H46      RUL  23   1.431  -5.877   3.795
  253    H47  RUL 101           H47      RUL  23   0.940  -6.227   1.333
  254    H48  RUL 101           H48      RUL  23  -6.496  -4.563   3.585
  255    H49  RUL 101           H49      RUL  23  -7.343  -4.866   1.293
  256    H50  RUL 101           H50      RUL  23  -5.718  -5.441  -0.543
  257    H51  RUL 101           H51      RUL  23  -5.201  -4.330   7.488
  258    H52  RUL 101           H52      RUL  23  -7.689  -4.739   8.267
  259    H53  RUL 101           H53      RUL  23  -9.027  -6.224   6.804
  260    H54  RUL 101           H54      RUL  23  -8.022  -7.599   5.014
  261    H55  RUL 101           H55      RUL  23  -2.031  -7.632   3.611
  262    H56  RUL 101           H56      RUL  23  -2.820  -9.869   2.709
  263    H57  RUL 101           H57      RUL  23  -5.016 -10.662   3.185
  264    H58  RUL 101           H58      RUL  23  -6.694  -9.210   4.326
  265    H59  RUL 101           H59      RUL  23  -5.119  -2.494   4.641
  266    H60  RUL 101           H60      RUL  23  -5.845  -1.098   6.578
  267    H61  RUL 101           H61      RUL  23  -4.025  -0.501   8.230
  268    H62  RUL 101           H62      RUL  23  -2.028  -1.930   8.476
  269    H63  RUL 101           H63      RUL  23  -3.019  -7.790   6.768
  270    H64  RUL 101           H64      RUL  23  -1.156  -8.159   8.550
  271    H65  RUL 101           H65      RUL  23   0.117  -6.276   9.212
  272    H66  RUL 101           H66      RUL  23  -0.417  -3.946   8.575
  273    H67  RUL 101           H67      RUL  23   2.593  -7.698  -5.961
  274    H68  RUL 101           H68      RUL  23   3.419  -7.432  -3.609
  275    H69  RUL 101           H69      RUL  23   1.792  -6.901  -1.796
  276    H70  RUL 101           H70      RUL  23  -3.583  -7.054  -7.686
  277    H71  RUL 101           H71      RUL  23  -5.428  -6.573  -6.076
  278    H72  RUL 101           H72      RUL  23  -4.838  -6.343  -3.590
  279    H73  RUL 101           H73      RUL  23   1.113  -8.344  -9.863
  280    H74  RUL 101           H74      RUL  23   3.167  -9.856 -10.519
  281    H75  RUL 101           H75      RUL  23   3.808 -11.432  -8.811
  282    H76  RUL 101           H76      RUL  23   3.084 -11.461  -6.528
  283    H77  RUL 101           H77      RUL  23  -2.635  -9.230  -5.655
  284    H78  RUL 101           H78      RUL  23  -2.470 -11.092  -3.759
  285    H79  RUL 101           H79      RUL  23   0.012 -11.945  -3.346
  286    H80  RUL 101           H80      RUL  23   1.684 -11.519  -4.790
  287    H81  RUL 101           H81      RUL  23  -1.798 -10.489  -8.145
  288    H82  RUL 101           H82      RUL  23  -3.897 -10.791  -9.671
  289    H83  RUL 101           H83      RUL  23  -4.437  -9.037 -11.152
  290    H84  RUL 101           H84      RUL  23  -3.207  -6.845 -11.250
  291    H85  RUL 101           H85      RUL  23   2.095  -6.174  -8.097
  292    H86  RUL 101           H86      RUL  23   2.607  -4.608  -9.883
  293    H87  RUL 101           H87      RUL  23   0.936  -4.530 -11.916
  294    H88  RUL 101           H88      RUL  23  -1.394  -5.477 -11.546
  Start of MODEL    2
    1    H5'   DA   1           H5'        A   1  -0.395  12.164  11.097
    2   H5''   DA   1          H5''        A   1  -1.218  13.243  12.244
    3    H4'   DA   1           H4'        A   1  -2.977  13.654  10.502
    4    H3'   DA   1           H3'        A   1  -1.504  11.548   9.136
    5    H2'   DA   1           H2'        A   1  -0.468  12.693   7.522
    6   H2''   DA   1          H2''        A   1  -2.010  13.553   7.116
    7    H1'   DA   1           H1'        A   1  -1.233  15.406   8.077
    8    H8    DA   1           H8         A   1   1.384  14.387  10.441
    9    H61   DA   1           H61        A   1   5.575  15.496   6.068
   10    H62   DA   1           H62        A   1   5.322  15.234   7.779
   11    H2    DA   1           H2         A   1   1.529  15.358   4.117
   12   HO5'   DA   1          H5T         A   1  -1.665  10.696  11.845
   13    H5'   DG   2           H5'        G   2  -2.152   9.511   6.575
   14   H5''   DG   2          H5''        G   2  -2.301  11.282   6.815
   15    H4'   DG   2           H4'        G   2  -3.720  11.416   4.863
   16    H3'   DG   2           H3'        G   2  -3.624   8.402   4.914
   17    H2'   DG   2           H2'        G   2  -3.614   8.327   2.610
   18   H2''   DG   2          H2''        G   2  -4.432   9.967   2.456
   19    H1'   DG   2           H1'        G   2  -2.464  10.920   2.252
   20    H8    DG   2           H8         G   2   0.319   9.335   3.714
   21    H1    DG   2           H1         G   2  -0.651   7.177  -2.187
   22    H21   DG   2           H21        G   2  -2.840   7.527  -2.829
   23    H22   DG   2           H22        G   2  -3.963   8.299  -1.722
   24    H5'   DG   3           H5'        G   3  -6.021   5.301   4.624
   25   H5''   DG   3          H5''        G   3  -4.746   6.554   4.507
   26    H4'   DG   3           H4'        G   3  -6.214   7.084   2.294
   27    H3'   DG   3           H3'        G   3  -6.442   4.101   2.738
   28    H2'   DG   3           H2'        G   3  -6.115   3.782   0.526
   29   H2''   DG   3          H2''        G   3  -6.860   5.386   0.068
   30    H1'   DG   3           H1'        G   3  -4.931   6.427   0.197
   31    H8    DG   3           H8         G   3  -4.908   4.227  -1.678
   32    H1    DG   3           H1         G   3   0.978   3.442   0.535
   33    H21   DG   3           H21        G   3   1.176   4.208   2.620
   34    H22   DG   3           H22        G   3  -0.167   4.944   3.483
   35    H5'   DG   4           H5'        G   4 -10.380   2.558   0.363
   36   H5''   DG   4          H5''        G   4 -11.811   2.603   1.453
   37    H4'   DG   4           H4'        G   4 -10.491   0.883   2.237
   38    H3'   DG   4           H3'        G   4 -10.728   3.297   3.799
   39    H2'   DG   4           H2'        G   4  -8.508   3.805   3.405
   40   H2''   DG   4          H2''        G   4  -8.336   2.915   4.970
   41    H1'   DG   4           H1'        G   4  -8.208   0.795   3.682
   42    H8    DG   4           H8         G   4  -5.886   2.442   5.003
   43    H1    DG   4           H1         G   4  -3.370  -0.956   0.259
   44    H21   DG   4           H21        G   4  -5.006  -0.921  -1.151
   45    H22   DG   4           H22        G   4  -6.603  -0.291  -0.968
   46    H5'   DT   5           H5'       DT   5 -11.114  -2.400   5.214
   47   H5''   DT   5          H5''       DT   5  -9.367  -2.506   4.989
   48    H4'   DT   5           H4'       DT   5  -9.930  -4.321   3.719
   49    H3'   DT   5           H3'       DT   5  -9.444  -2.149   2.077
   50    H2'   DT   5           H2'       DT   5 -11.455  -1.523   1.270
   51   H2''   DT   5          H2''       DT   5 -11.520  -3.122   0.417
   52    H1'   DT   5           H1'       DT   5 -13.207  -3.722   1.779
   53    H3    DT   5           H3        DT   5 -14.206  -0.567   5.678
   54    H71   DT   5           H53       DT   5 -15.282   0.498   0.502
   55    H72   DT   5           H51       DT   5 -16.218   1.243   1.821
   56    H73   DT   5           H52       DT   5 -14.607   1.864   1.413
   57    H6    DT   5           H6        DT   5 -13.765  -1.163   0.931
   58    H5'   DT   6           H5'       DT   6  -8.301  -7.345  -0.882
   59   H5''   DT   6          H5''       DT   6  -7.461  -5.818  -1.192
   60    H4'   DT   6           H4'       DT   6  -9.255  -5.754  -3.229
   61    H3'   DT   6           H3'       DT   6  -9.284  -8.576  -2.416
   62    H2'   DT   6           H2'       DT   6  -7.501  -9.153  -3.726
   63   H2''   DT   6          H2''       DT   6  -8.710  -8.973  -5.079
   64    H1'   DT   6           H1'       DT   6  -8.130  -6.743  -5.379
   65    H3    DT   6           H3        DT   6  -5.194  -9.412  -7.944
   66    H71   DT   6           H53       DT   6  -3.026  -5.554  -4.875
   67    H72   DT   6           H51       DT   6  -2.364  -5.727  -6.508
   68    H73   DT   6           H52       DT   6  -1.995  -6.896  -5.279
   69    H6    DT   6           H6        DT   6  -5.111  -6.124  -4.454
   70    H5'   DA   7           H5'        A   7  -9.919  -8.161  -8.403
   71   H5''   DA   7          H5''        A   7  -8.279  -8.641  -7.940
   72    H4'   DA   7           H4'        A   7  -9.428  -5.963  -7.315
   73    H3'   DA   7           H3'        A   7  -8.730  -6.888  -9.939
   74    H2'   DA   7           H2'        A   7  -6.472  -6.811  -9.486
   75   H2''   DA   7          H2''        A   7  -6.679  -5.112 -10.043
   76    H1'   DA   7           H1'        A   7  -7.067  -4.426  -7.800
   77    H8    DA   7           H8         A   7  -4.700  -4.366  -5.692
   78    H61   DA   7           H61        A   7  -0.353  -3.742 -10.049
   79    H62   DA   7           H62        A   7  -0.908  -3.259  -8.462
   80    H2    DA   7           H2         A   7  -3.568  -6.325 -11.814
   81    H5'   DG   8           H5'        G   8  -9.189  -3.860  -7.850
   82   H5''   DG   8          H5''        G   8  -9.927  -2.322  -7.795
   83    H4'   DG   8           H4'        G   8  -8.767  -3.183  -5.786
   84    H3'   DG   8           H3'        G   8  -7.746  -0.557  -6.848
   85    H2'   DG   8           H2'        G   8  -6.743  -0.356  -4.823
   86   H2''   DG   8          H2''        G   8  -8.043  -1.301  -3.999
   87    H1'   DG   8           H1'        G   8  -7.071  -3.239  -4.383
   88    H8    DG   8           H8         G   8  -6.277  -1.233  -2.687
   89    H1    DG   8           H1         G   8  -0.429  -3.188  -3.059
   90    H21   DG   8           H21        G   8  -0.905  -4.496  -6.062
   91    H22   DG   8           H22        G   8   0.119  -4.352  -4.704
   92    H5'   DG   9           H5'        G   9  -7.142   1.571  -6.411
   93   H5''   DG   9          H5''        G   9  -8.133   2.969  -6.940
   94    H4'   DG   9           H4'        G   9  -7.098   3.045  -8.923
   95    H3'   DG   9           H3'        G   9  -7.298   0.109  -8.893
   96    H2'   DG   9           H2'        G   9  -5.128  -0.403  -9.166
   97   H2''   DG   9          H2''        G   9  -5.102   0.641 -10.669
   98    H1'   DG   9           H1'        G   9  -4.226   2.359  -9.616
   99    H8    DG   9           H8         G   9  -2.057   0.326  -9.567
  100    H1    DG   9           H1         G   9  -1.668   2.582  -3.577
  101    H21   DG   9           H21        G   9  -3.707   3.377  -3.015
  102    H22   DG   9           H22        G   9  -5.083   3.339  -4.073
  103    H5'   DG  10           H5'        G  10  -8.549   5.582  -9.595
  104   H5''   DG  10          H5''        G  10  -8.052   5.418 -11.302
  105    H4'   DG  10           H4'        G  10  -6.355   6.709 -10.475
  106    H3'   DG  10           H3'        G  10  -5.635   3.878 -10.340
  107    H2'   DG  10           H2'        G  10  -4.625   4.070  -8.296
  108   H2''   DG  10          H2''        G  10  -3.382   5.064  -9.181
  109    H1'   DG  10           H1'        G  10  -4.552   7.010  -8.805
  110    H8    DG  10           H8         G  10  -6.084   7.210  -5.772
