NMR Restraints Grid

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

image mrblock_id pdb_id cing stage program type subtype subsubtype
369873 1biv cing 3-converted-DOCR XPLOR/CNS distance general distance ambi


 assi 
   (( segid "   B" and resid 74   and name  HN  ))
   (( segid "   B" and resid 77   and name  HN  ))

      4.500     2.000     2.000
 assi 
   (( segid "   B" and resid 78   and name  HA  ))
   (( segid "   B" and resid 73   and name  HN  ))

      3.500     2.000     2.000
 assi 
   (( segid "   B" and resid 74   and name  HN  ))
   (( segid "   B" and resid 76   and name  HN  ))

      4.500     2.000     2.000
 assi 
   (( segid "   B" and resid 72   and name  HN  ))
   (( segid "   B" and resid 73   and name  HN  ))

      4.500     2.000     2.000
 assi 
   (( segid "   B" and resid 72   and name  HG1 ))
   (( segid "   B" and resid 76   and name  HA1 ))

      4.500     2.000     2.000
 assi 
   (  segid "   B" and resid 72   and name  HG2#)
   (  segid "   B" and resid 78   and name  HD# )

      4.500     2.000     2.000
 assi 
   (  segid "   B" and resid 67   and name  HB# )
   (( segid "   B" and resid 68   and name  HN  ))

      4.000     2.000     2.000
 assi 
   (( segid "   B" and resid 71   and name  HA1 ))
   (( segid "   B" and resid 72   and name  HN  ))

      4.000     1.000     1.000
 assi 
   (( segid "   B" and resid 73   and name  HB1 ))
   (( segid "   B" and resid 73   and name  HE  ))

      4.500     1.000     2.000
 assi 
   (( segid "   B" and resid 74   and name  HA2 ))
   (( segid "   B" and resid 72   and name  HG1 ))

      4.500     1.000     2.000
 assi 
   (( segid "   B" and resid 76   and name  HA1 ))
   (( segid "   B" and resid 72   and name  HG1 ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 13   and name  H61 ))
   (( segid "   B" and resid 70   and name  HD2 ))

      3.500     1.500     1.500
 assi 
   (( segid "   A" and resid 13   and name  H61 ))
   (( segid "   B" and resid 70   and name  HD1 ))

      3.500     1.500     1.500
 assi 
   (( segid "   A" and resid 13   and name  H61 ))
   (  segid "   B" and resid 70   and name  HB# )

      4.500     2.000     2.000
 assi 
   (( segid "   A" and resid 13   and name  H61 ))
   (  segid "   B" and resid 70   and name  HG# )

      4.500     2.000     2.000
 assi 
   (( segid "   A" and resid 25   and name  H42 ))
   (  segid "   B" and resid 73   and name  HD# )

      4.500     2.000     2.000
 assi 
   (( segid "   A" and resid 11   and name  H1  ))
   (( segid "   A" and resid 11   and name  H22 ))

      2.700     0.800     0.800
 assi 
   (( segid "   A" and resid 11   and name  H1  ))
   (( segid "   A" and resid 24   and name  H3  ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 11   and name  H1  ))
   (( segid "   A" and resid 25   and name  H1' ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 11   and name  H1  ))
   (( segid "   A" and resid 25   and name  H41 ))

      2.700     0.800     2.000
 assi 
   (( segid "   A" and resid 11   and name  H1  ))
   (( segid "   A" and resid 25   and name  H42 ))

      2.700     0.800     2.000
 assi 
   (( segid "   A" and resid 11   and name  H1  ))
   (( segid "   B" and resid 73   and name  HB1 ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 11   and name  H1  ))
   (( segid "   B" and resid 73   and name  HB2 ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 11   and name  H1  ))
   (  segid "   B" and resid 73   and name  HD# )

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 11   and name  H1  ))
   (( segid "   B" and resid 73   and name  HE  ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 11   and name  H1  ))
   (  segid "   B" and resid 73   and name  HG# )

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (( segid "   A" and resid 13   and name  H2  ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (( segid "   A" and resid 14   and name  H1' ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (( segid "   A" and resid 15   and name  H1' ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (( segid "   A" and resid 22   and name  H1  ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (( segid "   A" and resid 23   and name  H41 ))

      2.700     0.800     2.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (( segid "   A" and resid 23   and name  H42 ))

      2.700     0.800     2.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (( segid "   A" and resid 23   and name  H5  ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (( segid "   A" and resid 24   and name  H1' ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (( segid "   A" and resid 24   and name  H3  ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (( segid "   A" and resid 24   and name  H5  ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (( segid "   A" and resid 24   and name  H6  ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (  segid "   B" and resid 70   and name  HB# )

