NMR Restraints Grid

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

image mrblock_id pdb_id cing in_recoord in_dress stage position program type subtype subsubtype

3864 1e9k cing recoord dress 1-original 1 XPLOR/CNS distance NOE ambi
!1V 2P 3E 4V 5D 6N 7P 8H 9C 10P 11N 12P 13W 14L 15N 16E 17D 18L 19V 20K

!21S 22L 23R 24E 25N 26L 27L 28Q 29H 30E 31K 32S 33K 34T 35A 36R 37K 38S

!----------------------------------------------------------------------------

!i,i

assign (resid 1 and name HA ) (resid 1 and name HG1# ) 1.0 0.0 4.5 !

assign (resid 1 and name HA ) (resid 1 and name HG2# ) 1.0 0.0 4.5 !

!i,i+1

assign (resid 1 and name HA ) (resid 2 and name HD1 ) 1.0 0.0 2.0 !

assign (resid 1 and name HA ) (resid 2 and name HD2 ) 1.0 0.0 2.0 !

assign (resid 1 and name HG1# ) (resid 2 and name HD1 ) 1.0 0.0 4.0 !

assign (resid 1 and name HG1# ) (resid 2 and name HD2 ) 1.0 0.0 4.0 !

assign (resid 1 and name HG2# ) (resid 2 and name HD1 ) 1.0 0.0 4.0 !

assign (resid 1 and name HG2# ) (resid 2 and name HD2 ) 1.0 0.0 4.0 !

!i,i+2

assign (resid 1 and name HG1# ) (resid 3 and name HB# ) 1.0 0.0 4.5 !

assign (resid 1 and name HG2# ) (resid 3 and name HB# ) 1.0 0.0 4.5 !

!----------------------------------------------------------------------------

!i,i+1

assign (resid 2 and name HA ) (resid 3 and name HN ) 2.0 0.0 4.0 !

assign (resid 2 and name HD# ) (resid 3 and name HN ) 3.0 0.0 4.0 !

assign (resid 2 and name HD1 ) (resid 3 and name HG# ) 1.0 0.0 3.5 !

assign (resid 2 and name HD2 ) (resid 3 and name HG# ) 1.0 0.0 3.5 !

assign (resid 2 and name HD# ) (resid 3 and name HB# ) 2.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 3 and name HN ) (resid 3 and name HA ) 1.0 0.0 3.0 !

assign (resid 3 and name HN ) (resid 3 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 3 and name HN ) (resid 3 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 3 and name HN ) (resid 3 and name HG# ) 1.0 0.0 4.0 !

assign (resid 3 and name HA ) (resid 3 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 3 and name HA ) (resid 3 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 3 and name HA ) (resid 3 and name HG# ) 1.0 0.0 4.0 !

!i,i+1

assign (resid 3 and name HA ) (resid 4 and name HN ) 1.0 0.0 4.0 !

assign (resid 3 and name HN ) (resid 4 and name HN ) 1.0 0.0 2.5 !

assign (resid 3 and name HG# ) (resid 4 and name HN ) 1.0 0.0 3.5 !

assign (resid 3 and name HN ) (resid 4 and name HG1# ) 3.0 0.0 5.5 !

assign (resid 3 and name HN ) (resid 4 and name HG2# ) 3.0 0.0 5.5 !

!----------------------------------------------------------------------------

!i,i

assign (resid 4 and name HN ) (resid 4 and name HA ) 1.0 0.0 3.0 !

assign (resid 4 and name HN ) (resid 4 and name HB ) 1.0 0.0 3.0 !

assign (resid 4 and name HN ) (resid 4 and name HG## ) 2.0 0.0 4.0 !

assign (resid 4 and name HA ) (resid 4 and name HB ) 1.0 0.0 3.0 !

!i,i+1

assign (resid 4 and name HA ) (resid 5 and name HN ) 1.0 0.0 3.0 !

assign (resid 4 and name HN ) (resid 5 and name HN ) 1.0 0.0 2.5 !

assign (resid 4 and name HA ) (resid 5 and name HA ) 1.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 5 and name HN ) (resid 5 and name HA ) 1.0 0.0 3.5 !

assign (resid 5 and name HN ) (resid 5 and name HB# ) 1.0 0.0 4.5 !

assign (resid 5 and name HA ) (resid 5 and name HB# ) 1.0 0.0 4.0 !

!i,i+1

assign (resid 5 and name HA ) (resid 6 and name HN ) 1.0 0.0 2.0 !

assign (resid 5 and name HB# ) (resid 6 and name HN ) 1.0 0.0 4.5 !

assign (resid 5 and name HN ) (resid 6 and name HB# ) 2.0 0.0 4.0 !

!i,i+2

assign (resid 5 and name HA ) (resid 7 and name HD1 ) 1.0 0.0 4.0 !

assign (resid 5 and name HA ) (resid 7 and name HD2 ) 1.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 6 and name HN ) (resid 6 and name HA ) 1.0 0.0 3.0 !

assign (resid 6 and name HN ) (resid 6 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 6 and name HN ) (resid 6 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 6 and name HN ) (resid 6 and name HD21 ) 3.0 0.0 4.0 !

    or (resid 6 and name HN ) (resid 6 and name HD22 ) 

assign (resid 6 and name HA ) (resid 6 and name HB1 ) 1.0 0.0 3.5 !

assign (resid 6 and name HA ) (resid 6 and name HB2 ) 1.0 0.0 3.5 !

assign (resid 6 and name HA ) (resid 6 and name HD21 ) 3.0 0.0 5.0 !

assign (resid 6 and name HA ) (resid 6 and name HD22 ) 3.0 0.0 5.0 !

assign (resid 6 and name HB1 ) (resid 6 and name HD21 ) 1.0 0.0 4.0 !

assign (resid 6 and name HB1 ) (resid 6 and name HD22 ) 1.0 0.0 4.0 !

assign (resid 6 and name HB2 ) (resid 6 and name HD21 ) 1.0 0.0 4.0 !

assign (resid 6 and name HB2 ) (resid 6 and name HD22 ) 1.0 0.0 4.0 !

assign (resid 6 and name HD21 ) (resid 6 and name HD22 ) 1.0 0.0 3.0 !

!i,i+1

assign (resid 6 and name HA ) (resid 7 and name HD1 ) 1.0 0.0 2.0 !

assign (resid 6 and name HA ) (resid 7 and name HD2 ) 1.0 0.0 2.0 !

assign (resid 6 and name HB1 ) (resid 7 and name HD1 ) 1.0 0.0 3.5 !

assign (resid 6 and name HB1 ) (resid 7 and name HD2 ) 1.0 0.0 3.5 !

assign (resid 6 and name HB2 ) (resid 7 and name HD1 ) 1.0 0.0 3.5 !

assign (resid 6 and name HB2 ) (resid 7 and name HD2 ) 1.0 0.0 3.5 !

assign (resid 6 and name HD21 ) (resid 7 and name HD1 ) 3.0 0.0 4.0 !

assign (resid 6 and name HD21 ) (resid 7 and name HD2 ) 3.0 0.0 4.0 !

assign (resid 6 and name HD22 ) (resid 7 and name HD1 ) 3.0 0.0 4.0 !

assign (resid 6 and name HD22 ) (resid 7 and name HD2 ) 3.0 0.0 4.0 !

assign (resid 6 and name HN ) (resid 7 and name HD1 ) 2.0 0.0 4.0 !

assign (resid 6 and name HN ) (resid 7 and name HD2 ) 2.0 0.0 4.0 !

assign (resid 6 and name HA ) (resid 7 and name HA ) 1.0 0.0 3.5 !

assign (resid 6 and name HA ) (resid 7 and name HG1 ) 1.0 0.0 4.0 !

assign (resid 6 and name HA ) (resid 7 and name HG2 ) 1.0 0.0 4.0 !

assign (resid 6 and name HA ) (resid 7 and name HB1) 1.0 0.0 3.5 !

    or (resid 6 and name HA ) (resid 7 and name HB2)

!i,i+2

assign (resid 6 and name HA ) (resid 8 and name HN ) 1.0 0.0 3.5 !

assign (resid 6 and name HD21 ) (resid 8 and name HB1 ) 2.0 0.0 4.0 !

    or (resid 6 and name HD22 ) (resid 8 and name HB1 )

assign (resid 6 and name HD21 ) (resid 8 and name HB2 ) 2.0 0.0 4.0 !

    or (resid 6 and name HD22 ) (resid 8 and name HB2 )

assign (resid 6 and name HB1 ) (resid 8 and name HN ) 2.0 0.0 4.0 !

    or (resid 6 and name HB2 ) (resid 8 and name HN )

!----------------------------------------------------------------------------

!i,i+1

assign (resid 7 and name HA ) (resid 8 and name HN ) 1.0 0.0 3.0 !

assign (resid 7 and name HD1 ) (resid 8 and name HN ) 1.0 0.0 4.5 !

assign (resid 7 and name HD2 ) (resid 8 and name HN ) 1.0 0.0 4.5 !

assign (resid 7 and name HA ) (resid 8 and name HD2 ) 3.0 0.0 4.0 !

assign (resid 7 and name HB1 ) (resid 8 and name HA ) 1.0 0.0 3.5 !

    or (resid 7 and name HB2 ) (resid 8 and name HA )

assign (resid 7 and name HB2 ) (resid 8 and name HA ) 2.0 0.0 4.0 !

    or (resid 7 and name HB1 ) (resid 8 and name HA )

assign (resid 7 and name HB1 ) (resid 8 and name HN ) 1.0 0.0 3.5 !

assign (resid 7 and name HB2 ) (resid 8 and name HN ) 1.0 0.0 3.5 !

assign (resid 7 and name HG# ) (resid 8 and name HN ) 1.0 0.0 4.5 !