  111    H1    DG  10           H1         G  10   0.080   5.859  -4.890
  112    H21   DG  10           H21        G  10   0.910   4.886  -6.669
  113    H22   DG  10           H22        G  10  -0.044   4.532  -8.086
  114    H5'   DT  11           H5'       DT  11  -2.982   7.701 -10.624
  115   H5''   DT  11          H5''       DT  11  -2.893   7.347 -12.361
  116    H4'   DT  11           H4'       DT  11  -0.310   7.485 -12.022
  117    H3'   DT  11           H3'       DT  11  -1.226   8.125  -9.365
  118    H2'   DT  11           H2'       DT  11  -1.191  10.359  -9.346
  119   H2''   DT  11          H2''       DT  11   0.511  10.332  -9.963
  120    H1'   DT  11           H1'       DT  11  -0.197  11.026 -11.958
  121    H3    DT  11           H3        DT  11  -3.016  14.295 -10.337
  122    H71   DT  11           H53       DT  11  -5.969  11.535 -13.279
  123    H72   DT  11           H51       DT  11  -5.847  10.111 -12.227
  124    H73   DT  11           H52       DT  11  -6.634  11.594 -11.637
  125    H6    DT  11           H6        DT  11  -3.510   9.902 -12.220
  126    H5'   DT  12           H5'       DT  12   3.429   8.000  -6.580
  127   H5''   DT  12          H5''       DT  12   2.841   9.669  -6.724
  128    H4'   DT  12           H4'       DT  12   5.247   8.807  -8.314
  129    H3'   DT  12           H3'       DT  12   5.093   8.833  -5.402
  130    H2'   DT  12           H2'       DT  12   6.049  10.796  -4.930
  131   H2''   DT  12          H2''       DT  12   7.409  10.426  -6.067
  132    H1'   DT  12           H1'       DT  12   6.584  11.861  -7.553
  133    H3    DT  12           H3        DT  12   5.836  15.444  -4.856
  134    H71   DT  12           H53       DT  12   1.213  14.451  -6.234
  135    H72   DT  12           H51       DT  12   1.211  12.756  -5.703
  136    H73   DT  12           H52       DT  12   1.305  14.069  -4.507
  137    H6    DT  12           H6        DT  12   3.138  11.842  -6.536
  138    H5'   DA  13           H5'        A  13   8.128   5.785  -3.431
  139   H5''   DA  13          H5''        A  13   8.694   7.328  -2.766
  140    H4'   DA  13           H4'        A  13  10.355   5.299  -3.028
  141    H3'   DA  13           H3'        A  13  10.683   8.183  -3.166
  142    H2'   DA  13           H2'        A  13  12.122   8.408  -4.859
  143   H2''   DA  13          H2''        A  13  13.163   7.093  -4.175
  144    H1'   DA  13           H1'        A  13  12.468   5.716  -5.778
  145    H8    DA  13           H8         A  13   9.310   7.777  -6.476
  146    H61   DA  13           H61        A  13  11.821   8.958 -11.972
  147    H62   DA  13           H62        A  13  10.368   9.072 -11.004
  148    H2    DA  13           H2         A  13  14.915   6.905  -9.441
  149    H5'   DG  14           H5'        G  14  11.915   3.705   0.498
  150   H5''   DG  14          H5''        G  14  11.004   4.425  -0.860
  151    H4'   DG  14           H4'        G  14  11.804   6.265   1.341
  152    H3'   DG  14           H3'        G  14  10.178   3.831   1.843
  153    H2'   DG  14           H2'        G  14   8.326   4.918   2.681
  154   H2''   DG  14          H2''        G  14   9.336   6.365   3.205
  155    H1'   DG  14           H1'        G  14   8.623   7.394   1.404
  156    H8    DG  14           H8         G  14   8.633   4.918  -1.312
  157    H1    DG  14           H1         G  14   2.853   7.160   0.155
  158    H21   DG  14           H21        G  14   2.841   8.008   2.194
  159    H22   DG  14           H22        G  14   4.269   8.027   3.211
  160    H5'   DG  15           H5'        G  15   9.618   0.944   3.820
  161   H5''   DG  15          H5''        G  15   9.236   1.731   2.261
  162    H4'   DG  15           H4'        G  15   9.219   3.690   4.407
  163    H3'   DG  15           H3'        G  15   7.705   1.144   4.892
  164    H2'   DG  15           H2'        G  15   5.769   2.320   5.401
  165   H2''   DG  15          H2''        G  15   6.723   3.787   5.965
  166    H1'   DG  15           H1'        G  15   6.463   4.701   3.989
  167    H8    DG  15           H8         G  15   3.683   4.120   4.160
  168    H1    DG  15           H1         G  15   4.724   1.594  -1.605
  169    H21   DG  15           H21        G  15   6.861   0.926  -1.754
  170    H22   DG  15           H22        G  15   7.993   1.108  -0.438
  171    H5'   DG  16           H5'        G  16   7.597  -1.871   7.114
  172   H5''   DG  16          H5''        G  16   7.769  -1.759   5.338
  173    H4'   DG  16           H4'        G  16   6.361   0.521   6.518
  174    H3'   DG  16           H3'        G  16   5.305  -2.228   7.092
  175    H2'   DG  16           H2'        G  16   3.194  -1.590   6.413
  176   H2''   DG  16          H2''        G  16   3.484   0.160   6.905
  177    H1'   DG  16           H1'        G  16   4.088   0.690   4.865
  178    H8    DG  16           H8         G  16   5.157  -2.086   2.865
  179    H1    DG  16           H1         G  16  -0.945  -0.654   1.937
  180    H21   DG  16           H21        G  16  -1.779   0.479   3.652
  181    H22   DG  16           H22        G  16  -0.703   0.864   4.993
  182    H5'   DT  17           H5'       DT  17   4.262  -4.114   9.134
  183   H5''   DT  17          H5''       DT  17   5.311  -4.049  10.564
  184    H4'   DT  17           H4'       DT  17   7.036  -5.317   9.087
  185    H3'   DT  17           H3'       DT  17   4.803  -5.133   7.258
  186    H2'   DT  17           H2'       DT  17   3.851  -7.145   7.444
  187   H2''   DT  17          H2''       DT  17   5.465  -7.935   7.217
  188    H1'   DT  17           H1'       DT  17   5.500  -8.480   9.377
  189    H3    DT  17           H3        DT  17   1.125  -9.931   9.573
  190    H71   DT  17           H53       DT  17   0.667  -6.721  12.991
  191    H72   DT  17           H51       DT  17   2.026  -5.612  12.688
  192    H73   DT  17           H52       DT  17   0.538  -5.481  11.731
  193    H6    DT  17           H6        DT  17   3.568  -6.046  10.999
  194    H5'   DT  18           H5'       DT  18   6.067  -9.093   5.443
  195   H5''   DT  18          H5''       DT  18   7.348  -9.110   6.672
  196    H4'   DT  18           H4'       DT  18   8.918  -9.774   4.704
  197    H3'   DT  18           H3'       DT  18   6.379  -9.637   3.332
  198    H2'   DT  18           H2'       DT  18   5.734 -11.773   3.274
  199   H2''   DT  18          H2''       DT  18   7.349 -12.243   2.604
  200    H1'   DT  18           H1'       DT  18   7.906 -13.149   4.562
  201    H3    DT  18           H3        DT  18   3.903 -15.354   5.185
  202    H71   DT  18           H53       DT  18   4.037 -11.101   8.410
  203    H72   DT  18           H51       DT  18   2.980 -12.497   8.730
  204    H73   DT  18           H52       DT  18   4.645 -12.480   9.343
  205    H6    DT  18           H6        DT  18   6.023 -11.426   6.967
  206    H5'   DA  19           H5'        A  19  10.936  -8.923  -0.302
  207   H5''   DA  19          H5''        A  19  10.727  -8.605   1.433
  208    H4'   DA  19           H4'        A  19   8.271  -9.042  -0.227
  209    H3'   DA  19           H3'        A  19  10.216  -6.869  -0.644
  210    H2'   DA  19           H2'        A  19   8.982  -5.111   0.051
  211   H2''   DA  19          H2''        A  19   7.436  -5.868  -0.506
  212    H1'   DA  19           H1'        A  19   7.027  -6.293   1.652
  213    H8    DA  19           H8         A  19  10.312  -7.207   3.083
  214    H61   DA  19           H61        A  19  10.568  -1.629   5.669
  215    H62   DA  19           H62        A  19  11.249  -3.241   5.662
  216    H2    DA  19           H2         A  19   7.286  -1.589   2.602
  217    H5'   DG  20           H5'        G  20   8.218  -4.313  -3.961
  218   H5''   DG  20          H5''        G  20   7.968  -5.457  -2.601
  219    H4'   DG  20           H4'        G  20   7.053  -6.985  -4.543
  220    H3'   DG  20           H3'        G  20   6.888  -4.221  -5.743
  221    H2'   DG  20           H2'        G  20   4.727  -4.569  -6.392
  222   H2''   DG  20          H2''        G  20   5.009  -6.371  -6.600
  223    H1'   DG  20           H1'        G  20   4.275  -6.783  -4.571
  224    H8    DG  20           H8         G  20   2.094  -4.910  -5.735
  225    H1    DG  20           H1         G  20   2.420  -2.580   0.078
  226    H21   DG  20           H21        G  20   4.497  -2.822   0.892
  227    H22   DG  20           H22        G  20   5.757  -3.623  -0.011
  228    H5'   DG  21           H5'        G  21   6.284  -3.048  -8.862
  229   H5''   DG  21          H5''        G  21   7.631  -2.671  -9.992
  230    H4'   DG  21           H4'        G  21   8.180  -1.019  -8.644
  231    H3'   DG  21           H3'        G  21   8.906  -3.295  -6.949
  232    H2'   DG  21           H2'        G  21   7.931  -2.405  -5.073
  233   H2''   DG  21          H2''        G  21   9.157  -1.074  -5.225
  234    H1'   DG  21           H1'        G  21   7.769   0.227  -6.493
  235    H8    DG  21           H8         G  21   7.709   0.001  -3.436
  236    H1    DG  21           H1         G  21   1.609   1.231  -4.667
  237    H21   DG  21           H21        G  21   1.005   0.576  -6.656
  238    H22   DG  21           H22        G  21   2.145  -0.156  -7.786
  239    H5'   DG  22           H5'        G  22   9.303   2.345  -9.545
  240   H5''   DG  22          H5''        G  22   8.843   2.217  -7.823
  241    H4'   DG  22           H4'        G  22   7.036   0.673  -9.449
  242    H3'   DG  22           H3'        G  22   7.558   3.435 -10.515
  243   HO3'   DG  22          H3T         G  22   7.787   2.297 -12.282
  244    H2'   DG  22           H2'        G  22   5.301   3.845 -10.554
  245   H2''   DG  22          H2''        G  22   4.940   2.112 -11.050
  246    H1'   DG  22           H1'        G  22   4.691   1.430  -8.976
  247    H8    DG  22           H8         G  22   2.511   3.300  -9.435
  248    H1    DG  22           H1         G  22   4.241   5.218  -3.613
  249    H21   DG  22           H21        G  22   6.383   4.757  -3.267
  250    H22   DG  22           H22        G  22   7.385   3.980  -4.472
  251    H45  RUL 101           H45      RUL  23  -1.156  -1.625   6.931
  252    H46  RUL 101           H46      RUL  23   0.807  -2.613   5.891
  253    H47  RUL 101           H47      RUL  23   0.603  -4.020   3.811
  254    H48  RUL 101           H48      RUL  23  -7.160  -2.354   4.607
  255    H49  RUL 101           H49      RUL  23  -7.715  -3.621   2.603
  256    H50  RUL 101           H50      RUL  23  -5.910  -4.768   1.315
  257    H51  RUL 101           H51      RUL  23  -6.905   0.260   5.371
  258    H52  RUL 101           H52      RUL  23  -9.187   0.841   6.556
  259    H53  RUL 101           H53      RUL  23  -9.931  -0.793   8.230
  260    H54  RUL 101           H54      RUL  23  -8.406  -2.482   9.209
  261    H55  RUL 101           H55      RUL  23  -3.302  -4.569   6.487
  262    H56  RUL 101           H56      RUL  23  -4.350  -6.719   7.324