      4.000     1.000     1.500
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (( segid "   B" and resid 70   and name  HD1 ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (( segid "   B" and resid 70   and name  HD2 ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (  segid "   B" and resid 70   and name  HG# )

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (( segid "   B" and resid 70   and name  HE  ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 14   and name  H1  ))
   (  segid "   B" and resid 79   and name  HD1#)

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 16   and name  H3  ))
   (( segid "   A" and resid 21   and name  H2  ))

      2.700     0.800     0.800
 assi 
   (( segid "   A" and resid 16   and name  H3  ))
   (( segid "   A" and resid 21   and name  H62 ))

      4.000     2.000     1.000
 assi 
   (( segid "   A" and resid 16   and name  H3  ))
   (( segid "   A" and resid 21   and name  H61 ))

      4.000     2.000     1.000
 assi 
   (( segid "   A" and resid 16   and name  H3  ))
   (( segid "   A" and resid 22   and name  H1' ))

      4.500     2.000     2.000
 assi 
   (( segid "   A" and resid 16   and name  H3  ))
   (( segid "   A" and resid 22   and name  H1  ))

      4.500     2.000     1.000
 assi 
   (( segid "   A" and resid 21   and name  H8  ))
   (( segid "   B" and resid 68   and name  HD1 ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 21   and name  H8  ))
   (( segid "   B" and resid 68   and name  HD2 ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 22   and name  H1  ))
   (( segid "   A" and resid 15   and name  H41 ))

      2.700     0.800     2.000
 assi 
   (( segid "   A" and resid 22   and name  H1  ))
   (( segid "   A" and resid 15   and name  H42 ))

      2.700     0.800     2.000
 assi 
   (( segid "   A" and resid 22   and name  H1  ))
   (( segid "   A" and resid 15   and name  H5  ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 22   and name  H1  ))
   (( segid "   A" and resid 16   and name  H1' ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 22   and name  H1  ))
   (( segid "   A" and resid 21   and name  H2  ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 22   and name  H1  ))
   (( segid "   A" and resid 22   and name  H21 ))

      2.700     0.800     0.800
 assi 
   (( segid "   A" and resid 22   and name  H1  ))
   (( segid "   A" and resid 23   and name  H41 ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 22   and name  H1  ))
   (( segid "   A" and resid 23   and name  H42 ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 22   and name  H1  ))
   (  segid "   B" and resid 70   and name  HB# )

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 22   and name  H1  ))
   (  segid "   B" and resid 70   and name  HD# )

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 22   and name  H1  ))
   (  segid "   B" and resid 70   and name  HG# )

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (( segid "   A" and resid 13   and name  H2  ))

      2.700     0.800     0.800
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (( segid "   A" and resid 13   and name  H61 ))

      2.700     0.800     2.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (( segid "   A" and resid 13   and name  H62 ))

      2.700     0.800     2.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (( segid "   A" and resid 14   and name  H1  ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (( segid "   A" and resid 14   and name  H1' ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (( segid "   A" and resid 23   and name  H41 ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (( segid "   A" and resid 24   and name  H1' ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (( segid "   A" and resid 24   and name  H5  ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (( segid "   A" and resid 25   and name  H1' ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (( segid "   A" and resid 25   and name  H41 ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (( segid "   A" and resid 25   and name  H42 ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (( segid "   A" and resid 25   and name  H5  ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (  segid "   B" and resid 70   and name  HB# )

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (( segid "   B" and resid 70   and name  HD1 ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (( segid "   B" and resid 70   and name  HD2 ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (  segid "   B" and resid 70   and name  HG# )

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 24   and name  H3  ))
   (  segid "   B" and resid 79   and name  HD1#)

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 24   and name  H6  ))
   (( segid "   A" and resid 25   and name  H5  ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 25   and name  H6  ))
   (( segid "   A" and resid 26   and name  H6  ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 27   and name  H1  ))
   (( segid "   A" and resid 26   and name  H41 ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 27   and name  H1  ))
   (( segid "   A" and resid 27   and name  H21 ))

      2.700     0.800     0.800
 assi 
   (( segid "   A" and resid 27   and name  H1  ))
   (( segid "   A" and resid 28   and name  H1' ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 27   and name  H1  ))
   (( segid "   A" and resid 28   and name  H2  ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 28   and name  H2  ))
   (( segid "   A" and resid 28   and name  H1' ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 29   and name  H1  ))
   (( segid "   A" and resid 28   and name  H2  ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 29   and name  H1  ))
   (( segid "   A" and resid 28   and name  H61 ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 29   and name  H1  ))
   (( segid "   A" and resid 30   and name  H1' ))