!i,i+2

assign (resid 7 and name HA ) (resid 9 and name HN ) 1.0 0.0 4.0 !

assign (resid 7 and name HD1 ) (resid 9 and name HN ) 2.0 0.0 4.0 !

assign (resid 7 and name HD2 ) (resid 9 and name HN ) 2.0 0.0 4.0 !

!i,i+4

assign (resid 7 and name HD1 ) (resid 11 and name HN ) 1.0 0.0 4.0 !

assign (resid 7 and name HD2 ) (resid 11 and name HN ) 1.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 8 and name HN ) (resid 8 and name HA ) 1.0 0.0 3.0 !

assign (resid 8 and name HN ) (resid 8 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 8 and name HN ) (resid 8 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 8 and name HN ) (resid 8 and name HD2 ) 2.0 0.0 4.0 !

assign (resid 8 and name HA ) (resid 8 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 8 and name HA ) (resid 8 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 8 and name HB1 ) (resid 8 and name HD2 ) 2.0 0.0 4.0 !

assign (resid 8 and name HD2 ) (resid 8 and name HA ) 2.0 0.0 4.0 !

!i,i+1

assign (resid 8 and name HA ) (resid 9 and name HN ) 1.0 0.0 4.0 !

assign (resid 8 and name HN ) (resid 9 and name HN ) 1.0 0.0 2.5 !

assign (resid 8 and name HB1 ) (resid 9 and name HN ) 1.0 0.0 2.5 !

assign (resid 8 and name HB2 ) (resid 9 and name HN ) 1.0 0.0 2.5 !

assign (resid 8 and name HN ) (resid 9 and name HB# ) 1.0 0.0 4.5 !

!----------------------------------------------------------------------------

!i,i

assign (resid 9 and name HN ) (resid 9 and name HA ) 2.0 0.0 4.0 !

assign (resid 9 and name HN ) (resid 9 and name HB# ) 1.0 0.0 4.0 !

!i,i+1

assign (resid 9 and name HN ) (resid 10 and name HB1 ) 2.0 0.0 4.0 !

    or (resid 9 and name HN ) (resid 10 and name HB2 )

    or (resid 9 and name HN ) (resid 10 and name HG1 )

    or (resid 9 and name HN ) (resid 10 and name HG2 )

!i,i+3

assign (resid 9 and name HN ) (resid 12 and name HB1 ) 2.0 0.0 4.0 !

    or (resid 9 and name HN ) (resid 12 and name HB2 )

!----------------------------------------------------------------------------

!i,i+1

assign (resid 10 and name HA ) (resid 11 and name HN ) 1.0 0.0 2.0 !

assign (resid 10 and name HA ) (resid 11 and name HA ) 1.0 0.0 3.5 !

assign (resid 10 and name HA ) (resid 11 and name HB1 ) 1.0 0.0 4.0 !

assign (resid 10 and name HA ) (resid 11 and name HB2 ) 1.0 0.0 4.0 !

!i,i+2

assign (resid 10 and name HA ) (resid 12 and name HD1 ) 3.0 0.0 4.0 !

    or (resid 10 and name HA ) (resid 12 and name HD2 )

!----------------------------------------------------------------------------

!i,i

assign (resid 11 and name HN ) (resid 11 and name HA ) 1.0 0.0 3.0 !

assign (resid 11 and name HN ) (resid 11 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 11 and name HN ) (resid 11 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 11 and name HN ) (resid 11 and name HD21 ) 3.0 0.0 4.0 !

assign (resid 11 and name HN ) (resid 11 and name HD22 ) 3.0 0.0 4.0 !

assign (resid 11 and name HA ) (resid 11 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 11 and name HA ) (resid 11 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 11 and name HA ) (resid 11 and name HD21 ) 3.0 0.0 4.0 !

assign (resid 11 and name HA ) (resid 11 and name HD22 ) 3.0 0.0 4.0 !

assign (resid 11 and name HD21 ) (resid 11 and name HD22 ) 1.0 0.0 3.0 !

assign (resid 11 and name HD21 ) (resid 11 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 11 and name HD21 ) (resid 11 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 11 and name HD22 ) (resid 11 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 11 and name HD22 ) (resid 11 and name HB2 ) 1.0 0.0 3.0 !

!i,i+1

assign (resid 11 and name HN ) (resid 12 and name HD1 ) 1.0 0.0 4.0 !

assign (resid 11 and name HN ) (resid 12 and name HD2 ) 1.0 0.0 4.0 !

assign (resid 11 and name HB1 ) (resid 12 and name HD1 ) 1.0 0.0 2.0 !

assign (resid 11 and name HB2 ) (resid 12 and name HD1 ) 1.0 0.0 2.0 !

assign (resid 11 and name HB1 ) (resid 12 and name HD2 ) 1.0 0.0 2.5 !

assign (resid 11 and name HB2 ) (resid 12 and name HD2 ) 1.0 0.0 2.5 !

assign (resid 11 and name HA ) (resid 12 and name HB1 ) 1.0 0.0 4.5 !

assign (resid 11 and name HA ) (resid 12 and name HB2 ) 1.0 0.0 4.5 !

assign (resid 11 and name HA ) (resid 12 and name HG1 ) 1.0 0.0 4.0 !

assign (resid 11 and name HA ) (resid 12 and name HG2 ) 1.0 0.0 4.0 !

assign (resid 11 and name HA ) (resid 12 and name HA ) 1.0 0.0 3.5 !

assign (resid 11 and name HA ) (resid 12 and name HD1 ) 1.0 0.0 2.0 !

assign (resid 11 and name HA ) (resid 12 and name HD2 ) 1.0 0.0 2.0 !

assign (resid 11 and name HB1 ) (resid 12 and name HB# ) 2.0 0.0 4.0 !

assign (resid 11 and name HB2 ) (resid 12 and name HB# ) 2.0 0.0 4.0 !

!i,i+2

assign (resid 11 and name HA ) (resid 13 and name HN ) 1.0 0.0 3.5 !

assign (resid 11 and name HD21 ) (resid 13 and name HD1 ) 2.0 0.0 4.5 !

    or (resid 11 and name HD22 ) (resid 13 and name HD1 )

assign (resid 11 and name HD21 ) (resid 13 and name HE3 ) 1.0 0.0 4.5 !

    or (resid 11 and name HD22 ) (resid 13 and name HE3 )

assign (resid 11 and name HD21 ) (resid 13 and name HB1 ) 2.0 0.0 4.0 !

    or (resid 11 and name HD22 ) (resid 13 and name HB1 )

assign (resid 11 and name HD21 ) (resid 13 and name HB2 ) 2.0 0.0 4.0 !

    or (resid 11 and name HD22 ) (resid 13 and name HB2 )

assign (resid 11 and name HA ) (resid 13 and name HZ3 ) 2.0 0.0 4.5 !

assign (resid 11 and name HA ) (resid 13 and name HD1 ) 3.0 0.0 4.5 !

assign (resid 11 and name HA ) (resid 13 and name HZ2 ) 2.0 0.0 4.5 !

assign (resid 11 and name HA ) (resid 13 and name HE3 ) 2.0 0.0 4.5 !

assign (resid 11 and name HB1 ) (resid 13 and name HE3 ) 1.0 0.0 4.0 !

assign (resid 11 and name HB2 ) (resid 13 and name HE3 ) 1.0 0.0 4.0 !

assign (resid 11 and name HB1 ) (resid 13 and name HD1 ) 2.0 0.0 4.5 !

assign (resid 11 and name HB2 ) (resid 13 and name HD1 ) 2.0 0.0 4.5 !

assign (resid 11 and name HB1 ) (resid 13 and name HA ) 2.0 0.0 4.0 !

    or (resid 11 and name HB2 ) (resid 13 and name HA )

!i,i+3

assign (resid 11 and name HD21 ) (resid 14 and name HG ) 1.0 0.0 4.0 !

    or (resid 11 and name HD21 ) (resid 14 and name HB# )

    or (resid 11 and name HD22 ) (resid 14 and name HG )

    or (resid 11 and name HD22 ) (resid 14 and name HB# )

assign (resid 11 and name HD21 ) (resid 14 and name HG ) 2.0 0.0 4.0 !