  263    H57  RUL 101           H57      RUL  23  -6.322  -6.628   8.653
  264    H58  RUL 101           H58      RUL  23  -7.573  -4.503   8.963
  265    H59  RUL 101           H59      RUL  23  -1.853   0.396   6.246
  266    H60  RUL 101           H60      RUL  23  -1.735   2.905   5.509
  267    H61  RUL 101           H61      RUL  23  -3.603   4.245   6.682
  268    H62  RUL 101           H62      RUL  23  -5.485   3.046   7.876
  269    H63  RUL 101           H63      RUL  23  -2.556  -2.402   8.988
  270    H64  RUL 101           H64      RUL  23  -3.793  -2.316  11.299
  271    H65  RUL 101           H65      RUL  23  -5.454  -0.642  11.585
  272    H66  RUL 101           H66      RUL  23  -6.093   1.000   9.844
  273    H67  RUL 101           H67      RUL  23   2.941  -8.468  -2.271
  274    H68  RUL 101           H68      RUL  23   3.583  -7.216  -0.237
  275    H69  RUL 101           H69      RUL  23   1.849  -6.054   1.111
  276    H70  RUL 101           H70      RUL  23  -3.250  -9.061  -4.286
  277    H71  RUL 101           H71      RUL  23  -5.158  -8.016  -3.085
  278    H72  RUL 101           H72      RUL  23  -4.744  -6.592  -1.065
  279    H73  RUL 101           H73      RUL  23   1.475 -10.395  -6.389
  280    H74  RUL 101           H74      RUL  23   3.824 -11.492  -6.785
  281    H75  RUL 101           H75      RUL  23   4.837 -12.313  -4.756
  282    H76  RUL 101           H76      RUL  23   4.212 -11.777  -2.505
  283    H77  RUL 101           H77      RUL  23  -1.875 -10.671  -1.917
  284    H78  RUL 101           H78      RUL  23  -1.299 -11.853   0.397
  285    H79  RUL 101           H79      RUL  23   1.309 -12.044   0.860
  286    H80  RUL 101           H80      RUL  23   2.839 -11.704  -0.750
  287    H81  RUL 101           H81      RUL  23  -0.900 -12.117  -4.006
  288    H82  RUL 101           H82      RUL  23  -2.539 -13.353  -5.624
  289    H83  RUL 101           H83      RUL  23  -3.174 -12.234  -7.602
  290    H84  RUL 101           H84      RUL  23  -2.161 -10.061  -8.358
  291    H85  RUL 101           H85      RUL  23   2.179  -7.340  -4.952
  292    H86  RUL 101           H86      RUL  23   2.952  -6.868  -7.203
  293    H87  RUL 101           H87      RUL  23   1.290  -7.228  -9.207
  294    H88  RUL 101           H88      RUL  23  -0.997  -8.176  -8.666
  Start of MODEL    3
    1    H5'   DA   1           H5'        A   1  -2.496  13.378  10.838
    2   H5''   DA   1          H5''        A   1  -1.417  14.723  10.412
    3    H4'   DA   1           H4'        A   1  -4.011  14.380   8.924
    4    H3'   DA   1           H3'        A   1  -1.851  12.429   8.960
    5    H2'   DA   1           H2'        A   1  -0.758  12.920   7.073
    6   H2''   DA   1          H2''        A   1  -2.321  13.033   6.166
    7    H1'   DA   1           H1'        A   1  -2.116  15.248   6.119
    8    H8    DA   1           H8         A   1   0.127  15.723   9.116
    9    H61   DA   1           H61        A   1   4.677  16.853   5.125
   10    H62   DA   1           H62        A   1   4.182  16.946   6.800
   11    H2    DA   1           H2         A   1   1.190  15.190   2.828
   12   HO5'   DA   1          H5T         A   1  -3.131  16.146  10.807
   13    H5'   DG   2           H5'        G   2  -1.919   8.903   7.021
   14   H5''   DG   2          H5''        G   2  -1.824  10.645   7.434
   15    H4'   DG   2           H4'        G   2  -3.448  11.106   5.659
   16    H3'   DG   2           H3'        G   2  -3.497   8.110   5.388
   17    H2'   DG   2           H2'        G   2  -3.674   8.268   3.090
   18   H2''   DG   2          H2''        G   2  -4.404   9.955   3.168
   19    H1'   DG   2           H1'        G   2  -2.403  10.816   2.889
   20    H8    DG   2           H8         G   2   0.361   8.942   4.022
   21    H1    DG   2           H1         G   2  -1.064   7.477  -1.990
   22    H21   DG   2           H21        G   2  -3.110   7.950  -2.492
   23    H22   DG   2           H22        G   2  -4.211   8.665  -1.315
   24    H5'   DG   3           H5'        G   3  -5.991   5.203   4.769
   25   H5''   DG   3          H5''        G   3  -4.742   6.479   4.601
   26    H4'   DG   3           H4'        G   3  -6.627   7.111   2.677
   27    H3'   DG   3           H3'        G   3  -6.195   4.110   2.663
   28    H2'   DG   3           H2'        G   3  -6.406   4.170   0.418
   29   H2''   DG   3          H2''        G   3  -7.222   5.810   0.429
   30    H1'   DG   3           H1'        G   3  -5.241   6.745   0.266
   31    H8    DG   3           H8         G   3  -5.077   4.643  -1.576
   32    H1    DG   3           H1         G   3   0.722   3.846   0.869
   33    H21   DG   3           H21        G   3   0.792   4.531   2.993
   34    H22   DG   3           H22        G   3  -0.607   5.202   3.815
   35    H5'   DG   4           H5'        G   4 -10.403   2.312   1.019
   36   H5''   DG   4          H5''        G   4 -11.767   2.315   2.196
   37    H4'   DG   4           H4'        G   4 -10.316   0.968   3.257
   38    H3'   DG   4           H3'        G   4  -9.867   3.787   4.052
   39    H2'   DG   4           H2'        G   4  -7.656   3.579   4.188
   40   H2''   DG   4          H2''        G   4  -7.904   2.428   5.528
   41    H1'   DG   4           H1'        G   4  -8.044   0.618   4.119
   42    H8    DG   4           H8         G   4  -5.272   1.799   5.150
   43    H1    DG   4           H1         G   4  -3.474  -1.217  -0.286
   44    H21   DG   4           H21        G   4  -5.297  -1.090  -1.666
   45    H22   DG   4           H22        G   4  -6.860  -0.483  -1.248
   46    H5'   DT   5           H5'       DT   5 -13.076  -0.449   3.302
   47   H5''   DT   5          H5''       DT   5 -13.211  -0.727   5.051
   48    H4'   DT   5           H4'       DT   5 -11.004  -2.078   3.514
   49    H3'   DT   5           H3'       DT   5 -13.843  -2.494   3.032
   50    H2'   DT   5           H2'       DT   5 -14.244  -4.336   4.229
   51   H2''   DT   5          H2''       DT   5 -12.761  -5.124   3.553
   52    H1'   DT   5           H1'       DT   5 -11.721  -4.834   5.499
   53    H3    DT   5           H3        DT   5 -15.017  -2.042   8.460
   54    H71   DT   5           H53       DT   5 -15.115  -7.370   7.945
   55    H72   DT   5           H51       DT   5 -14.208  -6.970   9.415
   56    H73   DT   5           H52       DT   5 -15.922  -6.532   9.292
   57    H6    DT   5           H6        DT   5 -13.420  -6.192   6.640
   58    H5'   DT   6           H5'       DT   6 -10.250  -7.047   0.733
   59   H5''   DT   6          H5''       DT   6  -9.254  -5.648   0.286
   60    H4'   DT   6           H4'       DT   6 -10.706  -5.566  -1.865
   61    H3'   DT   6           H3'       DT   6 -11.807  -7.911  -0.561
   62    H2'   DT   6           H2'       DT   6 -10.815  -9.572  -1.677
   63   H2''   DT   6          H2''       DT   6 -11.277  -8.797  -3.248
   64    H1'   DT   6           H1'       DT   6  -9.168  -8.158  -3.572
   65    H3    DT   6           H3        DT   6  -7.366 -12.262  -2.467
   66    H71   DT   6           H53       DT   6  -4.996  -8.862   0.467
   67    H72   DT   6           H51       DT   6  -5.533 -10.308   1.342
   68    H73   DT   6           H52       DT   6  -6.437  -8.783   1.498
   69    H6    DT   6           H6        DT   6  -7.715  -7.940  -0.396
   70    H5'   DA   7           H5'        A   7 -12.602  -7.273  -6.595
   71   H5''   DA   7          H5''        A   7 -11.269  -8.422  -6.411
   72    H4'   DA   7           H4'        A   7 -11.204  -5.420  -6.121
   73    H3'   DA   7           H3'        A   7 -10.227  -7.422  -8.074
   74    H2'   DA   7           H2'        A   7  -8.163  -7.360  -7.291
   75   H2''   DA   7          H2''        A   7  -8.058  -5.712  -8.008
   76    H1'   DA   7           H1'        A   7  -8.841  -4.745  -5.911
   77    H8    DA   7           H8         A   7  -7.116  -5.841  -3.199
   78    H61   DA   7           H61        A   7  -1.684  -5.533  -5.965
   79    H62   DA   7           H62        A   7  -2.537  -5.638  -4.441
   80    H2    DA   7           H2         A   7  -4.779  -5.866  -9.181
   81    H5'   DG   8           H5'        G   8  -7.039  -2.492  -9.833
   82   H5''   DG   8          H5''        G   8  -6.155  -4.027  -9.566
   83    H4'   DG   8           H4'        G   8  -7.587  -3.674  -7.335
   84    H3'   DG   8           H3'        G   8  -6.628  -0.917  -7.974
   85    H2'   DG   8           H2'        G   8  -6.457  -0.660  -5.689
   86   H2''   DG   8          H2''        G   8  -7.838  -1.811  -5.357
   87    H1'   DG   8           H1'        G   8  -6.510  -3.559  -5.318
   88    H8    DG   8           H8         G   8  -6.305  -1.493  -3.403
   89    H1    DG   8           H1         G   8  -0.245  -2.996  -3.375
   90    H21   DG   8           H21        G   8  -0.520  -4.204  -6.486
   91    H22   DG   8           H22        G   8   0.457  -4.028  -5.123
   92    H5'   DG   9           H5'        G   9  -7.500   2.293  -7.279
   93   H5''   DG   9          H5''        G   9  -8.293   3.074  -8.686
   94    H4'   DG   9           H4'        G   9  -6.267   3.371  -9.511
   95    H3'   DG   9           H3'        G   9  -6.426   0.401  -9.728
   96    H2'   DG   9           H2'        G   9  -4.208   0.126  -9.270
   97   H2''   DG   9          H2''        G   9  -3.835   1.272 -10.648
   98    H1'   DG   9           H1'        G   9  -3.867   3.074  -9.330
   99    H8    DG   9           H8         G   9  -1.379   1.133  -9.223
  100    H1    DG   9           H1         G   9  -1.741   3.207  -3.198
  101    H21   DG   9           H21        G   9  -3.861   3.887  -2.894
  102    H22   DG   9           H22        G   9  -5.103   3.832  -4.085
  103    H5'   DG  10           H5'        G  10  -5.890   5.495  -9.949
  104   H5''   DG  10          H5''        G  10  -5.244   5.645 -11.608
  105    H4'   DG  10           H4'        G  10  -3.796   6.992 -10.498
  106    H3'   DG  10           H3'        G  10  -2.677   4.307 -10.695
  107    H2'   DG  10           H2'        G  10  -2.225   4.199  -8.397
  108   H2''   DG  10          H2''        G  10  -0.853   5.295  -8.866
  109    H1'   DG  10           H1'        G  10  -2.197   7.195  -8.574
  110    H8    DG  10           H8         G  10  -4.124   7.197  -5.803
  111    H1    DG  10           H1         G  10   1.916   5.857  -4.213
  112    H21   DG  10           H21        G  10   2.925   4.984  -5.963
  113    H22   DG  10           H22        G  10   2.097   4.715  -7.469
  114    H5'   DT  11           H5'       DT  11   2.261   6.117 -12.343
  115   H5''   DT  11          H5''       DT  11   2.752   5.964 -10.645
  116    H4'   DT  11           H4'       DT  11   3.862   7.899 -11.455
  117    H3'   DT  11           H3'       DT  11   1.693   8.205  -9.547
  118    H2'   DT  11           H2'       DT  11   0.712  10.085 -10.255
  119   H2''   DT  11          H2''       DT  11   2.327  10.897 -10.382
  120    H1'   DT  11           H1'       DT  11   2.220  10.758 -12.601