      4.000     2.000     2.000
 assi 
   (( segid "   A" and resid 30   and name  H5  ))
   (( segid "   A" and resid 31   and name  H6  ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 8    and name  H6  ))
   (( segid "   B" and resid 77   and name  HE  ))

      3.000     1.000     2.000
 assi 
   (( segid "   A" and resid 7    and name  H3  ))
   (( segid "   A" and resid 27   and name  H1  ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 7    and name  H3  ))
   (( segid "   A" and resid 29   and name  H1  ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 9    and name  H1  ))
   (( segid "   A" and resid 11   and name  H1  ))

      4.000     1.000     1.000
 assi 
   (( segid "   A" and resid 9    and name  H1  ))
   (( segid "   A" and resid 27   and name  H1  ))

      4.500     1.000     2.000
 assi 
   (( segid "   A" and resid 4    and name  H1' ))
   (( segid "   A" and resid 4    and name  H8  ))

      3.570     1.070     1.070
 assi 
   (( segid "   A" and resid 5    and name  H8  ))
   (( segid "   A" and resid 4    and name  H8  ))

      4.210     1.260     1.260
 assi 
   (( segid "   A" and resid 5    and name  H8  ))
   (( segid "   A" and resid 5    and name  H1' ))

      3.250     0.970     0.970
 assi 
   (( segid "   A" and resid 5    and name  H1' ))
   (( segid "   A" and resid 6    and name  H5  ))

      4.790     1.440     1.440
 assi 
   (( segid "   A" and resid 6    and name  H1' ))
   (( segid "   A" and resid 6    and name  H6  ))

      3.300     0.990     0.990
 assi 
   (( segid "   A" and resid 6    and name  H1' ))
   (( segid "   A" and resid 6    and name  H5  ))

      4.510     1.350     1.350
 assi 
   (( segid "   A" and resid 7    and name  H5  ))
   (( segid "   A" and resid 6    and name  H5  ))

      4.040     1.210     1.210
 assi 
   (( segid "   A" and resid 6    and name  H1' ))
   (( segid "   A" and resid 7    and name  H6  ))

      3.280     0.980     1.300
 assi 
   (( segid "   A" and resid 7    and name  H5  ))
   (( segid "   A" and resid 7    and name  H1' ))

      3.390     1.020     2.000
 assi 
   (( segid "   A" and resid 7    and name  H1' ))
   (( segid "   A" and resid 7    and name  H6  ))

      3.360     1.010     1.010
 assi 
   (( segid "   A" and resid 8    and name  H6  ))
   (( segid "   A" and resid 7    and name  H6  ))

      3.980     1.190     1.190
 assi 
   (( segid "   A" and resid 8    and name  H5  ))
   (( segid "   A" and resid 7    and name  H6  ))

      3.530     1.060     1.060
 assi 
   (( segid "   A" and resid 8    and name  H1' ))
   (( segid "   A" and resid 8    and name  H5  ))

      3.410     1.020     1.590
 assi 
   (( segid "   A" and resid 28   and name  H2  ))
   (( segid "   A" and resid 8    and name  H1' ))

      3.070     0.920     0.920
 assi 
   (( segid "   A" and resid 28   and name  H2  ))
   (( segid "   A" and resid 8    and name  H6  ))

      4.560     1.370     1.370
 assi 
   (( segid "   B" and resid 77   and name  HD1 ))
   (( segid "   A" and resid 8    and name  H5  ))

      2.940     0.880     0.880
 assi 
   (( segid "   A" and resid 8    and name  H6  ))
   (( segid "   B" and resid 77   and name  HD2 ))

      3.920     1.180     1.180
 assi 
   (( segid "   A" and resid 8    and name  H5  ))
   (( segid "   B" and resid 77   and name  HD2 ))

      2.710     0.810     0.810
 assi 
   (( segid "   A" and resid 9    and name  H1' ))
   (( segid "   A" and resid 9    and name  H8  ))

      3.110     0.930     0.930
 assi 
   (( segid "   A" and resid 11   and name  H8  ))
   (( segid "   A" and resid 10   and name  H6  ))

      4.020     1.210     1.210
 assi 
   (( segid "   A" and resid 10   and name  H1' ))
   (( segid "   A" and resid 10   and name  H5  ))

      4.150     1.250     1.250
 assi 
   (( segid "   A" and resid 13   and name  H8  ))
   (( segid "   A" and resid 11   and name  H3' ))