    or (resid 11 and name HD21 ) (resid 14 and name HB# )

    or (resid 11 and name HD22 ) (resid 14 and name HG )

    or (resid 11 and name HD22 ) (resid 14 and name HB# )

assign (resid 11 and name HD21 ) (resid 14 and name HD## ) 2.0 0.0 4.0 !

    or (resid 11 and name HD22 ) (resid 14 and name HD## )

assign (resid 11 and name HB1 ) (resid 14 and name HB# ) 2.0 0.0 4.0 !

    or (resid 11 and name HB1 ) (resid 14 and name HG)

assign (resid 11 and name HB2 ) (resid 14 and name HB# ) 2.0 0.0 4.0 !

    or (resid 11 and name HB2 ) (resid 14 and name HG)

assign (resid 11 and name HB1 ) (resid 14 and name HB# ) 2.0 0.0 4.0 !

    or (resid 11 and name HB1 ) (resid 14 and name HG)

assign (resid 11 and name HB2 ) (resid 14 and name HB# ) 2.0 0.0 4.0 !

    or (resid 11 and name HB2 ) (resid 14 and name HG)

assign (resid 11 and name HB1 ) (resid 14 and name HD## ) 2.0 0.0 4.0 !

assign (resid 11 and name HB2 ) (resid 14 and name HD## ) 2.0 0.0 4.0 !

assign (resid 11 and name HN ) (resid 14 and name HD## ) 3.0 0.0 4.5 !

assign (resid 11 and name HN ) (resid 14 and name HB# ) 2.0 0.0 4.0 !

    or (resid 11 and name HN ) (resid 14 and name HG )

assign (resid 11 and name HD2# ) (resid 14 and name HA ) 3.0 0.0 4.0 !

!i,i+4

assign (resid 11 and name HN ) (resid 15 and name HD21 ) 3.0 0.0 4.0 !

assign (resid 11 and name HN ) (resid 15 and name HD22 ) 3.0 0.0 4.0 !

assign (resid 11 and name HN ) (resid 15 and name HB1 ) 2.0 0.0 4.0 !

assign (resid 11 and name HN ) (resid 15 and name HB2 ) 2.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i+1

assign (resid 12 and name HD1 ) (resid 13 and name HN ) 1.0 0.0 2.5 !

assign (resid 12 and name HD2 ) (resid 13 and name HN ) 1.0 0.0 2.5 !

assign (resid 12 and name HD1 ) (resid 13 and name HH2 ) 2.0 0.0 4.5 !

assign (resid 12 and name HD2 ) (resid 13 and name HH2 ) 2.0 0.0 4.5 !

assign (resid 12 and name HD1 ) (resid 13 and name HZ3 ) 1.0 0.0 4.0 !

assign (resid 12 and name HD2 ) (resid 13 and name HZ3 ) 1.0 0.0 4.0 !

assign (resid 12 and name HD1 ) (resid 13 and name HE3 ) 1.0 0.0 3.5 !

assign (resid 12 and name HD2 ) (resid 13 and name HE3 ) 1.0 0.0 3.5 !

assign (resid 12 and name HD1) (resid 13 and name HA ) 2.0 0.0 4.0 !

    or (resid 12 and name HD2) (resid 13 and name HA )

assign (resid 12 and name HD1) (resid 13 and name HA ) 2.0 0.0 4.0 !

    or (resid 12 and name HD2) (resid 13 and name HA )

assign (resid 12 and name HG1 ) (resid 13 and name HZ3 ) 2.0 0.0 4.5 !

assign (resid 12 and name HG2 ) (resid 13 and name HZ3 ) 2.0 0.0 4.5 !

assign (resid 12 and name HB# ) (resid 13 and name HZ3 ) 3.0 0.0 4.5 !

assign (resid 12 and name HD1 ) (resid 13 and name HD1 ) 1.0 0.0 4.5 !

assign (resid 12 and name HD2 ) (resid 13 and name HD1 ) 1.0 0.0 4.5 !

assign (resid 12 and name HG1) (resid 13 and name HA ) 2.0 0.0 4.0 !

    or (resid 12 and name HG2) (resid 13 and name HA )

assign (resid 12 and name HG1) (resid 13 and name HA ) 1.0 0.0 4.0 !

    or (resid 12 and name HG2) (resid 13 and name HA )

assign (resid 12 and name HB# ) (resid 13 and name HA ) 1.0 0.0 4.0 !

assign (resid 12 and name HB1 ) (resid 13 and name HD1 ) 3.0 0.0 4.0 !

    or (resid 12 and name HB2 ) (resid 13 and name HD1 )

    or (resid 12 and name HG1 ) (resid 13 and name HD1 )

    or (resid 12 and name HG2 ) (resid 13 and name HD1 )

!i,i+2

assign (resid 12 and name HD1 ) (resid 14 and name HN ) 1.0 0.0 4.0 !

assign (resid 12 and name HD2 ) (resid 14 and name HN ) 1.0 0.0 4.0 !

assign (resid 12 and name HG1 ) (resid 14 and name HN ) 3.0 0.0 4.0 !

assign (resid 12 and name HG2 ) (resid 14 and name HN ) 3.0 0.0 4.0 !

!i,i+3

assign (resid 12 and name HA ) (resid 15 and name HB1 ) 1.0 0.0 3.5 !

assign (resid 12 and name HA ) (resid 15 and name HB2 ) 1.0 0.0 3.5 !

!----------------------------------------------------------------------------

!i,i

assign (resid 13 and name HN ) (resid 13 and name HA ) 1.0 0.0 4.5 !

assign (resid 13 and name HN ) (resid 13 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 13 and name HN ) (resid 13 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 13 and name HA ) (resid 13 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 13 and name HA ) (resid 13 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 13 and name HA ) (resid 13 and name HE3 ) 2.0 0.0 4.0 !

assign (resid 13 and name HA ) (resid 13 and name HZ3 ) 3.0 0.0 4.5 !

assign (resid 13 and name HB1 ) (resid 13 and name HZ3 ) 2.0 0.0 4.5 !

assign (resid 13 and name HB2 ) (resid 13 and name HZ3 ) 2.0 0.0 4.5 !

assign (resid 13 and name HE3 ) (resid 13 and name HB1 ) 1.0 0.0 4.0 !

assign (resid 13 and name HE3 ) (resid 13 and name HB2 ) 1.0 0.0 4.0 !

assign (resid 13 and name HD1 ) (resid 13 and name HB1 ) 1.0 0.0 4.0 !

assign (resid 13 and name HD1 ) (resid 13 and name HB2 ) 1.0 0.0 4.0 !

assign (resid 13 and name HD1 ) (resid 13 and name HA ) 2.0 0.0 4.0 !

!i,i+1

assign (resid 13 and name HA ) (resid 14 and name HN ) 1.0 0.0 2.5 !

assign (resid 13 and name HN ) (resid 14 and name HN ) 1.0 0.0 2.0 !

assign (resid 13 and name HB1 ) (resid 14 and name HN ) 1.0 0.0 2.5 !

assign (resid 13 and name HB2 ) (resid 14 and name HN ) 1.0 0.0 2.5 !

assign (resid 13 and name HZ3 ) (resid 14 and name HA ) 3.0 0.0 5.0 !

assign (resid 13 and name HD1 ) (resid 14 and name HA ) 2.0 0.0 4.5 !

assign (resid 13 and name HD1 ) (resid 14 and name HD## ) 3.0 0.0 5.0 !

assign (resid 13 and name HA ) (resid 14 and name HD## ) 3.0 0.0 4.0 !

assign (resid 13 and name HB1 ) (resid 14 and name HB# ) 2.0 0.0 4.0 !

    or (resid 13 and name HB1 ) (resid 14 and name HG)

assign (resid 13 and name HB2 ) (resid 14 and name HB# ) 2.0 0.0 4.0 !

    or (resid 13 and name HB2 ) (resid 14 and name HG)

assign (resid 13 and name HA ) (resid 14 and name HB# ) 3.0 0.0 5.0 !

    or (resid 13 and name HA ) (resid 14 and name HG)

assign (resid 13 and name HA ) (resid 14 and name HB# ) 3.0 0.0 4.0 !

    or (resid 13 and name HA ) (resid 14 and name HG)

assign (resid 13 and name HA ) (resid 14 and name HA ) 1.0 0.0 4.0 !

!i,i+3

assign (resid 13 and name HA ) (resid 16 and name HB# ) 2.0 0.0 4.0 !

assign (resid 13 and name HA ) (resid 16 and name HG# ) 2.0 0.0 4.0 !

assign (resid 13 and name HD1 ) (resid 16 and name HG# ) 3.0 0.0 5.5 !

!----------------------------------------------------------------------------

!i,i

assign (resid 14 and name HN ) (resid 14 and name HA ) 1.0 0.0 3.0 !

assign (resid 14 and name HN ) (resid 14 and name HB# ) 1.0 0.0 4.0 !

    or (resid 14 and name HN ) (resid 14 and name HG )

assign (resid 14 and name HN ) (resid 14 and name HD## ) 2.0 0.0 4.5 !

assign (resid 14 and name HA ) (resid 14 and name HB# ) 1.0 0.0 4.0 !

    or (resid 14 and name HA ) (resid 14 and name HG )

assign (resid 14 and name HA ) (resid 14 and name HD## ) 2.0 0.0 4.5 !