  121    H3    DT  11           H3        DT  11  -1.981  12.135 -13.556
  122    H71   DT  11           H53       DT  11  -3.349   7.770 -14.206
  123    H72   DT  11           H51       DT  11  -1.785   6.950 -14.405
  124    H73   DT  11           H52       DT  11  -2.555   7.007 -12.811
  125    H6    DT  11           H6        DT  11   0.051   7.860 -12.729
  126    H5'   DT  12           H5'       DT  12   4.532  12.152  -8.055
  127   H5''   DT  12          H5''       DT  12   5.542  11.241  -9.196
  128    H4'   DT  12           H4'       DT  12   7.346  11.172  -7.454
  129    H3'   DT  12           H3'       DT  12   5.228  12.280  -5.812
  130    H2'   DT  12           H2'       DT  12   5.827  14.426  -5.653
  131   H2''   DT  12          H2''       DT  12   7.510  13.930  -5.204
  132    H1'   DT  12           H1'       DT  12   8.234  14.540  -7.221
  133    H3    DT  12           H3        DT  12   5.935  18.545  -7.299
  134    H71   DT  12           H53       DT  12   3.390  15.172 -10.497
  135    H72   DT  12           H51       DT  12   3.403  16.922 -10.817
  136    H73   DT  12           H52       DT  12   4.648  15.875 -11.528
  137    H6    DT  12           H6        DT  12   5.493  14.233  -9.374
  138    H5'   DA  13           H5'        A  13   6.201   7.906  -3.775
  139   H5''   DA  13          H5''        A  13   6.968   8.244  -2.211
  140    H4'   DA  13           H4'        A  13   8.271   6.468  -2.753
  141    H3'   DA  13           H3'        A  13   9.462   8.902  -3.795
  142    H2'   DA  13           H2'        A  13  10.153   8.242  -5.816
  143   H2''   DA  13          H2''        A  13  10.959   6.802  -5.070
  144    H1'   DA  13           H1'        A  13   9.362   5.463  -5.852
  145    H8    DA  13           H8         A  13   6.624   7.904  -6.598
  146    H61   DA  13           H61        A  13   8.287   7.521 -12.514
  147    H62   DA  13           H62        A  13   7.041   8.048 -11.405
  148    H2    DA  13           H2         A  13  11.521   5.628 -10.032
  149    H5'   DG  14           H5'        G  14  12.327   5.753  -0.409
  150   H5''   DG  14          H5''        G  14  11.656   4.129  -0.136
  151    H4'   DG  14           H4'        G  14  11.697   6.243   1.649
  152    H3'   DG  14           H3'        G  14  10.175   3.700   1.434
  153    H2'   DG  14           H2'        G  14   8.403   4.357   2.822
  154   H2''   DG  14          H2''        G  14   9.386   5.746   3.506
  155    H1'   DG  14           H1'        G  14   8.108   6.905   2.139
  156    H8    DG  14           H8         G  14   9.063   4.704  -0.839
  157    H1    DG  14           H1         G  14   2.995   6.642  -0.678
  158    H21   DG  14           H21        G  14   2.493   7.442   1.345
  159    H22   DG  14           H22        G  14   3.667   7.492   2.643
  160    H5'   DG  15           H5'        G  15   8.873   1.151   4.534
  161   H5''   DG  15          H5''        G  15   9.016   2.271   3.146
  162    H4'   DG  15           H4'        G  15   8.671   3.857   5.475
  163    H3'   DG  15           H3'        G  15   6.911   1.419   5.498
  164    H2'   DG  15           H2'        G  15   5.078   2.772   6.116
  165   H2''   DG  15          H2''        G  15   6.178   4.098   6.753
  166    H1'   DG  15           H1'        G  15   5.971   5.091   4.807
  167    H8    DG  15           H8         G  15   3.155   4.465   4.747
  168    H1    DG  15           H1         G  15   4.681   2.188  -1.020
  169    H21   DG  15           H21        G  15   6.854   1.585  -1.015
  170    H22   DG  15           H22        G  15   7.867   1.752   0.393
  171    H5'   DG  16           H5'        G  16   6.508  -1.824   7.742
  172   H5''   DG  16          H5''        G  16   7.471  -0.902   6.560
  173    H4'   DG  16           H4'        G  16   5.325   0.717   6.849
  174    H3'   DG  16           H3'        G  16   4.270  -2.003   7.494
  175    H2'   DG  16           H2'        G  16   2.517  -1.593   6.075
  176   H2''   DG  16          H2''        G  16   2.497   0.193   6.493
  177    H1'   DG  16           H1'        G  16   3.854   0.715   4.844
  178    H8    DG  16           H8         G  16   5.249  -1.834   2.889
  179    H1    DG  16           H1         G  16  -0.849  -0.932   1.367
  180    H21   DG  16           H21        G  16  -1.958   0.060   3.085
  181    H22   DG  16           H22        G  16  -1.120   0.460   4.572
  182    H5'   DT  17           H5'       DT  17   3.688  -3.693   8.781
  183   H5''   DT  17          H5''       DT  17   3.955  -3.782  10.533
  184    H4'   DT  17           H4'       DT  17   6.276  -4.201   8.664
  185    H3'   DT  17           H3'       DT  17   3.899  -5.885   8.768
  186    H2'   DT  17           H2'       DT  17   4.599  -7.550  10.082
  187   H2''   DT  17          H2''       DT  17   6.134  -7.678   9.130
  188    H1'   DT  17           H1'       DT  17   7.260  -6.700  10.781
  189    H3    DT  17           H3        DT  17   5.714  -9.107  14.317
  190    H71   DT  17           H53       DT  17   4.080  -4.286  15.091
  191    H72   DT  17           H51       DT  17   2.719  -4.730  14.046
  192    H73   DT  17           H52       DT  17   2.980  -5.589  15.583
  193    H6    DT  17           H6        DT  17   4.585  -4.879  12.335
  194    H5'   DT  18           H5'       DT  18   6.374  -7.773   3.601
  195   H5''   DT  18          H5''       DT  18   4.909  -8.562   4.218
  196    H4'   DT  18           H4'       DT  18   7.612  -9.697   4.908
  197    H3'   DT  18           H3'       DT  18   6.536  -9.473   2.211
  198    H2'   DT  18           H2'       DT  18   5.654 -11.504   1.915
  199   H2''   DT  18          H2''       DT  18   7.182 -12.266   2.519
  200    H1'   DT  18           H1'       DT  18   6.197 -12.776   4.447
  201    H3    DT  18           H3        DT  18   2.385 -14.698   2.890
  202    H71   DT  18           H53       DT  18   0.642 -10.038   3.380
  203    H72   DT  18           H51       DT  18   0.071 -11.045   4.724
  204    H73   DT  18           H52       DT  18   1.354  -9.841   4.992
  205    H6    DT  18           H6        DT  18   3.583 -10.307   4.428
  206    H5'   DA  19           H5'        A  19  10.987  -7.268   0.618
  207   H5''   DA  19          H5''        A  19   9.946  -6.657   1.921
  208    H4'   DA  19           H4'        A  19   8.917  -8.474  -0.278
  209    H3'   DA  19           H3'        A  19   9.645  -5.644  -0.423
  210    H2'   DA  19           H2'        A  19   7.625  -4.675  -0.414
  211   H2''   DA  19          H2''        A  19   6.958  -5.944  -1.521
  212    H1'   DA  19           H1'        A  19   5.871  -6.820   0.211
  213    H8    DA  19           H8         A  19   4.579  -4.732   1.212
  214    H61   DA  19           H61        A  19   7.305  -2.663   6.330
  215    H62   DA  19           H62        A  19   5.845  -2.627   5.367
  216    H2    DA  19           H2         A  19  10.170  -5.429   4.247
  217    H5'   DG  20           H5'        G  20   8.786  -3.723  -4.093
  218   H5''   DG  20          H5''        G  20   8.423  -4.837  -2.736
  219    H4'   DG  20           H4'        G  20   7.897  -6.470  -4.772
  220    H3'   DG  20           H3'        G  20   7.666  -3.722  -5.988
  221    H2'   DG  20           H2'        G  20   5.592  -4.134  -6.802
  222   H2''   DG  20          H2''        G  20   5.966  -5.912  -7.069
  223    H1'   DG  20           H1'        G  20   5.086  -6.448  -5.130
  224    H8    DG  20           H8         G  20   2.928  -4.970  -6.385
  225    H1    DG  20           H1         G  20   2.604  -2.556  -0.487
  226    H21   DG  20           H21        G  20   4.605  -2.668   0.463
  227    H22   DG  20           H22        G  20   5.998  -3.331  -0.359
  228    H5'   DG  21           H5'        G  21   7.293  -2.311  -7.945
  229   H5''   DG  21          H5''        G  21   8.510  -1.598  -9.056
  230    H4'   DG  21           H4'        G  21   9.085  -0.118  -7.502
  231    H3'   DG  21           H3'        G  21   9.470  -2.484  -5.779
  232    H2'   DG  21           H2'        G  21   8.382  -1.546  -4.022
  233   H2''   DG  21          H2''        G  21   9.608  -0.197  -4.084
  234    H1'   DG  21           H1'        G  21   8.330   1.079  -5.472
  235    H8    DG  21           H8         G  21   7.843   0.817  -2.454
  236    H1    DG  21           H1         G  21   1.896   1.784  -4.505
  237    H21   DG  21           H21        G  21   1.651   1.150  -6.620
  238    H22   DG  21           H22        G  21   2.989   0.483  -7.548
  239    H5'   DG  22           H5'        G  22  10.887   3.025  -8.326
  240   H5''   DG  22          H5''        G  22   9.800   2.621  -6.960
  241    H4'   DG  22           H4'        G  22   9.387   0.986  -9.376
  242    H3'   DG  22           H3'        G  22   9.281   3.969  -9.604
  243   HO3'   DG  22          H3T         G  22   9.977   3.482 -11.600
  244    H2'   DG  22           H2'        G  22   7.145   3.952 -10.510
  245   H2''   DG  22          H2''        G  22   7.343   2.228 -11.129
  246    H1'   DG  22           H1'        G  22   6.243   1.534  -9.365
  247    H8    DG  22           H8         G  22   4.240   3.419  -9.485
  248    H1    DG  22           H1         G  22   5.951   4.830  -3.527
  249    H21   DG  22           H21        G  22   8.078   4.281  -3.183
  250    H22   DG  22           H22        G  22   9.085   3.574  -4.427
  251    H45  RUL 101           H45      RUL  23  -0.823  -3.382   5.862
  252    H46  RUL 101           H46      RUL  23   1.185  -3.633   4.491
  253    H47  RUL 101           H47      RUL  23   1.030  -4.641   2.169
  254    H48  RUL 101           H48      RUL  23  -6.753  -5.126   4.047
  255    H49  RUL 101           H49      RUL  23  -7.276  -6.167   1.927
  256    H50  RUL 101           H50      RUL  23  -5.458  -6.533   0.253
  257    H51  RUL 101           H51      RUL  23  -5.658  -2.743   8.020
  258    H52  RUL 101           H52      RUL  23  -8.322  -2.813   8.311
  259    H53  RUL 101           H53      RUL  23  -9.149  -5.148   8.080
  260    H54  RUL 101           H54      RUL  23  -8.004  -6.800   6.586
  261    H55  RUL 101           H55      RUL  23  -1.862  -6.623   5.769
  262    H56  RUL 101           H56      RUL  23  -2.092  -8.722   7.260
  263    H57  RUL 101           H57      RUL  23  -4.295  -9.577   7.648
  264    H58  RUL 101           H58      RUL  23  -6.301  -8.383   6.742
  265    H59  RUL 101           H59      RUL  23  -5.077  -2.268   3.016
  266    H60  RUL 101           H60      RUL  23  -7.327  -1.618   3.861
  267    H61  RUL 101           H61      RUL  23  -7.381  -0.473   6.137
  268    H62  RUL 101           H62      RUL  23  -5.194   0.283   7.140
  269    H63  RUL 101           H63      RUL  23  -2.626  -4.973   8.358
  270    H64  RUL 101           H64      RUL  23  -1.357  -3.549  10.146
  271    H65  RUL 101           H65      RUL  23  -1.316  -1.197   9.855
  272    H66  RUL 101           H66      RUL  23  -2.420  -0.004   7.989
  273    H67  RUL 101           H67      RUL  23   2.725  -7.502  -5.332
  274    H68  RUL 101           H68      RUL  23   3.651  -6.514  -3.253
  275    H69  RUL 101           H69      RUL  23   2.145  -5.928  -1.364
  276    H70  RUL 101           H70      RUL  23  -3.505  -8.940  -6.187
  277    H71  RUL 101           H71      RUL  23  -5.260  -8.531  -4.497
  278    H72  RUL 101           H72      RUL  23  -4.615  -7.503  -2.273
  279    H73  RUL 101           H73      RUL  23   0.723  -8.102  -9.270
  280    H74  RUL 101           H74      RUL  23   2.926  -8.714 -10.566
  281    H75  RUL 101           H75      RUL  23   4.471 -10.051  -9.290
  282    H76  RUL 101           H76      RUL  23   4.391 -10.519  -6.946
  283    H77  RUL 101           H77      RUL  23  -1.344 -10.719  -4.686
  284    H78  RUL 101           H78      RUL  23  -0.052 -12.421  -3.098
  285    H79  RUL 101           H79      RUL  23   2.592 -12.193  -3.247
  286    H80  RUL 101           H80      RUL  23   3.600 -11.093  -4.932
  287    H81  RUL 101           H81      RUL  23  -0.594 -11.358  -7.599
  288    H82  RUL 101           H82      RUL  23  -2.896 -12.341  -8.387
  289    H83  RUL 101           H83      RUL  23  -4.504 -10.817  -9.218
  290    H84  RUL 101           H84      RUL  23  -4.181  -8.319  -9.275
  291    H85  RUL 101           H85      RUL  23   1.028  -5.627  -7.260
  292    H86  RUL 101           H86      RUL  23   1.043  -4.568  -9.425
  293    H87  RUL 101           H87      RUL  23  -1.051  -4.927 -10.993
  294    H88  RUL 101           H88      RUL  23  -2.890  -6.458 -10.142
  Start of MODEL    4
    1    H5'   DA   1           H5'        A   1  -0.496  14.953   9.325
    2   H5''   DA   1          H5''        A   1  -1.435  16.389   9.783
    3    H4'   DA   1           H4'        A   1  -3.245  15.638   8.224
    4    H3'   DA   1           H3'        A   1  -1.562  13.268   8.091
    5    H2'   DA   1           H2'        A   1  -0.690  13.445   6.042
    6   H2''   DA   1          H2''        A   1  -2.326  13.811   5.356
    7    H1'   DA   1           H1'        A   1  -1.747  15.948   5.115
    8    H8    DA   1           H8         A   1   1.003  16.597   7.460
    9    H61   DA   1           H61        A   1   4.976  15.537   2.877
   10    H62   DA   1           H62        A   1   4.780  16.218   4.476
   11    H2    DA   1           H2         A   1   0.943  14.016   1.604
   12   HO5'   DA   1          H5T         A   1  -1.590  13.933  10.764
   13    H5'   DG   2           H5'        G   2  -2.175   9.879   6.308
   14   H5''   DG   2          H5''        G   2  -1.941  11.645   6.517
   15    H4'   DG   2           H4'        G   2  -3.424  12.027   4.616
   16    H3'   DG   2           H3'        G   2  -3.777   9.032   4.677
   17    H2'   DG   2           H2'        G   2  -3.785   8.942   2.380
   18   H2''   DG   2          H2''        G   2  -4.410  10.662   2.220
   19    H1'   DG   2           H1'        G   2  -2.355  11.404   2.003
   20    H8    DG   2           H8         G   2   0.285   9.452   3.261
   21    H1    DG   2           H1         G   2  -1.335   7.580  -2.594
   22    H21   DG   2           H21        G   2  -3.379   8.169  -3.090
   23    H22   DG   2           H22        G   2  -4.389   9.052  -1.953
   24    H5'   DG   3           H5'        G   3  -6.259   6.292   3.703
   25   H5''   DG   3          H5''        G   3  -4.780   7.299   3.768
   26    H4'   DG   3           H4'        G   3  -5.726   7.767   1.237
   27    H3'   DG   3           H3'        G   3  -6.422   4.917   1.934
   28    H2'   DG   3           H2'        G   3  -5.545   4.224  -0.023
   29   H2''   DG   3          H2''        G   3  -6.114   5.730  -0.892
   30    H1'   DG   3           H1'        G   3  -4.262   6.834  -0.464
   31    H8    DG   3           H8         G   3  -4.086   4.546  -2.168
   32    H1    DG   3           H1         G   3   1.509   3.739   0.678
   33    H21   DG   3           H21        G   3   1.548   4.606   2.697
   34    H22   DG   3           H22        G   3   0.155   5.422   3.399
   35    H5'   DG   4           H5'        G   4  -7.642   3.457   0.839
   36   H5''   DG   4          H5''        G   4  -9.004   2.308   1.010
   37    H4'   DG   4           H4'        G   4  -8.564   1.860   3.122
   38    H3'   DG   4           H3'        G   4  -7.827   4.640   3.595
   39    H2'   DG   4           H2'        G   4  -5.668   4.180   4.146
   40   H2''   DG   4          H2''        G   4  -6.382   3.297   5.576
   41    H1'   DG   4           H1'        G   4  -6.373   1.306   4.485
   42    H8    DG   4           H8         G   4  -3.474   2.232   5.482
   43    H1    DG   4           H1         G   4  -2.522  -1.053   0.049
   44    H21   DG   4           H21        G   4  -4.425  -0.711  -1.154
   45    H22   DG   4           H22        G   4  -5.826   0.119  -0.589
   46    H5'   DT   5           H5'       DT   5 -11.066   2.990   1.371
   47   H5''   DT   5          H5''       DT   5 -12.288   2.226   2.401
   48    H4'   DT   5           H4'       DT   5 -10.190   0.463   1.139
   49    H3'   DT   5           H3'       DT   5 -11.797   2.080  -0.494
   50    H2'   DT   5           H2'       DT   5 -13.745   0.978  -0.521
   51   H2''   DT   5          H2''       DT   5 -12.873  -0.383  -1.332
   52    H1'   DT   5           H1'       DT   5 -12.936  -1.627   0.517
   53    H3    DT   5           H3        DT   5 -15.947   1.363   3.632
   54    H71   DT   5           H53       DT   5 -17.355  -3.253   1.744
   55    H72   DT   5           H51       DT   5 -18.611  -2.009   1.922
   56    H73   DT   5           H52       DT   5 -17.855  -2.298   0.337
   57    H6    DT   5           H6        DT   5 -15.262  -2.076   0.349
   58    H5'   DT   6           H5'       DT   6  -8.100  -3.057   0.000
   59   H5''   DT   6          H5''       DT   6  -7.693  -1.920  -1.299
   60    H4'   DT   6           H4'       DT   6  -9.180  -3.244  -2.836
   61    H3'   DT   6           H3'       DT   6  -9.806  -4.675  -0.356
   62    H2'   DT   6           H2'       DT   6  -8.371  -6.410  -0.773
   63   H2''   DT   6          H2''       DT   6  -9.565  -6.846  -2.080
   64    H1'   DT   6           H1'       DT   6  -8.430  -5.611  -3.662
   65    H3    DT   6           H3        DT   6  -6.655  -9.789  -3.949
   66    H71   DT   6           H53       DT   6  -3.082  -5.694  -3.927
   67    H72   DT   6           H51       DT   6  -3.018  -6.984  -5.145
   68    H73   DT   6           H52       DT   6  -2.415  -7.254  -3.555
   69    H6    DT   6           H6        DT   6  -5.149  -5.372  -2.813
   70    H5'   DA   7           H5'        A   7 -10.678  -7.381  -5.666
   71   H5''   DA   7          H5''        A   7  -9.132  -7.959  -5.025
   72    H4'   DA   7           H4'        A   7  -9.539  -5.129  -5.981
   73    H3'   DA   7           H3'        A   7  -9.518  -7.462  -7.647
   74    H2'   DA   7           H2'        A   7  -7.230  -7.846  -7.342
   75   H2''   DA   7          H2''        A   7  -7.169  -6.661  -8.731
   76    H1'   DA   7           H1'        A   7  -7.095  -4.902  -7.250
   77    H8    DA   7           H8         A   7  -4.814  -4.744  -4.892
   78    H61   DA   7           H61        A   7  -0.388  -5.997  -8.969
   79    H62   DA   7           H62        A   7  -0.808  -5.127  -7.511
   80    H2    DA   7           H2         A   7  -4.152  -7.976 -10.424
   81    H5'   DG   8           H5'        G   8  -6.473  -1.941  -9.111
   82   H5''   DG   8          H5''        G   8  -6.048  -3.636  -8.714
   83    H4'   DG   8           H4'        G   8  -7.620  -2.892  -6.569
   84    H3'   DG   8           H3'        G   8  -6.028  -0.468  -7.249
   85    H2'   DG   8           H2'        G   8  -5.917  -0.208  -4.909
   86   H2''   DG   8          H2''        G   8  -7.462  -1.154  -4.660
   87    H1'   DG   8           H1'        G   8  -6.365  -3.054  -4.526
   88    H8    DG   8           H8         G   8  -5.691  -0.993  -2.795
   89    H1    DG   8           H1         G   8   0.154  -3.256  -3.011
   90    H21   DG   8           H21        G   8  -0.417  -4.550  -6.053
   91    H22   DG   8           H22        G   8   0.628  -4.478  -4.695
   92    H5'   DG   9           H5'        G   9  -6.524   1.650  -6.977
   93   H5''   DG   9          H5''        G   9  -7.002   3.286  -7.461
   94    H4'   DG   9           H4'        G   9  -5.814   3.169  -9.404
   95    H3'   DG   9           H3'        G   9  -6.199   0.232  -9.329
   96    H2'   DG   9           H2'        G   9  -4.060  -0.360  -9.380
   97   H2''   DG   9          H2''        G   9  -3.851   0.639 -10.898
   98    H1'   DG   9           H1'        G   9  -3.087   2.385  -9.802
   99    H8    DG   9           H8         G   9  -0.985   0.218  -9.631
  100    H1    DG   9           H1         G   9  -0.730   2.674  -3.715
  101    H21   DG   9           H21        G   9  -2.732   3.585  -3.302
  102    H22   DG   9           H22        G   9  -4.066   3.588  -4.405
  103    H5'   DG  10           H5'        G  10  -7.182   5.752 -10.240
  104   H5''   DG  10          H5''        G  10  -6.532   5.543 -11.891
  105    H4'   DG  10           H4'        G  10  -4.894   6.816 -10.928
  106    H3'   DG  10           H3'        G  10  -4.269   3.976 -10.744
  107    H2'   DG  10           H2'        G  10  -3.522   4.146  -8.572
  108   H2''   DG  10          H2''        G  10  -2.108   5.010  -9.324
  109    H1'   DG  10           H1'        G  10  -3.206   7.049  -9.128
  110    H8    DG  10           H8         G  10  -4.879   7.417  -6.188
  111    H1    DG  10           H1         G  10   1.131   5.592  -4.996
  112    H21   DG  10           H21        G  10   1.948   4.527  -6.734
  113    H22   DG  10           H22        G  10   1.021   4.244  -8.187
  114    H5'   DT  11           H5'       DT  11  -3.461   9.579 -11.098
  115   H5''   DT  11          H5''       DT  11  -2.083   9.059 -12.088
  116    H4'   DT  11           H4'       DT  11  -0.810  10.362 -10.771
  117    H3'   DT  11           H3'       DT  11  -1.178   7.881  -9.338
  118    H2'   DT  11           H2'       DT  11  -1.704   8.574  -7.280
  119   H2''   DT  11          H2''       DT  11  -0.275   9.688  -7.290
  120    H1'   DT  11           H1'       DT  11  -1.637  11.435  -7.514
  121    H3    DT  11           H3        DT  11  -4.782  10.421  -4.377
  122    H71   DT  11           H53       DT  11  -7.551   8.775  -7.828
  123    H72   DT  11           H51       DT  11  -7.506  10.401  -8.530
  124    H73   DT  11           H52       DT  11  -6.591   9.085  -9.293
  125    H6    DT  11           H6        DT  11  -4.418   9.875  -9.137
  126    H5'   DT  12           H5'       DT  12   3.374   9.168  -6.514
  127   H5''   DT  12          H5''       DT  12   2.165  10.468  -6.557
  128    H4'   DT  12           H4'       DT  12   4.885  10.948  -7.748
  129    H3'   DT  12           H3'       DT  12   4.382  10.334  -4.941
  130    H2'   DT  12           H2'       DT  12   4.388  12.379  -4.041
  131   H2''   DT  12          H2''       DT  12   5.899  12.795  -4.948