!i,i+1

assign (resid 14 and name HA ) (resid 15 and name HN ) 1.0 0.0 2.0 !

assign (resid 14 and name HN ) (resid 15 and name HN ) 1.0 0.0 2.0 !

assign (resid 14 and name HA ) (resid 15 and name HD21 ) 3.0 0.0 4.0 !

assign (resid 14 and name HA ) (resid 15 and name HD22 ) 3.0 0.0 4.0 !

assign (resid 14 and name HD## ) (resid 15 and name HA ) 2.0 0.0 4.0 !

assign (resid 14 and name HG) (resid 15 and name HA ) 1.0 0.0 4.0 !

assign (resid 14 and name HB#) (resid 15 and name HA ) 2.0 0.0 4.0 !

assign (resid 14 and name HA ) (resid 15 and name HB1 ) 2.0 0.0 4.0 !

assign (resid 14 and name HA ) (resid 15 and name HB2 ) 2.0 0.0 4.0 !

assign (resid 14 and name HA ) (resid 15 and name HA ) 1.0 0.0 4.0 !

assign (resid 14 and name HN ) (resid 15 and name HB1 ) 2.0 0.0 4.0 !

    or (resid 14 and name HN ) (resid 15 and name HB2 )

!i,i+2

assign (resid 14 and name HA ) (resid 16 and name HN ) 1.0 0.0 2.5 !

!----------------------------------------------------------------------------

!i,i

assign (resid 15 and name HN ) (resid 15 and name HA ) 1.0 0.0 3.0 !

assign (resid 15 and name HN ) (resid 15 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 15 and name HN ) (resid 15 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 15 and name HN ) (resid 15 and name HD21) 3.0 0.0 4.0 !

assign (resid 15 and name HN ) (resid 15 and name HD22) 3.0 0.0 4.0 !

assign (resid 15 and name HA ) (resid 15 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 15 and name HA ) (resid 15 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 15 and name HA ) (resid 15 and name HD21 ) 2.0 0.0 4.0 !

assign (resid 15 and name HA ) (resid 15 and name HD22 ) 2.0 0.0 4.0 !

assign (resid 15 and name HD21 ) (resid 15 and name HB1 ) 1.0 0.0 3.5 !

assign (resid 15 and name HD21 ) (resid 15 and name HB2 ) 1.0 0.0 3.5 !

assign (resid 15 and name HD22 ) (resid 15 and name HB1 ) 1.0 0.0 3.5 !

assign (resid 15 and name HD22 ) (resid 15 and name HB2 ) 1.0 0.0 3.5 !

assign (resid 15 and name HD21 ) (resid 15 and name HD22 ) 1.0 0.0 3.0 !

!i,i+1

assign (resid 15 and name HA ) (resid 16 and name HN ) 1.0 0.0 2.0 !

assign (resid 15 and name HN ) (resid 16 and name HN ) 1.0 0.0 2.5 !

assign (resid 15 and name HB1 ) (resid 16 and name HN ) 1.0 0.0 2.0 !

assign (resid 15 and name HB2 ) (resid 16 and name HN ) 1.0 0.0 2.0 !

assign (resid 15 and name HA ) (resid 16 and name HB# ) 1.0 0.0 4.5 !

assign (resid 15 and name HA ) (resid 16 and name HG# ) 3.0 0.0 5.0 !

assign (resid 15 and name HA ) (resid 16 and name HA ) 1.0 0.0 4.0 !

assign (resid 15 and name HB1 ) (resid 16 and name HA ) 1.0 0.0 3.5 !

assign (resid 15 and name HB2 ) (resid 16 and name HA ) 1.0 0.0 3.5 !

assign (resid 15 and name HN ) (resid 16 and name HG# ) 3.0 0.0 4.0 !

assign (resid 15 and name HN ) (resid 16 and name HB# ) 3.0 0.0 4.0 !

assign (resid 15 and name HB1 ) (resid 16 and name HG# ) 3.0 0.0 4.0 !

assign (resid 15 and name HB2 ) (resid 16 and name HG# ) 3.0 0.0 4.0 !

assign (resid 15 and name HB1 ) (resid 16 and name HB# ) 2.0 0.0 4.0 !

assign (resid 15 and name HB2 ) (resid 16 and name HB# ) 2.0 0.0 4.0 !

!i,i+4

assign (resid 15 and name HB1 ) (resid 19 and name HG1# ) 2.0 0.0 4.5 !

assign (resid 15 and name HB2 ) (resid 19 and name HG1# ) 2.0 0.0 4.5 !

assign (resid 15 and name HB1 ) (resid 19 and name HG2# ) 2.0 0.0 4.5 !

assign (resid 15 and name HB2 ) (resid 19 and name HG2# ) 2.0 0.0 4.5 !

assign (resid 15 and name HB1 ) (resid 19 and name HB ) 3.0 0.0 4.0 !

assign (resid 15 and name HB2 ) (resid 19 and name HB ) 3.0 0.0 4.0 !

assign (resid 15 and name HD21 ) (resid 19 and name HG1# ) 2.0 0.0 4.5 !

assign (resid 15 and name HD21 ) (resid 19 and name HG2# ) 2.0 0.0 4.5 !

assign (resid 15 and name HD22 ) (resid 19 and name HG1# ) 2.0 0.0 4.5 !

assign (resid 15 and name HD22 ) (resid 19 and name HG2# ) 2.0 0.0 4.5 !

assign (resid 15 and name HD21 ) (resid 19 and name HB ) 2.0 0.0 4.0 !

assign (resid 15 and name HD22 ) (resid 19 and name HB ) 2.0 0.0 4.0 !

!i,j

assign (resid 15 and name HD21 ) (resid 20 and name HG1 ) 2.0 0.0 4.0 !

assign (resid 15 and name HD22 ) (resid 20 and name HG1 ) 2.0 0.0 4.0 !

assign (resid 15 and name HD21 ) (resid 20 and name HG2 ) 2.0 0.0 4.0 !

assign (resid 15 and name HD22 ) (resid 20 and name HG2 ) 2.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 16 and name HN ) (resid 16 and name HA ) 1.0 0.0 3.5 !

assign (resid 16 and name HN ) (resid 16 and name HB# ) 1.0 0.0 4.0 !

assign (resid 16 and name HN ) (resid 16 and name HG# ) 1.0 0.0 4.0 !

assign (resid 16 and name HA ) (resid 16 and name HB# ) 1.0 0.0 4.0 !

assign (resid 16 and name HA ) (resid 16 and name HG# ) 1.0 0.0 4.0 !

!i,i+1

assign (resid 16 and name HA ) (resid 17 and name HN ) 1.0 0.0 3.0 !

assign (resid 16 and name HN ) (resid 17 and name HN ) 1.0 0.0 3.5 !

assign (resid 16 and name HG# ) (resid 17 and name HN ) 1.0 0.0 3.5 !

!i,i+2

assign (resid 16 and name HA ) (resid 18 and name HN ) 1.0 0.0 2.5 !

assign (resid 16 and name HG# ) (resid 18 and name HN ) 3.0 0.0 4.0 !

assign (resid 16 and name HB# ) (resid 18 and name HN ) 3.0 0.0 4.0 !

assign (resid 16 and name HA ) (resid 18 and name HB1 ) 2.0 0.0 4.0 !

    or (resid 16 and name HA ) (resid 18 and name HB2 )

    or (resid 16 and name HA ) (resid 18 and name HG )

!i,i+3

assign (resid 16 and name HA ) (resid 19 and name HN ) 1.0 0.0 2.0 !

assign (resid 16 and name HA ) (resid 19 and name HG1# ) 2.0 0.0 4.0 !

assign (resid 16 and name HA ) (resid 19 and name HG2# ) 2.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 17 and name HN ) (resid 17 and name HA ) 1.0 0.0 4.5 !

assign (resid 17 and name HA ) (resid 17 and name HB# ) 1.0 0.0 4.5 !

!i,i+1

assign (resid 17 and name HA ) (resid 18 and name HN ) 1.0 0.0 3.0 !

assign (resid 17 and name HN ) (resid 18 and name HN ) 1.0 0.0 4.0 !

!i,i+2

assign (resid 17 and name HN ) (resid 19 and name HN ) 2.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 18 and name HN ) (resid 18 and name HA ) 2.0 0.0 4.0 !

assign (resid 18 and name HN ) (resid 18 and name HB# ) 3.0 0.0 4.0 !

    or (resid 18 and name HN ) (resid 18 and name HG )

assign (resid 18 and name HN ) (resid 18 and name HB# ) 3.0 0.0 4.0 !

    or (resid 18 and name HN ) (resid 18 and name HG )

assign (resid 18 and name HN ) (resid 18 and name HD## ) 2.0 0.0 4.5 !

assign (resid 18 and name HA ) (resid 18 and name HB# ) 3.0 0.0 4.0 !

assign (resid 18 and name HA ) (resid 18 and name HG ) 2.0 0.0 4.0 !

assign (resid 18 and name HA ) (resid 18 and name HD## ) 2.0 0.0 4.5 !