  132    H1'   DT  12           H1'       DT  12   4.727  14.062  -6.352
  133    H3    DT  12           H3        DT  12   2.246  16.455  -3.385
  134    H71   DT  12           H53       DT  12  -0.752  12.640  -5.803
  135    H72   DT  12           H51       DT  12  -1.130  12.973  -4.101
  136    H73   DT  12           H52       DT  12  -1.474  14.198  -5.335
  137    H6    DT  12           H6        DT  12   1.511  12.498  -6.009
  138    H5'   DA  13           H5'        A  13   6.202   6.975  -4.652
  139   H5''   DA  13          H5''        A  13   7.092   7.557  -3.231
  140    H4'   DA  13           H4'        A  13   8.264   5.625  -3.618
  141    H3'   DA  13           H3'        A  13   9.520   7.938  -4.834
  142    H2'   DA  13           H2'        A  13  10.195   7.118  -6.801
  143   H2''   DA  13          H2''        A  13  10.959   5.712  -5.951
  144    H1'   DA  13           H1'        A  13   9.331   4.369  -6.656
  145    H8    DA  13           H8         A  13   6.691   6.901  -7.524
  146    H61   DA  13           H61        A  13   8.187   5.971 -13.423
  147    H62   DA  13           H62        A  13   7.001   6.656 -12.334
  148    H2    DA  13           H2         A  13  11.357   4.070 -10.866
  149    H5'   DG  14           H5'        G  14  11.904   3.479  -0.655
  150   H5''   DG  14          H5''        G  14  10.323   3.484  -1.472
  151    H4'   DG  14           H4'        G  14  11.382   5.484   0.576
  152    H3'   DG  14           H3'        G  14   9.664   3.058   0.758
  153    H2'   DG  14           H2'        G  14   7.959   4.084   1.966
  154   H2''   DG  14          H2''        G  14   9.079   5.437   2.504
  155    H1'   DG  14           H1'        G  14   8.083   6.626   0.950
  156    H8    DG  14           H8         G  14   8.256   4.131  -1.863
  157    H1    DG  14           H1         G  14   2.548   6.771  -0.942
  158    H21   DG  14           H21        G  14   2.427   7.689   1.080
  159    H22   DG  14           H22        G  14   3.768   7.647   2.207
  160    H5'   DG  15           H5'        G  15   9.219   0.576   3.878
  161   H5''   DG  15          H5''        G  15   9.166   1.740   2.523
  162    H4'   DG  15           H4'        G  15   9.813   3.117   4.978
  163    H3'   DG  15           H3'        G  15   7.534   1.163   5.162
  164    H2'   DG  15           H2'        G  15   6.167   2.724   6.223
  165   H2''   DG  15          H2''        G  15   7.592   3.832   6.611
  166    H1'   DG  15           H1'        G  15   6.997   4.922   4.801
  167    H8    DG  15           H8         G  15   4.198   4.558   4.840
  168    H1    DG  15           H1         G  15   5.219   1.789  -0.813
  169    H21   DG  15           H21        G  15   7.290   0.989  -0.898
  170    H22   DG  15           H22        G  15   8.409   1.138   0.437
  171    H5'   DG  16           H5'        G  16   9.239  -1.950   7.273
  172   H5''   DG  16          H5''        G  16   8.845  -2.339   5.573
  173    H4'   DG  16           H4'        G  16   7.704   0.032   7.040
  174    H3'   DG  16           H3'        G  16   6.627  -2.763   7.102
  175    H2'   DG  16           H2'        G  16   4.458  -1.852   6.981
  176   H2''   DG  16          H2''        G  16   5.051  -0.204   7.573
  177    H1'   DG  16           H1'        G  16   5.216   0.444   5.488
  178    H8    DG  16           H8         G  16   6.134  -2.385   3.306
  179    H1    DG  16           H1         G  16   0.122  -0.368   2.880
  180    H21   DG  16           H21        G  16  -0.446   0.738   4.701
  181    H22   DG  16           H22        G  16   0.678   0.955   6.026
  182    H5'   DT  17           H5'       DT  17   7.623  -4.824  10.922
  183   H5''   DT  17          H5''       DT  17   8.919  -4.873   9.710
  184    H4'   DT  17           H4'       DT  17   8.306  -6.959   9.181
  185    H3'   DT  17           H3'       DT  17   6.176  -5.341   8.058
  186    H2'   DT  17           H2'       DT  17   4.347  -6.433   8.734
  187   H2''   DT  17          H2''       DT  17   5.065  -8.002   8.182
  188    H1'   DT  17           H1'       DT  17   5.415  -8.585  10.301
  189    H3    DT  17           H3        DT  17   4.125  -4.513  13.296
  190    H71   DT  17           H53       DT  17   0.506  -7.442  13.205
  191    H72   DT  17           H51       DT  17   0.275  -7.267  11.454
  192    H73   DT  17           H52       DT  17   1.045  -8.727  12.099
  193    H6    DT  17           H6        DT  17   2.951  -8.339  10.637
  194    H5'   DT  18           H5'       DT  18   6.221  -9.739   7.090
  195   H5''   DT  18          H5''       DT  18   7.924  -9.861   6.604
  196    H4'   DT  18           H4'       DT  18   7.474 -11.834   5.648
  197    H3'   DT  18           H3'       DT  18   6.245  -9.922   3.842
  198    H2'   DT  18           H2'       DT  18   4.247 -10.850   3.470
  199   H2''   DT  18          H2''       DT  18   5.035 -12.450   3.154
  200    H1'   DT  18           H1'       DT  18   4.312 -13.199   5.122
  201    H3    DT  18           H3        DT  18  -0.006 -11.716   4.912
  202    H71   DT  18           H53       DT  18   1.152  -9.129   8.719
  203    H72   DT  18           H51       DT  18   2.904  -8.902   8.508
  204    H73   DT  18           H52       DT  18   1.759  -7.941   7.552
  205    H6    DT  18           H6        DT  18   4.047 -10.174   6.984
  206    H5'   DA  19           H5'        A  19   9.646 -10.969  -0.592
  207   H5''   DA  19          H5''        A  19  10.325 -10.106   0.803
  208    H4'   DA  19           H4'        A  19   7.938  -9.292  -0.888
  209    H3'   DA  19           H3'        A  19  10.758  -8.631  -0.923
  210    H2'   DA  19           H2'        A  19  10.798  -6.686   0.171
  211   H2''   DA  19          H2''        A  19   9.477  -6.059  -0.891
  212    H1'   DA  19           H1'        A  19   8.019  -6.237   0.775
  213    H8    DA  19           H8         A  19  10.228  -8.608   2.811
  214    H61   DA  19           H61        A  19  10.930  -3.908   6.728
  215    H62   DA  19           H62        A  19  11.187  -5.621   6.482
  216    H2    DA  19           H2         A  19   8.860  -2.360   3.052
  217    H5'   DG  20           H5'        G  20   8.613  -4.837  -4.074
  218   H5''   DG  20          H5''        G  20   8.423  -6.108  -2.823
  219    H4'   DG  20           H4'        G  20   7.250  -7.397  -4.773
  220    H3'   DG  20           H3'        G  20   7.160  -4.542  -5.751
  221    H2'   DG  20           H2'        G  20   4.951  -4.817  -6.364
  222   H2''   DG  20          H2''        G  20   5.155  -6.628  -6.617
  223    H1'   DG  20           H1'        G  20   4.501  -7.023  -4.559
  224    H8    DG  20           H8         G  20   2.389  -5.227  -5.604
  225    H1    DG  20           H1         G  20   2.994  -2.719   0.218
  226    H21   DG  20           H21        G  20   5.056  -3.089   0.999
  227    H22   DG  20           H22        G  20   6.261  -3.972   0.090
  228    H5'   DG  21           H5'        G  21   6.922  -3.741  -7.781
  229   H5''   DG  21          H5''        G  21   7.622  -2.823  -9.149
  230    H4'   DG  21           H4'        G  21   8.767  -1.460  -7.798
  231    H3'   DG  21           H3'        G  21   9.257  -3.708  -5.949
  232    H2'   DG  21           H2'        G  21   8.378  -2.626  -4.193
  233   H2''   DG  21          H2''        G  21   9.699  -1.397  -4.429
  234    H1'   DG  21           H1'        G  21   8.403  -0.096  -5.803
  235    H8    DG  21           H8         G  21   8.285  -0.172  -2.697
  236    H1    DG  21           H1         G  21   2.298   1.387  -4.154
  237    H21   DG  21           H21        G  21   1.754   0.666  -6.232
  238    H22   DG  21           H22        G  21   2.928  -0.174  -7.231
  239    H5'   DG  22           H5'        G  22  10.137   1.510  -9.029
  240   H5''   DG  22          H5''        G  22   9.354   1.381  -7.428
  241    H4'   DG  22           H4'        G  22   7.981  -0.228  -9.435
  242    H3'   DG  22           H3'        G  22   8.533   2.624 -10.198
  243   HO3'   DG  22          H3T         G  22   8.066   1.403 -12.284
  244    H2'   DG  22           H2'        G  22   6.307   2.967 -10.692
  245   H2''   DG  22          H2''        G  22   6.081   1.212 -11.201
  246    H1'   DG  22           H1'        G  22   5.350   0.654  -9.210
  247    H8    DG  22           H8         G  22   3.388   2.678  -9.687
  248    H1    DG  22           H1         G  22   5.111   4.529  -3.851
  249    H21   DG  22           H21        G  22   7.234   3.866  -3.456
  250    H22   DG  22           H22        G  22   8.173   2.993  -4.637
  251    H45  RUL 101           H45      RUL  23  -3.632  -1.445   5.956
  252    H46  RUL 101           H46      RUL  23  -1.249  -1.467   5.439
  253    H47  RUL 101           H47      RUL  23  -0.337  -3.000   3.630
  254    H48  RUL 101           H48      RUL  23  -7.981  -5.302   3.254
  255    H49  RUL 101           H49      RUL  23  -7.486  -6.907   1.482
  256    H50  RUL 101           H50      RUL  23  -5.138  -7.083   0.642
  257    H51  RUL 101           H51      RUL  23  -9.234  -3.358   3.967
  258    H52  RUL 101           H52      RUL  23 -11.437  -3.475   5.420
  259    H53  RUL 101           H53      RUL  23 -11.283  -5.026   7.338
  260    H54  RUL 101           H54      RUL  23  -9.115  -5.515   8.438
  261    H55  RUL 101           H55      RUL  23  -3.634  -5.414   5.783
  262    H56  RUL 101           H56      RUL  23  -4.076  -7.968   6.258
  263    H57  RUL 101           H57      RUL  23  -5.698  -8.359   8.004
  264    H58  RUL 101           H58      RUL  23  -6.983  -6.327   8.910
  265    H59  RUL 101           H59      RUL  23  -6.506  -2.133   2.043
  266    H60  RUL 101           H60      RUL  23  -8.642  -1.176   1.277
  267    H61  RUL 101           H61      RUL  23 -10.348  -0.684   3.093
  268    H62  RUL 101           H62      RUL  23  -9.500   0.215   5.239
  269    H63  RUL 101           H63      RUL  23  -5.055  -3.007   8.089
  270    H64  RUL 101           H64      RUL  23  -5.527  -1.230   9.936
  271    H65  RUL 101           H65      RUL  23  -6.962   0.569   9.406
  272    H66  RUL 101           H66      RUL  23  -8.114   0.837   7.246
  273    H67  RUL 101           H67      RUL  23   3.917  -7.594  -2.429
  274    H68  RUL 101           H68      RUL  23   4.270  -6.158  -0.456
  275    H69  RUL 101           H69      RUL  23   2.307  -5.161   0.735
  276    H70  RUL 101           H70      RUL  23  -1.736 -10.537  -3.606
  277    H71  RUL 101           H71      RUL  23  -3.799 -10.031  -2.400
  278    H72  RUL 101           H72      RUL  23  -3.770  -8.219  -0.647
  279    H73  RUL 101           H73      RUL  23   2.935 -10.146  -6.027
  280    H74  RUL 101           H74      RUL  23   5.491 -10.434  -6.599
  281    H75  RUL 101           H75      RUL  23   6.838 -10.929  -4.654
  282    H76  RUL 101           H76      RUL  23   6.253 -10.532  -2.363
  283    H77  RUL 101           H77      RUL  23   0.193 -10.966  -1.166