!i,i+1

assign (resid 18 and name HA ) (resid 19 and name HN ) 1.0 0.0 2.0 !

assign (resid 18 and name HD## ) (resid 19 and name HG## ) 2.0 0.0 4.5 !

assign (resid 18 and name HN ) (resid 19 and name HG## ) 3.0 0.0 5.0 !

!i,i+2

assign (resid 18 and name HA ) (resid 20 and name HA ) 2.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 19 and name HN ) (resid 19 and name HA ) 1.0 0.0 3.0 !

assign (resid 19 and name HN ) (resid 19 and name HB ) 1.0 0.0 3.0 !

assign (resid 19 and name HN ) (resid 19 and name HG1# ) 1.0 0.0 4.5 !

assign (resid 19 and name HN ) (resid 19 and name HG2# ) 1.0 0.0 4.5 !

assign (resid 19 and name HA ) (resid 19 and name HB ) 1.0 0.0 3.0 !

assign (resid 19 and name HA ) (resid 19 and name HG1# ) 1.0 0.0 4.5 !

assign (resid 19 and name HA ) (resid 19 and name HG2# ) 1.0 0.0 4.5 !

!i,i+1

assign (resid 19 and name HA ) (resid 20 and name HN ) 1.0 0.0 2.0 !

assign (resid 19 and name HN ) (resid 20 and name HN ) 1.0 0.0 2.5 !

assign (resid 19 and name HA ) (resid 20 and name HB# ) 2.0 0.0 4.0 !

assign (resid 19 and name HA ) (resid 20 and name HG# ) 1.0 0.0 3.5 !

assign (resid 19 and name HA ) (resid 20 and name HD# ) 1.0 0.0 3.5 !

assign (resid 19 and name HA ) (resid 20 and name HA ) 1.0 0.0 4.0 !

!i,i+2

assign (resid 19 and name HB ) (resid 21 and name HN ) 1.0 0.0 4.0 !

!i,i+3

assign (resid 19 and name HA ) (resid 22 and name HN ) 1.0 0.0 2.5 !

!i,i+4

assign (resid 19 and name HG1# ) (resid 23 and name HE ) 2.0 0.0 4.5 !

assign (resid 19 and name HG2# ) (resid 23 and name HE ) 2.0 0.0 4.5 !

assign (resid 19 and name HB ) (resid 23 and name HE ) 1.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 20 and name HN ) (resid 20 and name HA ) 1.0 0.0 3.0 !

assign (resid 20 and name HN ) (resid 20 and name HB# ) 1.0 0.0 4.0 !

assign (resid 20 and name HN ) (resid 20 and name HG# ) 1.0 0.0 4.0 !

assign (resid 20 and name HN ) (resid 20 and name HD# ) 1.0 0.0 4.0 !

assign (resid 20 and name HA ) (resid 20 and name HB# ) 3.0 0.0 4.0 !

assign (resid 20 and name HA ) (resid 20 and name HG# ) 3.0 0.0 4.0 !

assign (resid 20 and name HA ) (resid 20 and name HD# ) 3.0 0.0 4.0 !

!i,i+1

assign (resid 20 and name HN ) (resid 21 and name HN ) 1.0 0.0 2.5 !

!i,i+2

assign (resid 20 and name HN ) (resid 22 and name HN ) 1.0 0.0 3.5 !

!i,i+3

assign (resid 20 and name HN ) (resid 23 and name HD# ) 1.0 0.0 4.5 !

assign (resid 20 and name HE# ) (resid 23 and name HA ) 3.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 21 and name HN ) (resid 21 and name HA ) 1.0 0.0 3.0 !

assign (resid 21 and name HN ) (resid 21 and name HB# ) 3.0 0.0 4.0 !

assign (resid 21 and name HA ) (resid 21 and name HB# ) 1.0 0.0 3.0 !

!i,i+1

assign (resid 21 and name HA ) (resid 22 and name HN ) 1.0 0.0 2.0 !

assign (resid 21 and name HN ) (resid 22 and name HN ) 1.0 0.0 4.0 !

!i,i+2

assign (resid 21 and name HN ) (resid 23 and name HB1 ) 1.0 0.0 4.0 !

assign (resid 21 and name HN ) (resid 23 and name HB2 ) 1.0 0.0 4.0 !

assign (resid 21 and name HN ) (resid 23 and name HG# ) 2.0 0.0 4.0 !

!i,i+4

assign (resid 21 and name HA ) (resid 25 and name HB1 ) 1.0 0.0 4.0 !

assign (resid 21 and name HA ) (resid 25 and name HB2 ) 1.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 22 and name HN ) (resid 22 and name HA ) 1.0 0.0 3.0 !

assign (resid 22 and name HN ) (resid 22 and name HB# ) 1.0 0.0 4.5 !

    or (resid 22 and name HN ) (resid 22 and name HG)

assign (resid 22 and name HA ) (resid 22 and name HD## ) 3.0 0.0 4.5 !

!i,i+1

assign (resid 22 and name HA ) (resid 23 and name HN ) 1.0 0.0 3.0 !

assign (resid 22 and name HD## ) (resid 23 and name HD1 ) 2.0 0.0 4.5 !

assign (resid 22 and name HD## ) (resid 23 and name HD2 ) 2.0 0.0 4.5 !

assign (resid 22 and name HB# ) (resid 23 and name HD1 ) 3.0 0.0 4.0 !

    or (resid 22 and name HG) (resid 23 and name HD1 )

assign (resid 22 and name HB# ) (resid 23 and name HD2 ) 3.0 0.0 4.0 !

    or (resid 22 and name HG) (resid 23 and name HD2 )

assign (resid 22 and name HD## ) (resid 23 and name HA ) 2.0 0.0 4.5 !

!i,i+3

assign (resid 22 and name HA ) (resid 25 and name HB1 ) 2.0 0.0 4.0 !

assign (resid 22 and name HA ) (resid 25 and name HB2 ) 2.0 0.0 4.0 !

assign (resid 28 and name HA ) (resid 25 and name HB1 ) 2.0 0.0 4.0 !

assign (resid 28 and name HA ) (resid 25 and name HB2 ) 2.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 23 and name HN ) (resid 23 and name HA ) 1.0 0.0 3.0 !

assign (resid 23 and name HN ) (resid 23 and name HB1 ) 1.0 0.0 3.5 !

assign (resid 23 and name HN ) (resid 23 and name HB2 ) 1.0 0.0 3.5 !

assign (resid 23 and name HN ) (resid 23 and name HG# ) 1.0 0.0 4.5 !

assign (resid 23 and name HN ) (resid 23 and name HD# ) 1.0 0.0 4.5 !

assign (resid 23 and name HA ) (resid 23 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 23 and name HA ) (resid 23 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 23 and name HA ) (resid 23 and name HG# ) 1.0 0.0 3.0 !

assign (resid 23 and name HA ) (resid 23 and name HD# ) 1.0 0.0 4.0 !

assign (resid 23 and name HE ) (resid 23 and name HD# ) 1.0 0.0 4.0 !

assign (resid 23 and name HE ) (resid 23 and name HB1 ) 1.0 0.0 3.5 !

assign (resid 23 and name HE ) (resid 23 and name HB2 ) 1.0 0.0 3.5 !

assign (resid 23 and name HE ) (resid 23 and name HG# ) 1.0 0.0 4.5 !

!i,i+1

assign (resid 23 and name HA ) (resid 24 and name HN ) 1.0 0.0 2.5 !

assign (resid 23 and name HN ) (resid 24 and name HN ) 1.0 0.0 3.5 !

assign (resid 23 and name HA ) (resid 24 and name HB# ) 1.0 0.0 4.5 !

assign (resid 23 and name HN ) (resid 24 and name HG# ) 2.0 0.0 4.0 !

!i,i+2

assign (resid 23 and name HN ) (resid 25 and name HB1 ) 1.0 0.0 2.5 !

assign (resid 23 and name HN ) (resid 25 and name HB2 ) 1.0 0.0 2.5 !

assign (resid 23 and name HA ) (resid 25 and name HD21 ) 2.0 0.0 4.0 !

assign (resid 23 and name HA ) (resid 25 and name HD22 ) 2.0 0.0 4.0 !

assign (resid 23 and name HA ) (resid 25 and name HA ) 2.0 0.0 4.0 !

assign (resid 23 and name HB1 ) (resid 25 and name HB1 ) 3.0 0.0 4.0 !

assign (resid 23 and name HB2 ) (resid 25 and name HB2 ) 3.0 0.0 4.0 !

assign (resid 23 and name HB2 ) (resid 25 and name HB1 ) 3.0 0.0 4.0 !

assign (resid 23 and name HB1 ) (resid 25 and name HB2 ) 3.0 0.0 4.0 !