  284    H78  RUL 101           H78      RUL  23   1.287 -11.837   1.099
  285    H79  RUL 101           H79      RUL  23   3.872 -11.251   1.301
  286    H80  RUL 101           H80      RUL  23   5.097 -10.621  -0.479
  287    H81  RUL 101           H81      RUL  23   1.889 -12.497  -3.292
  288    H82  RUL 101           H82      RUL  23   0.462 -14.479  -4.215
  289    H83  RUL 101           H83      RUL  23  -1.079 -14.018  -5.937
  290    H84  RUL 101           H84      RUL  23  -1.489 -11.727  -6.887
  291    H85  RUL 101           H85      RUL  23   2.633  -7.414  -5.655
  292    H86  RUL 101           H86      RUL  23   2.071  -6.783  -7.935
  293    H87  RUL 101           H87      RUL  23  -0.032  -7.947  -9.050
  294    H88  RUL 101           H88      RUL  23  -1.429  -9.495  -7.576
  Start of MODEL    5
    1    H5'   DA   1           H5'        A   1  -3.575  16.061   8.068
    2   H5''   DA   1          H5''        A   1  -4.916  15.311   7.177
    3    H4'   DA   1           H4'        A   1  -3.872  13.204   7.133
    4    H3'   DA   1           H3'        A   1  -2.717  14.067   9.657
    5    H2'   DA   1           H2'        A   1  -0.547  14.192   9.146
    6   H2''   DA   1          H2''        A   1  -0.618  12.529   8.432
    7    H1'   DA   1           H1'        A   1  -0.521  13.377   6.376
    8    H8    DA   1           H8         A   1  -1.485  16.918   6.668
    9    H61   DA   1           H61        A   1   4.494  18.344   7.029
   10    H62   DA   1           H62        A   1   2.884  18.970   6.748
   11    H2    DA   1           H2         A   1   4.076  13.917   7.679
   12   HO5'   DA   1          H5T         A   1  -4.250  15.137   9.907
   13    H5'   DG   2           H5'        G   2  -2.924   9.598   6.819
   14   H5''   DG   2          H5''        G   2  -2.679  11.354   7.099
   15    H4'   DG   2           H4'        G   2  -4.447  11.780   5.418
   16    H3'   DG   2           H3'        G   2  -4.511   8.769   5.259
   17    H2'   DG   2           H2'        G   2  -4.775   8.848   2.970
   18   H2''   DG   2          H2''        G   2  -5.498  10.539   3.015
   19    H1'   DG   2           H1'        G   2  -3.506  11.373   2.615
   20    H8    DG   2           H8         G   2  -0.711   9.538   3.740
   21    H1    DG   2           H1         G   2  -2.373   7.806  -2.141
   22    H21   DG   2           H21        G   2  -4.451   8.279  -2.574
   23    H22   DG   2           H22        G   2  -5.490   9.053  -1.383
   24    H5'   DG   3           H5'        G   3  -6.887   5.773   4.566
   25   H5''   DG   3          H5''        G   3  -5.500   6.894   4.669
   26    H4'   DG   3           H4'        G   3  -6.462   7.608   2.288
   27    H3'   DG   3           H3'        G   3  -7.575   4.849   2.676
   28    H2'   DG   3           H2'        G   3  -6.627   4.106   0.804
   29   H2''   DG   3          H2''        G   3  -7.161   5.606  -0.086
   30    H1'   DG   3           H1'        G   3  -5.307   6.730   0.383
   31    H8    DG   3           H8         G   3  -5.287   4.552  -1.568
   32    H1    DG   3           H1         G   3   0.619   3.716   0.642
   33    H21   DG   3           H21        G   3   0.797   4.455   2.721
   34    H22   DG   3           H22        G   3  -0.543   5.163   3.608
   35    H5'   DG   4           H5'        G   4  -9.769   2.833   1.401
   36   H5''   DG   4          H5''        G   4 -11.124   2.687   2.572
   37    H4'   DG   4           H4'        G   4  -9.720   1.422   3.709
   38    H3'   DG   4           H3'        G   4  -8.837   4.171   4.340
   39    H2'   DG   4           H2'        G   4  -6.600   3.620   4.210
   40   H2''   DG   4          H2''        G   4  -6.918   2.557   5.631
   41    H1'   DG   4           H1'        G   4  -7.412   0.742   4.296
   42    H8    DG   4           H8         G   4  -4.628   1.786   5.043
   43    H1    DG   4           H1         G   4  -3.432  -1.300  -0.385
   44    H21   DG   4           H21        G   4  -5.420  -1.012  -1.618
   45    H22   DG   4           H22        G   4  -6.861  -0.295  -1.055
   46    H5'   DT   5           H5'       DT   5 -12.000   0.846   4.533
   47   H5''   DT   5          H5''       DT   5 -11.708  -0.233   5.911
   48    H4'   DT   5           H4'       DT   5 -12.288  -1.891   4.498
   49    H3'   DT   5           H3'       DT   5  -9.465  -1.323   4.077
   50    H2'   DT   5           H2'       DT   5  -9.351  -1.400   1.845
   51   H2''   DT   5          H2''       DT   5 -10.137  -3.032   1.881
   52    H1'   DT   5           H1'       DT   5 -12.085  -2.189   1.210
   53    H3    DT   5           H3        DT   5 -11.448   2.790  -0.031
   54    H71   DT   5           H53       DT   5  -9.592   0.386  -3.553
   55    H72   DT   5           H51       DT   5  -9.320  -1.226  -2.849
   56    H73   DT   5           H52       DT   5 -10.888  -0.824  -3.572
   57    H6    DT   5           H6        DT   5 -10.531  -1.860  -0.815
   58    H5'   DT   6           H5'       DT   6 -13.504  -3.664   2.021
   59   H5''   DT   6          H5''       DT   6 -13.301  -5.418   2.100
   60    H4'   DT   6           H4'       DT   6 -13.126  -3.639  -0.214
   61    H3'   DT   6           H3'       DT   6 -14.111  -6.216   0.221
   62    H2'   DT   6           H2'       DT   6 -11.924  -7.095   0.498
   63   H2''   DT   6          H2''       DT   6 -12.310  -7.499  -1.233
   64    H1'   DT   6           H1'       DT   6 -11.325  -5.464  -1.960
   65    H3    DT   6           H3        DT   6  -8.301  -8.879  -2.266
   66    H71   DT   6           H53       DT   6  -6.465  -4.380   0.075
   67    H72   DT   6           H51       DT   6  -6.457  -4.160  -1.670
   68    H73   DT   6           H52       DT   6  -5.380  -5.339  -0.948
   69    H6    DT   6           H6        DT   6  -8.700  -4.652  -0.086
   70    H5'   DA   7           H5'        A   7 -11.994  -6.932  -5.251
   71   H5''   DA   7          H5''        A   7 -10.902  -7.858  -4.204
   72    H4'   DA   7           H4'        A   7 -10.320  -4.957  -4.559
   73    H3'   DA   7           H3'        A   7 -10.430  -6.694  -6.948
   74    H2'   DA   7           H2'        A   7  -8.266  -7.383  -6.605
   75   H2''   DA   7          H2''        A   7  -7.904  -5.764  -7.341
   76    H1'   DA   7           H1'        A   7  -7.963  -4.757  -5.110
   77    H8    DA   7           H8         A   7  -5.758  -5.851  -3.078
   78    H61   DA   7           H61        A   7  -1.436  -5.133  -7.300
   79    H62   DA   7           H62        A   7  -1.841  -4.978  -5.608
   80    H2    DA   7           H2         A   7  -5.213  -6.388  -9.404
   81    H5'   DG   8           H5'        G   8  -7.167  -2.781  -9.426
   82   H5''   DG   8          H5''        G   8  -5.959  -4.096  -9.250
   83    H4'   DG   8           H4'        G   8  -7.345  -3.686  -6.902
   84    H3'   DG   8           H3'        G   8  -6.268  -1.056  -7.755
   85    H2'   DG   8           H2'        G   8  -5.896  -0.710  -5.505
   86   H2''   DG   8          H2''        G   8  -7.333  -1.736  -5.015
   87    H1'   DG   8           H1'        G   8  -6.126  -3.564  -4.996
   88    H8    DG   8           H8         G   8  -5.904  -1.526  -3.268
   89    H1    DG   8           H1         G   8   0.133  -3.090  -2.717
   90    H21   DG   8           H21        G   8   0.029  -4.371  -5.799
   91    H22   DG   8           H22        G   8   0.909  -4.162  -4.368
   92    H5'   DG   9           H5'        G   9  -6.957   1.939  -6.508
   93   H5''   DG   9          H5''        G   9  -8.053   3.124  -7.291
   94    H4'   DG   9           H4'        G   9  -6.627   3.362  -8.952
   95    H3'   DG   9           H3'        G   9  -6.949   0.469  -9.188
   96    H2'   DG   9           H2'        G   9  -4.737  -0.111  -9.023
   97   H2''   DG   9          H2''        G   9  -4.468   0.881 -10.543
   98    H1'   DG   9           H1'        G   9  -3.789   2.660  -9.444
   99    H8    DG   9           H8         G   9  -1.539   0.695  -9.160
  100    H1    DG   9           H1         G   9  -1.928   3.017  -3.218
  101    H21   DG   9           H21        G   9  -4.057   3.730  -2.908
  102    H22   DG   9           H22        G   9  -5.289   3.619  -4.119
  103    H5'   DG  10           H5'        G  10  -7.872   5.104  -9.445
  104   H5''   DG  10          H5''        G  10  -7.932   6.110 -10.920
  105    H4'   DG  10           H4'        G  10  -5.918   6.989 -10.469
  106    H3'   DG  10           H3'        G  10  -5.121   4.167 -10.333
  107    H2'   DG  10           H2'        G  10  -4.273   4.390  -8.187
  108   H2''   DG  10          H2''        G  10  -2.978   5.380  -9.002
  109    H1'   DG  10           H1'        G  10  -4.192   7.320  -8.696
  110    H8    DG  10           H8         G  10  -5.861   7.494  -5.735
  111    H1    DG  10           H1         G  10   0.263   6.077  -4.572
  112    H21   DG  10           H21        G  10   1.169   5.124  -6.323
  113    H22   DG  10           H22        G  10   0.273   4.796  -7.780
  114    H5'   DT  11           H5'       DT  11  -0.866   6.687 -13.263
  115   H5''   DT  11          H5''       DT  11   0.104   5.567 -12.287
  116    H4'   DT  11           H4'       DT  11   1.467   7.371 -12.068
  117    H3'   DT  11           H3'       DT  11  -0.484   7.328  -9.922
  118    H2'   DT  11           H2'       DT  11  -1.037   9.488  -9.749
  119   H2''   DT  11          H2''       DT  11   0.716   9.946  -9.740
  120    H1'   DT  11           H1'       DT  11   0.534  10.717 -11.819
  121    H3    DT  11           H3        DT  11  -3.283  13.169 -11.465
  122    H71   DT  11           H53       DT  11  -5.663   9.862 -13.670
  123    H72   DT  11           H51       DT  11  -4.359   9.374 -14.770
  124    H73   DT  11           H52       DT  11  -4.706   8.401 -13.330
  125    H6    DT  11           H6        DT  11  -2.221   8.729 -12.965
  126    H5'   DT  12           H5'       DT  12   4.367   7.765  -6.306
  127   H5''   DT  12          H5''       DT  12   3.343   9.214  -6.264
  128    H4'   DT  12           H4'       DT  12   5.833   9.087  -7.978
  129    H3'   DT  12           H3'       DT  12   5.700   9.144  -5.068
  130    H2'   DT  12           H2'       DT  12   6.019  11.316  -4.653
  131   H2''   DT  12          H2''       DT  12   7.429  11.340  -5.790
  132    H1'   DT  12           H1'       DT  12   6.214  12.423  -7.306
  133    H3    DT  12           H3        DT  12   4.418  15.728  -4.772
  134    H71   DT  12           H53       DT  12   0.807  12.165  -4.291
  135    H72   DT  12           H51       DT  12   0.273  13.646  -5.112
  136    H73   DT  12           H52       DT  12   0.630  12.179  -6.054
  137    H6    DT  12           H6        DT  12   2.947  11.379  -6.190
  138    H5'   DA  13           H5'        A  13   8.558   5.037  -5.233
  139   H5''   DA  13          H5''        A  13   8.177   5.745  -3.652
  140    H4'   DA  13           H4'        A  13  10.254   4.723  -3.296
  141    H3'   DA  13           H3'        A  13  10.237   7.610  -3.523
  142    H2'   DA  13           H2'        A  13  12.110   8.012  -4.675
  143   H2''   DA  13          H2''        A  13  13.037   6.918  -3.569
  144    H1'   DA  13           H1'        A  13  13.147   5.386  -5.178
  145    H8    DA  13           H8         A  13  10.179   6.574  -7.216
  146    H61   DA  13           H61        A  13  14.279   8.550 -11.361
  147    H62   DA  13           H62        A  13  12.589   8.215 -11.063
  148    H2    DA  13           H2         A  13  16.506   7.442  -7.618
  149    H5'   DG  14           H5'        G  14  10.522   3.601   0.564
  150   H5''   DG  14          H5''        G  14  10.048   4.424  -0.950
  151    H4'   DG  14           H4'        G  14  10.365   6.275   1.295
  152    H3'   DG  14           H3'        G  14   8.697   3.835   1.767
  153    H2'   DG  14           H2'        G  14   6.766   4.961   2.210
  154   H2''   DG  14          H2''        G  14   7.675   6.423   2.849
  155    H1'   DG  14           H1'        G  14   7.330   7.402   0.917
  156    H8    DG  14           H8         G  14   7.451   4.942  -1.734
  157    H1    DG  14           H1         G  14   1.589   7.162  -0.653
  158    H21   DG  14           H21        G  14   1.440   7.995   1.403
  159    H22   DG  14           H22        G  14   2.797   8.003   2.510
  160    H5'   DG  15           H5'        G  15   9.203   1.431   4.788
  161   H5''   DG  15          H5''        G  15   9.121   2.202   3.176
  162    H4'   DG  15           H4'        G  15   8.601   4.174   5.190
  163    H3'   DG  15           H3'        G  15   7.159   1.567   5.595
  164    H2'   DG  15           H2'        G  15   5.130   2.653   5.837
  165   H2''   DG  15          H2''        G  15   5.939   4.185   6.464
  166    H1'   DG  15           H1'        G  15   5.948   5.043   4.446
  167    H8    DG  15           H8         G  15   3.146   4.411   4.419
  168    H1    DG  15           H1         G  15   4.667   1.916  -1.255
  169    H21   DG  15           H21        G  15   6.816   1.303  -1.251
  170    H22   DG  15           H22        G  15   7.848   1.510   0.143
  171    H5'   DG  16           H5'        G  16   6.870  -1.411   8.060
  172   H5''   DG  16          H5''        G  16   7.461  -1.369   6.375
  173    H4'   DG  16           H4'        G  16   5.596   0.805   6.938
  174    H3'   DG  16           H3'        G  16   4.697  -1.974   7.638
  175    H2'   DG  16           H2'        G  16   2.785  -1.694   6.398
  176   H2''   DG  16          H2''        G  16   2.716   0.102   6.783
  177    H1'   DG  16           H1'        G  16   3.801   0.632   4.950
  178    H8    DG  16           H8         G  16   5.371  -2.066   3.226
  179    H1    DG  16           H1         G  16  -0.600  -1.131   1.313
  180    H21   DG  16           H21        G  16  -1.737  -0.080   2.841
  181    H22   DG  16           H22        G  16  -1.029   0.396   4.341
  182    H5'   DT  17           H5'       DT  17   3.892  -3.921   9.806
  183   H5''   DT  17          H5''       DT  17   4.769  -3.507  11.294
  184    H4'   DT  17           H4'       DT  17   6.891  -4.264  10.009
  185    H3'   DT  17           H3'       DT  17   4.842  -4.792   8.021
  186    H2'   DT  17           H2'       DT  17   4.588  -7.004   8.189
  187   H2''   DT  17          H2''       DT  17   6.385  -7.227   8.127
  188    H1'   DT  17           H1'       DT  17   6.404  -7.701  10.304
  189    H3    DT  17           H3        DT  17   2.756 -10.526  10.174
  190    H71   DT  17           H53       DT  17   0.594  -7.634  13.063
  191    H72   DT  17           H51       DT  17   1.914  -6.546  13.546
  192    H73   DT  17           H52       DT  17   0.881  -6.125  12.170
  193    H6    DT  17           H6        DT  17   3.637  -6.046  11.673
  194    H5'   DT  18           H5'       DT  18   7.693  -6.557   3.721
  195   H5''   DT  18          H5''       DT  18   6.479  -7.434   4.674
  196    H4'   DT  18           H4'       DT  18   9.392  -8.078   5.058
  197    H3'   DT  18           H3'       DT  18   7.931  -8.408   2.553
  198    H2'   DT  18           H2'       DT  18   7.429 -10.585   2.630
  199   H2''   DT  18          H2''       DT  18   9.126 -10.980   3.126
  200    H1'   DT  18           H1'       DT  18   8.444 -11.356   5.210
  201    H3    DT  18           H3        DT  18   4.832 -14.000   4.404
  202    H71   DT  18           H53       DT  18   2.125 -10.078   4.756
  203    H72   DT  18           H51       DT  18   2.542 -10.208   6.473
  204    H73   DT  18           H52       DT  18   3.264  -8.922   5.481
  205    H6    DT  18           H6        DT  18   5.489  -9.316   5.245
  206    H5'   DA  19           H5'        A  19  11.818  -7.472   0.288
  207   H5''   DA  19          H5''        A  19  10.556  -6.868  -0.799
  208    H4'   DA  19           H4'        A  19  12.718  -8.306  -1.617
  209    H3'   DA  19           H3'        A  19  10.032  -7.774  -2.734
  210    H2'   DA  19           H2'        A  19   9.752  -9.675  -3.877
  211   H2''   DA  19          H2''        A  19  11.482  -9.663  -4.415
  212    H1'   DA  19           H1'        A  19  11.964 -11.239  -2.924
  213    H8    DA  19           H8         A  19  10.369 -13.216  -3.565
  214    H61   DA  19           H61        A  19   5.386 -13.453   0.040
  215    H62   DA  19           H62        A  19   6.355 -14.323  -1.128
  216    H2    DA  19           H2         A  19   7.403  -9.494   0.712
  217    H5'   DG  20           H5'        G  20   9.175  -4.096  -3.155
  218   H5''   DG  20          H5''        G  20   9.585  -5.651  -2.356
  219    H4'   DG  20           H4'        G  20   8.591  -6.836  -4.242
  220    H3'   DG  20           H3'        G  20   8.159  -4.080  -5.401
  221    H2'   DG  20           H2'        G  20   6.142  -4.724  -6.240
  222   H2''   DG  20          H2''        G  20   6.656  -6.480  -6.381
  223    H1'   DG  20           H1'        G  20   5.816  -6.923  -4.400
  224    H8    DG  20           H8         G  20   3.792  -5.499  -5.887
  225    H1    DG  20           H1         G  20   2.993  -2.833  -0.157
  226    H21   DG  20           H21        G  20   4.916  -2.921   0.945
  227    H22   DG  20           H22        G  20   6.349  -3.639   0.255
  228    H5'   DG  21           H5'        G  21   7.174  -2.962  -8.236
  229   H5''   DG  21          H5''        G  21   8.327  -2.277  -9.436
  230    H4'   DG  21           H4'        G  21   8.720  -0.568  -8.090
  231    H3'   DG  21           H3'        G  21   9.619  -2.721  -6.326
  232    H2'   DG  21           H2'        G  21   8.288  -2.043  -4.579
  233   H2''   DG  21          H2''        G  21   9.405  -0.609  -4.507
  234    H1'   DG  21           H1'        G  21   8.090   0.603  -5.984
  235    H8    DG  21           H8         G  21   7.841   0.369  -2.916
  236    H1    DG  21           H1         G  21   1.798   1.466  -4.560
  237    H21   DG  21           H21        G  21   1.369   0.801  -6.582
  238    H22   DG  21           H22        G  21   2.596   0.094  -7.630
  239    H5'   DG  22           H5'        G  22   9.396   2.873  -8.848
  240   H5''   DG  22          H5''        G  22   8.644   2.532  -7.262
  241    H4'   DG  22           H4'        G  22   7.481   0.826  -9.258
  242    H3'   DG  22           H3'        G  22   7.815   3.680 -10.150
  243   HO3'   DG  22          H3T         G  22   8.190   2.688 -12.009
  244    H2'   DG  22           H2'        G  22   5.577   3.929 -10.557
  245   H2''   DG  22          H2''        G  22   5.424   2.184 -11.112
  246    H1'   DG  22           H1'        G  22   4.763   1.518  -9.128
  247    H8    DG  22           H8         G  22   2.647   3.421  -9.606
  248    H1    DG  22           H1         G  22   4.217   5.205  -3.688
  249    H21   DG  22           H21        G  22   6.387   4.675  -3.327
  250    H22   DG  22           H22        G  22   7.376   3.910  -4.536
  251    H45  RUL 101           H45      RUL  23  -0.843  -2.887   6.949
  252    H46  RUL 101           H46      RUL  23   1.211  -3.342   5.714
  253    H47  RUL 101           H47      RUL  23   1.139  -4.433   3.437
  254    H48  RUL 101           H48      RUL  23  -6.737  -4.308   4.808
  255    H49  RUL 101           H49      RUL  23  -7.211  -5.352   2.647
  256    H50  RUL 101           H50      RUL  23  -5.313  -5.968   1.154
  257    H51  RUL 101           H51      RUL  23  -6.590  -1.517   5.997
  258    H52  RUL 101           H52      RUL  23  -9.101  -1.680   6.734
  259    H53  RUL 101           H53      RUL  23  -9.722  -3.662   8.032
  260    H54  RUL 101           H54      RUL  23  -8.078  -5.311   8.835
  261    H55  RUL 101           H55      RUL  23  -2.540  -6.180   6.208
  262    H56  RUL 101           H56      RUL  23  -3.347  -8.548   6.593
  263    H57  RUL 101           H57      RUL  23  -5.359  -8.951   7.796
  264    H58  RUL 101           H58      RUL  23  -6.795  -7.075   8.566
  265    H59  RUL 101           H59      RUL  23  -2.204  -1.241   4.960
  266    H60  RUL 101           H60      RUL  23  -1.250   0.884   6.033
  267    H61  RUL 101           H61      RUL  23  -2.856   2.196   7.505
  268    H62  RUL 101           H62      RUL  23  -5.119   1.222   8.042
  269    H63  RUL 101           H63      RUL  23  -2.251  -4.193   9.116
  270    H64  RUL 101           H64      RUL  23  -3.514  -4.180  11.416
  271    H65  RUL 101           H65      RUL  23  -5.242  -2.572  11.700
  272    H66  RUL 101           H66      RUL  23  -5.949  -0.962   9.952
  273    H67  RUL 101           H67      RUL  23   3.348  -7.681  -3.730
  274    H68  RUL 101           H68      RUL  23   4.111  -6.642  -1.601
  275    H69  RUL 101           H69      RUL  23   2.448  -5.931   0.107
  276    H70  RUL 101           H70      RUL  23  -2.888  -8.787  -5.155
  277    H71  RUL 101           H71      RUL  23  -4.723  -8.212  -3.673
  278    H72  RUL 101           H72      RUL  23  -4.176  -7.109  -1.430
  279    H73  RUL 101           H73      RUL  23   1.635  -8.447  -7.905
  280    H74  RUL 101           H74      RUL  23   3.938  -9.186  -8.935
  281    H75  RUL 101           H75      RUL  23   5.309 -10.474  -7.431
  282    H76  RUL 101           H76      RUL  23   5.003 -10.754  -5.073
  283    H77  RUL 101           H77      RUL  23  -0.930 -10.636  -3.339
  284    H78  RUL 101           H78      RUL  23   0.157 -12.265  -1.534
  285    H79  RUL 101           H79      RUL  23   2.809 -12.118  -1.455
  286    H80  RUL 101           H80      RUL  23   4.001 -11.173  -3.112
  287    H81  RUL 101           H81      RUL  23   0.179 -11.488  -6.216
  288    H82  RUL 101           H82      RUL  23  -2.098 -12.532  -7.015
  289    H83  RUL 101           H83      RUL  23  -3.669 -11.065  -8.016
  290    H84  RUL 101           H84      RUL  23  -3.331  -8.571  -8.227
  291    H85  RUL 101           H85      RUL  23   1.626  -5.658  -6.096
  292    H86  RUL 101           H86      RUL  23   2.194  -5.182  -8.405
  293    H87  RUL 101           H87      RUL  23   0.302  -5.696 -10.189
  294    H88  RUL 101           H88      RUL  23  -1.814  -6.849  -9.310