!i,i+3

assign (resid 23 and name HA ) (resid 26 and name HN ) 1.0 0.0 2.5 !

!i,j

assign (resid 23 and name HA ) (resid 28 and name HG# ) 3.0 0.0 4.0 !

assign (resid 23 and name HN ) (resid 28 and name HG# ) 2.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 24 and name HN ) (resid 24 and name HA ) 1.0 0.0 3.0 !

assign (resid 24 and name HN ) (resid 24 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 24 and name HN ) (resid 24 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 24 and name HN ) (resid 24 and name HG# ) 1.0 0.0 4.0 !

assign (resid 24 and name HA ) (resid 24 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 24 and name HA ) (resid 24 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 24 and name HA ) (resid 24 and name HG# ) 1.0 0.0 4.0 !

!i,i+1

assign (resid 24 and name HA ) (resid 25 and name HN ) 1.0 0.0 3.0 !

assign (resid 24 and name HN ) (resid 25 and name HN ) 1.0 0.0 3.5 !

assign (resid 24 and name HA ) (resid 25 and name HB1 ) 2.0 0.0 4.0 !

assign (resid 24 and name HA ) (resid 25 and name HB2 ) 2.0 0.0 4.0 !

assign (resid 24 and name HA ) (resid 25 and name HA ) 1.0 0.0 3.5 !

assign (resid 24 and name HB# ) (resid 25 and name HA ) 1.0 0.0 4.5 !

assign (resid 24 and name HN ) (resid 25 and name HB1 ) 2.0 0.0 4.0 !

    or (resid 24 and name HN ) (resid 25 and name HB2 )

assign (resid 24 and name HA ) (resid 25 and name HD21 ) 1.0 0.0 4.5 !

assign (resid 24 and name HA ) (resid 25 and name HD22 ) 1.0 0.0 4.5 !

assign (resid 24 and name HG# ) (resid 25 and name HA ) 1.0 0.0 4.0 !

!i,i+4

assign (resid 24 and name HG# ) (resid 28 and name HE21 ) 2.0 0.0 4.0 !

assign (resid 24 and name HG# ) (resid 28 and name HE22 ) 2.0 0.0 4.0 !

assign (resid 24 and name HG# ) (resid 28 and name HA ) 1.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 25 and name HN ) (resid 25 and name HA ) 3.0 0.0 4.0 !

assign (resid 25 and name HN ) (resid 25 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 25 and name HN ) (resid 25 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 25 and name HN ) (resid 25 and name HD21 ) 3.0 0.0 4.0 !

assign (resid 25 and name HN ) (resid 25 and name HD22 ) 3.0 0.0 4.0 !

assign (resid 25 and name HA ) (resid 25 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 25 and name HA ) (resid 25 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 25 and name HA ) (resid 25 and name HD21 ) 1.0 0.0 4.0 !

assign (resid 25 and name HA ) (resid 25 and name HD22 ) 1.0 0.0 4.0 !

assign (resid 25 and name HD21 ) (resid 25 and name HB1 ) 1.0 0.0 3.5 !

assign (resid 25 and name HD21 ) (resid 25 and name HB2 ) 1.0 0.0 3.5 !

assign (resid 25 and name HD22 ) (resid 25 and name HB1 ) 1.0 0.0 3.5 !

assign (resid 25 and name HD22 ) (resid 25 and name HB2 ) 1.0 0.0 3.5 !

assign (resid 25 and name HD21 ) (resid 25 and name HD22 ) 1.0 0.0 3.0 !

!i,i+1

assign (resid 25 and name HA ) (resid 26 and name HN ) 1.0 0.0 2.0 !

assign (resid 25 and name HN ) (resid 26 and name HN ) 1.0 0.0 2.0 !

assign (resid 25 and name HB1 ) (resid 26 and name HN ) 1.0 0.0 3.0 !

assign (resid 25 and name HB2 ) (resid 26 and name HN ) 1.0 0.0 3.0 !

assign (resid 25 and name HA ) (resid 26 and name HA ) 1.0 0.0 3.5 !

assign (resid 25 and name HB1 ) (resid 26 and name HD## ) 2.0 0.0 4.0 !

    or (resid 25 and name HB1 ) (resid 27 and name HD## )

assign (resid 25 and name HB2 ) (resid 26 and name HD## ) 2.0 0.0 4.0 !

    or (resid 25 and name HB2 ) (resid 27 and name HD## )

assign (resid 25 and name HD21 ) (resid 26 and name HN ) 3.0 0.0 4.0 !

    or (resid 25 and name HD22 ) (resid 26 and name HN )

!i,i+2

assign (resid 25 and name HD21 ) (resid 27 and name HB# ) 3.0 0.0 4.0 !

    or (resid 25 and name HD21 ) (resid 27 and name HG)

assign (resid 25 and name HD22 ) (resid 27 and name HB# ) 3.0 0.0 4.0 !

    or (resid 25 and name HD22 ) (resid 27 and name HG)

assign (resid 25 and name HB1 ) (resid 27 and name HN ) 2.0 0.0 4.0 !

    or (resid 25 and name HB2 ) (resid 27 and name HN )

assign (resid 25 and name HN ) (resid 27 and name HB1 ) 2.0 0.0 4.0 !

    or (resid 25 and name HN ) (resid 27 and name HB2 )

    or (resid 25 and name HN ) (resid 27 and name HG )

!i,i+3

assign (resid 25 and name HA ) (resid 28 and name HN ) 1.0 0.0 2.5 !

assign (resid 25 and name HA ) (resid 28 and name HB1 ) 1.0 0.0 3.5 !

assign (resid 25 and name HA ) (resid 28 and name HB2 ) 1.0 0.0 3.5 !

assign (resid 25 and name HA ) (resid 28 and name HG1 ) 1.0 0.0 3.5 !

assign (resid 25 and name HA ) (resid 28 and name HG2 ) 1.0 0.0 3.5 !

assign (resid 25 and name HB1 ) (resid 28 and name HN ) 3.0 0.0 4.0 !

assign (resid 25 and name HB2 ) (resid 28 and name HN ) 3.0 0.0 4.0 !

assign (resid 25 and name HB1 ) (resid 28 and name HG1 ) 2.0 0.0 4.0 !

assign (resid 25 and name HB2 ) (resid 28 and name HG2 ) 2.0 0.0 4.0 !

assign (resid 25 and name HB1 ) (resid 28 and name HG2 ) 2.0 0.0 4.0 !

assign (resid 25 and name HB2 ) (resid 28 and name HG1 ) 2.0 0.0 4.0 !

assign (resid 25 and name HN ) (resid 28 and name HG1 ) 2.0 0.0 4.0 !

    or (resid 25 and name HN ) (resid 28 and name HG2 )

assign (resid 25 and name HN ) (resid 28 and name HB1 ) 2.0 0.0 4.0 !

    or (resid 25 and name HN ) (resid 28 and name HB2 )

!i,i+4

assign (resid 25 and name HD21 ) (resid 29 and name HE1 ) 2.0 0.0 4.0 !

assign (resid 25 and name HD22 ) (resid 29 and name HE1 ) 2.0 0.0 4.0 !

assign (resid 25 and name HA ) (resid 29 and name HD2 ) 2.0 0.0 4.0 !

assign (resid 25 and name HB1 ) (resid 29 and name HD2 ) 2.0 0.0 4.0 !

assign (resid 25 and name HB2 ) (resid 29 and name HD1 ) 2.0 0.0 4.0 !

assign (resid 25 and name HA ) (resid 29 and name HB# ) 2.0 0.0 4.0 !

assign (resid 25 and name HD2# ) (resid 29 and name HA ) 3.0 0.0 4.0 !

assign (resid 25 and name HB1 ) (resid 29 and name HA ) 2.0 0.0 4.0 !

    or (resid 25 and name HB2 ) (resid 29 and name HA )

!----------------------------------------------------------------------------

!i,i

assign (resid 26 and name HN ) (resid 26 and name HA ) 1.0 0.0 3.0 !

assign (resid 26 and name HA ) (resid 26 and name HD## ) 3.0 0.0 4.0 !

!i,i+1

assign (resid 26 and name HA ) (resid 27 and name HN ) 1.0 0.0 4.0 !

assign (resid 26 and name HN ) (resid 27 and name HN ) 1.0 0.0 4.0 !

!i,i+2

assign (resid 26 and name HN ) (resid 28 and name HN ) 1.0 0.0 4.0 !

!i,i+3

assign (resid 26 and name HN ) (resid 29 and name HB# ) 1.0 0.0 4.5 !

assign (resid 26 and name HD## ) (resid 29 and name HB# ) 3.0 0.0 4.0 !

    or (resid 27 and name HD## ) (resid 29 and name HB# )

assign (resid 27 and name HB# ) (resid 29 and name HB# ) 3.0 0.0 5.0 !

    or (resid 27 and name HG) (resid 29 and name HB# )

!i,i+4

assign (resid 26 and name HN ) (resid 30 and name HG# ) 2.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 27 and name HN ) (resid 27 and name HA ) 3.0 0.0 4.0 !

assign (resid 27 and name HN ) (resid 27 and name HB# ) 1.0 0.0 3.0 !

assign (resid 27 and name HN ) (resid 27 and name HG ) 1.0 0.0 3.0 !

!i,i+1

assign (resid 27 and name HA ) (resid 28 and name HN ) 1.0 0.0 3.5 !

assign (resid 27 and name HN ) (resid 28 and name HN ) 1.0 0.0 3.5 !

assign (resid 27 and name HB# ) (resid 28 and name HN ) 2.0 0.0 4.0 !

assign (resid 27 and name HG# ) (resid 28 and name HN ) 2.0 0.0 4.0 !

assign (resid 27 and name HB# ) (resid 28 and name HE21 ) 3.0 0.0 4.0 !

assign (resid 27 and name HB# ) (resid 28 and name HE22 ) 3.0 0.0 4.0 !

assign (resid 27 and name HG ) (resid 28 and name HE21 ) 2.0 0.0 4.0 !

assign (resid 27 and name HG ) (resid 28 and name HE22 ) 2.0 0.0 4.0 !

assign (resid 27 and name HD## ) (resid 28 and name HN ) 1.0 0.0 4.5 !

!i,i+2

assign (resid 27 and name HA ) (resid 29 and name HN ) 2.0 0.0 4.0 !

assign (resid 27 and name HA ) (resid 29 and name HB# ) 1.0 0.0 4.0 !

assign (resid 27 and name HB1 ) (resid 29 and name HD2 ) 2.0 0.0 4.0 !

assign (resid 27 and name HB2 ) (resid 29 and name HD2 ) 2.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 28 and name HN ) (resid 28 and name HA ) 1.0 0.0 3.0 !

assign (resid 28 and name HN ) (resid 28 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 28 and name HN ) (resid 28 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 28 and name HN ) (resid 28 and name HG1 ) 1.0 0.0 3.0 !

assign (resid 28 and name HN ) (resid 28 and name HG2 ) 1.0 0.0 3.0 !

assign (resid 28 and name HA ) (resid 28 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 28 and name HA ) (resid 28 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 28 and name HA ) (resid 28 and name HG1 ) 1.0 0.0 3.5 !

assign (resid 28 and name HA ) (resid 28 and name HG2 ) 1.0 0.0 3.5 !

assign (resid 28 and name HA ) (resid 28 and name HE21 ) 2.0 0.0 4.0 !

assign (resid 28 and name HA ) (resid 28 and name HE22 ) 2.0 0.0 4.0 !

assign (resid 28 and name HE21 ) (resid 28 and name HG1 ) 1.0 0.0 3.5 !

assign (resid 28 and name HE21 ) (resid 28 and name HG2 ) 1.0 0.0 3.5 !

assign (resid 28 and name HE22 ) (resid 28 and name HG1 ) 1.0 0.0 3.5 !

assign (resid 28 and name HE22 ) (resid 28 and name HG2 ) 1.0 0.0 3.5 !

assign (resid 28 and name HE21 ) (resid 28 and name HE22 ) 1.0 0.0 3.0 !

assign (resid 28 and name HE21 ) (resid 28 and name HB1 ) 2.0 0.0 4.0 !

assign (resid 28 and name HE22 ) (resid 28 and name HB1 ) 2.0 0.0 4.0 !

assign (resid 28 and name HE21 ) (resid 28 and name HB2 ) 2.0 0.0 4.0 !

assign (resid 28 and name HE22 ) (resid 28 and name HB2 ) 2.0 0.0 4.0 !

!i,i+1

assign (resid 28 and name HA ) (resid 29 and name HN ) 1.0 0.0 2.5 !

assign (resid 28 and name HN ) (resid 29 and name HN ) 1.0 0.0 3.5 !

assign (resid 28 and name HG1) (resid 29 and name HD2 ) 1.0 0.0 4.0 !

    or (resid 28 and name HG2) (resid 29 and name HD2 ) 

assign (resid 28 and name HN ) (resid 29 and name HA ) 1.0 0.0 3.5 !

assign (resid 26 and name HA ) (resid 29 and name HB# ) 3.0 0.0 4.0 !

assign (resid 28 and name HG1 ) (resid 29 and name HN ) 1.0 0.0 4.0 !

assign (resid 28 and name HG2 ) (resid 29 and name HN ) 1.0 0.0 4.0 !

assign (resid 28 and name HN ) (resid 29 and name HB# ) 1.0 0.0 3.5 !

assign (resid 28 and name HA ) (resid 29 and name HD2 ) 2.0 0.0 4.0 !

assign (resid 28 and name HG# ) (resid 29 and name HA ) 2.0 0.0 4.0 !

assign (resid 28 and name HB# ) (resid 29 and name HA ) 1.0 0.0 4.0 !

!i,j

assign (resid 28 and name HA ) (resid 34 and name HG1#) 1.0 0.0 4.5 !

assign (resid 28 and name HA ) (resid 34 and name HB#) 1.0 0.0 4.5 !

!----------------------------------------------------------------------------

!i,i

assign (resid 29 and name HN ) (resid 29 and name HA ) 1.0 0.0 3.0 !

assign (resid 29 and name HN ) (resid 29 and name HB# ) 1.0 0.0 4.0 !

assign (resid 29 and name HN ) (resid 29 and name HD2 ) 2.0 0.0 4.0 !

assign (resid 29 and name HA ) (resid 29 and name HB# ) 1.0 0.0 4.0 !

assign (resid 29 and name HA ) (resid 29 and name HD2 ) 1.0 0.0 3.5 !

assign (resid 29 and name HA ) (resid 29 and name HE1 ) 3.0 0.0 4.0 !

assign (resid 29 and name HB# ) (resid 29 and name HD2 ) 1.0 0.0 4.5 !

assign (resid 29 and name HB# ) (resid 29 and name HE1 ) 2.0 0.0 4.5 !

assign (resid 29 and name HD2 ) (resid 29 and name HB# ) 2.0 0.0 4.5 !

assign (resid 29 and name HE1 ) (resid 29 and name HB# ) 2.0 0.0 4.5 !

assign (resid 29 and name HD2 ) (resid 29 and name HE1 ) 2.0 0.0 4.0 !

!i,i+1

assign (resid 29 and name HA ) (resid 30 and name HN ) 1.0 0.0 2.0 !

assign (resid 29 and name HN ) (resid 30 and name HN ) 1.0 0.0 2.5 !

assign (resid 29 and name HB# ) (resid 30 and name HN ) 1.0 0.0 3.0 !

assign (resid 29 and name HD2 ) (resid 30 and name HN ) 1.0 0.0 2.5 !

assign (resid 29 and name HD2 ) (resid 30 and name HB1 ) 1.0 0.0 4.0 !

assign (resid 29 and name HD2 ) (resid 30 and name HB2 ) 1.0 0.0 4.0 !

assign (resid 29 and name HD2 ) (resid 30 and name HG# ) 2.0 0.0 4.0 !

assign (resid 29 and name HD2 ) (resid 30 and name HA ) 1.0 0.0 3.5 !

assign (resid 29 and name HB# ) (resid 30 and name HA ) 3.0 0.0 4.0 !

assign (resid 29 and name HB# ) (resid 30 and name HG1 ) 3.0 0.0 4.0 !

assign (resid 29 and name HB# ) (resid 30 and name HG2 ) 3.0 0.0 4.0 !

!i,i+2

assign (resid 29 and name HA ) (resid 31 and name HN ) 1.0 0.0 2.5 !

assign (resid 29 and name HD2 ) (resid 31 and name HN ) 3.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 30 and name HN ) (resid 30 and name HA ) 1.0 0.0 3.0 !

assign (resid 30 and name HN ) (resid 30 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 30 and name HN ) (resid 30 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 30 and name HN ) (resid 30 and name HG# ) 1.0 0.0 4.0 !

assign (resid 30 and name HA ) (resid 30 and name HB# ) 1.0 0.0 4.0 !

assign (resid 30 and name HA ) (resid 30 and name HG# ) 1.0 0.0 4.0 !

!i,i+1

assign (resid 30 and name HA ) (resid 31 and name HN ) 1.0 0.0 3.0 !

assign (resid 30 and name HN ) (resid 31 and name HN ) 1.0 0.0 4.0 !

!i,i+2

assign (resid 30 and name HG# ) (resid 33 and name HN ) 3.0 0.0 4.0 !

assign (resid 30 and name HB# ) (resid 33 and name HN ) 3.0 0.0 4.0 !

!i,i+4

assign (resid 30 and name HA ) (resid 34 and name HG2# ) 3.0 0.0 4.5 !

assign (resid 30 and name HG1 ) (resid 34 and name HG2# ) 3.0 0.0 4.5 !

assign (resid 30 and name HG2 ) (resid 34 and name HG2# ) 3.0 0.0 4.5 !

!i,j

assign (resid 30 and name HN ) (resid 35 and name HB# ) 2.0 0.0 4.0 

!----------------------------------------------------------------------------

!i,i+1

assign (resid 31 and name HA ) (resid 32 and name HN ) 1.0 0.0 2.0 !

assign (resid 31 and name HN ) (resid 32 and name HN ) 1.0 0.0 2.5 !

!i,i+2

assign (resid 31 and name HN ) (resid 33 and name HN ) 3.0 0.0 4.0 !

!i,i+3

assign (resid 31 and name HA ) (resid 34 and name HG2# ) 2.0 0.0 4.5 !

!----------------------------------------------------------------------------

!i,i

assign (resid 32 and name HN ) (resid 32 and name HA ) 1.0 0.0 3.0 !

assign (resid 32 and name HN ) (resid 32 and name HB# ) 1.0 0.0 4.0 !

assign (resid 32 and name HA ) (resid 32 and name HB# ) 1.0 0.0 4.0 !

!i,i+1

assign (resid 32 and name HA ) (resid 33 and name HN ) 1.0 0.0 2.0 !

assign (resid 32 and name HN ) (resid 33 and name HN ) 1.0 0.0 2.5 !

!i,i+2

assign (resid 32 and name HA ) (resid 34 and name HN ) 1.0 0.0 2.5 !

!i,i+3

assign (resid 32 and name HA ) (resid 35 and name HN ) 1.0 0.0 2.5 !

!----------------------------------------------------------------------------

!i,i

assign (resid 33 and name HN ) (resid 33 and name HA ) 1.0 0.0 3.0 !

assign (resid 33 and name HN ) (resid 33 and name HB1 ) 1.0 0.0 3.0 !

assign (resid 33 and name HN ) (resid 33 and name HB2 ) 1.0 0.0 3.0 !

assign (resid 33 and name HN ) (resid 33 and name HG# ) 1.0 0.0 4.0 !

assign (resid 33 and name HN ) (resid 33 and name HD# ) 1.0 0.0 4.0 !

assign (resid 33 and name HA ) (resid 33 and name HE# ) 1.0 0.0 4.5 !

!i,i+1

assign (resid 33 and name HA ) (resid 34 and name HN ) 1.0 0.0 2.0 !

assign (resid 33 and name HN ) (resid 34 and name HN ) 1.0 0.0 3.5 !

assign (resid 33 and name HN ) (resid 34 and name HG2# ) 2.0 0.0 4.0 !

assign (resid 33 and name HE# ) (resid 34 and name HG2# ) 2.0 0.0 4.5 !

!i,i+2

assign (resid 33 and name HA ) (resid 35 and name HN ) 1.0 0.0 3.5 !

!i,i+3

assign (resid 33 and name HG# ) (resid 36 and name HE ) 1.0 0.0 4.5 !

assign (resid 33 and name HD# ) (resid 36 and name HE ) 1.0 0.0 4.5 !

assign (resid 33 and name HA ) (resid 36 and name HE ) 2.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 34 and name HN ) (resid 34 and name HA ) 1.0 0.0 3.0 !

assign (resid 34 and name HN ) (resid 34 and name HB ) 1.0 0.0 3.0 !

assign (resid 34 and name HN ) (resid 34 and name HG2# ) 2.0 0.0 4.0 !

assign (resid 34 and name HA ) (resid 34 and name HB ) 1.0 0.0 3.0 !

assign (resid 34 and name HA ) (resid 34 and name HG2# ) 1.0 0.0 4.5 !

assign (resid 34 and name HB ) (resid 34 and name HG2# ) 1.0 0.0 4.5 !

!i,i+1

assign (resid 34 and name HA ) (resid 35 and name HN ) 1.0 0.0 2.5 !

assign (resid 34 and name HN ) (resid 35 and name HN ) 1.0 0.0 2.5 !

assign (resid 34 and name HG2# ) (resid 35 and name HN ) 1.0 0.0 3.5 !

!i,i+2

assign (resid 34 and name HA ) (resid 36 and name HN ) 1.0 0.0 4.0 !

assign (resid 34 and name HN ) (resid 36 and name HN ) 1.0 0.0 4.0 !

assign (resid 34 and name HG2# ) (resid 36 and name HN ) 2.0 0.0 4.0 !

assign (resid 34 and name HG2# ) (resid 36 and name HB# ) 2.0 0.0 4.0 !

assign (resid 34 and name HG2# ) (resid 36 and name HG# ) 2.0 0.0 4.0 !

!i,i+3

assign (resid 34 and name HN ) (resid 37 and name HG# ) 2.0 0.0 4.0 !

    or (resid 34 and name HN ) (resid 37 and name HD#)

assign (resid 34 and name HN ) (resid 37 and name HB# ) 2.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 35 and name HN ) (resid 35 and name HA ) 1.0 0.0 3.0 !

assign (resid 35 and name HN ) (resid 35 and name HB# ) 1.0 0.0 3.5 !

assign (resid 35 and name HA ) (resid 35 and name HB# ) 1.0 0.0 3.5 !

!i,i+1

assign (resid 35 and name HA ) (resid 36 and name HN ) 1.0 0.0 4.0 !

assign (resid 35 and name HN ) (resid 36 and name HN ) 1.0 0.0 2.0 !

assign (resid 35 and name HB# ) (resid 36 and name HN ) 1.0 0.0 3.5 !

assign (resid 35 and name HN ) (resid 36 and name HG# ) 2.0 0.0 4.0 !

assign (resid 35 and name HN ) (resid 36 and name HB1) 1.0 0.0 2.5 !

    or (resid 35 and name HN ) (resid 36 and name HB2)

assign (resid 35 and name HN ) (resid 36 and name HB1 ) 3.0 0.0 4.0 !

assign (resid 35 and name HN ) (resid 36 and name HB2 ) 3.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 36 and name HN ) (resid 36 and name HA ) 1.0 0.0 3.0 !

assign (resid 36 and name HN ) (resid 36 and name HB1 ) 1.0 0.0 3.5 !

assign (resid 36 and name HN ) (resid 36 and name HB2 ) 1.0 0.0 3.5 !

assign (resid 36 and name HN ) (resid 36 and name HG# ) 1.0 0.0 4.5 !

assign (resid 36 and name HA ) (resid 36 and name HD# ) 1.0 0.0 4.5 !

assign (resid 36 and name HE ) (resid 36 and name HD# ) 1.0 0.0 4.5 !

assign (resid 36 and name HE ) (resid 36 and name HB1 ) 1.0 0.0 3.5 !

assign (resid 36 and name HE ) (resid 36 and name HB2 ) 1.0 0.0 3.5 !

assign (resid 36 and name HE ) (resid 36 and name HG# ) 1.0 0.0 4.5 !

!i,i+1

assign (resid 36 and name HA ) (resid 37 and name HN ) 1.0 0.0 2.5 !

assign (resid 36 and name HN ) (resid 37 and name HN ) 1.0 0.0 3.5 !

assign (resid 36 and name HD# ) (resid 37 and name HN ) 2.0 0.0 4.0 !

assign (resid 36 and name HB# ) (resid 37 and name HA ) 2.0 0.0 4.0 !

!----------------------------------------------------------------------------

!i,i

assign (resid 37 and name HN ) (resid 37 and name HA ) 1.0 0.0 3.0 !

assign (resid 37 and name HN ) (resid 37 and name HB1 ) 1.0 0.0 3.5 !

assign (resid 37 and name HN ) (resid 37 and name HB2 ) 1.0 0.0 3.5 !

assign (resid 37 and name HN ) (resid 37 and name HG# ) 1.0 0.0 4.5 !

assign (resid 37 and name HN ) (resid 37 and name HD# ) 1.0 0.0 4.5 !

!i,i+1

assign (resid 37 and name HA ) (resid 38 and name HN ) 1.0 0.0 2.0 !

assign (resid 37 and name HN ) (resid 38 and name HN ) 1.0 0.0 2.0 !

assign (resid 37 and name HB1 ) (resid 38 and name HN ) 1.0 0.0 2.5 !

assign (resid 37 and name HB2 ) (resid 38 and name HN ) 1.0 0.0 2.5 !

assign (resid 37 and name HG# ) (resid 38 and name HN ) 1.0 0.0 3.5 !

assign (resid 37 and name HD# ) (resid 38 and name HN ) 1.0 0.0 3.5 !

!----------------------------------------------------------------------------

!i,i

assign (resid 38 and name HN ) (resid 38 and name HA ) 1.0 0.0 3.0 !

assign (resid 38 and name HN ) (resid 38 and name HB# ) 1.0 0.0 4.0 !

assign (resid 38 and name HA ) (resid 38 and name HB# ) 1.0 0.0 4.0 !

!----------------------------------------------------------------------------
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Contact the webmaster for help, if required. Friday, May 3, 2024 5:46:57 PM GMT (wattos1)
image	mrblock_id	pdb_id	cing	in_recoord	in_dress	stage	position	program	type	subtype	subsubtype
	3864	1e9k	cing	recoord	dress	1-original	1	XPLOR/CNS	distance	NOE	ambi