      4.370     1.310     1.310
 assi 
   (  segid "   B" and resid 70   and name  HD# )
   (( segid "   A" and resid 10   and name  H5  ))

      3.200     0.960     0.960
 assi 
   (( segid "   B" and resid 79   and name  HA  ))
   (( segid "   A" and resid 10   and name  H5  ))

      2.840     0.850     1.160
 assi 
   (( segid "   B" and resid 79   and name  HB  ))
   (( segid "   A" and resid 10   and name  H6  ))

      3.740     1.120     1.120
 assi 
   (( segid "   B" and resid 79   and name  HG11))
   (( segid "   A" and resid 10   and name  H6  ))

      3.180     0.950     1.820
 assi 
   (( segid "   A" and resid 10   and name  H6  ))
   (  segid "   B" and resid 79   and name  HD1#)

      3.820     1.150     1.150
 assi 
   (( segid "   B" and resid 79   and name  HG11))
   (( segid "   A" and resid 10   and name  H5  ))

      2.530     0.760     2.500
 assi 
   (( segid "   A" and resid 10   and name  H5  ))
   (( segid "   B" and resid 79   and name  HB  ))

      2.360     0.710     2.600
 assi 
   (  segid "   B" and resid 79   and name  HD1#)
   (( segid "   A" and resid 10   and name  H5  ))

      2.910     0.870     0.870
 assi 
   (( segid "   A" and resid 10   and name  H6  ))
   (( segid "   B" and resid 79   and name  HG12))

      3.200     0.960     1.800
 assi 
   (( segid "   A" and resid 13   and name  H8  ))
   (( segid "   A" and resid 13   and name  H2' ))

      3.260     0.980     0.980
 assi 
   (( segid "   A" and resid 13   and name  H8  ))
   (( segid "   A" and resid 13   and name  H1' ))

      2.980     0.890     0.890
 assi 
   (( segid "   A" and resid 13   and name  H1' ))
   (( segid "   A" and resid 13   and name  H2' ))

      2.590     0.780     0.780
 assi 
   (( segid "   A" and resid 13   and name  H2  ))
   (( segid "   A" and resid 13   and name  H1' ))

      4.560     1.370     1.370
 assi 
   (( segid "   A" and resid 13   and name  H2  ))
   (( segid "   A" and resid 13   and name  H2' ))

      4.100     1.230     1.230
 assi 
   (( segid "   A" and resid 14   and name  H1' ))
   (( segid "   A" and resid 13   and name  H2' ))

      3.850     1.160     1.160
 assi 
   (( segid "   A" and resid 14   and name  H1' ))
   (( segid "   A" and resid 13   and name  H2  ))

      3.530     1.060     1.060
 assi 
   (( segid "   A" and resid 13   and name  H1' ))
   (( segid "   A" and resid 14   and name  H8  ))

      3.260     0.980     0.980
 assi 
   (( segid "   A" and resid 13   and name  H2  ))
   (( segid "   A" and resid 14   and name  H8  ))

      4.200     1.260     1.260
 assi 
   (( segid "   A" and resid 13   and name  H2' ))
   (( segid "   A" and resid 14   and name  H8  ))

      2.350     0.700     0.700
 assi 
   (( segid "   A" and resid 14   and name  H8  ))
   (( segid "   A" and resid 13   and name  H8  ))

      3.530     1.060     1.060
 assi 
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   (( segid "   B" and resid 73   and name  HE  ))
   (  segid "   B" and resid 73   and name  HD# )

      2.520     0.760     0.760
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   (( segid "   B" and resid 73   and name  HN  ))
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      3.310     0.990     0.990
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   (( segid "   B" and resid 73   and name  HN  ))
   (  segid "   B" and resid 73   and name  HG# )

      2.790     0.840     0.840
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   (( segid "   B" and resid 73   and name  HB1 ))
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      2.200     0.660     0.660
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   (( segid "   B" and resid 73   and name  HN  ))
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      2.810     0.840     0.840
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   (( segid "   B" and resid 73   and name  HN  ))
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      2.780     0.830     0.830
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      3.190     0.960     1.600
 assi 
   (( segid "   B" and resid 73   and name  HN  ))
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      4.410     1.320     1.320
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   (( segid "   B" and resid 73   and name  HE  ))
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      3.840     1.150     1.150
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   (( segid "   B" and resid 73   and name  HE  ))
   (( segid "   B" and resid 79   and name  HG11))

      2.750     0.820     0.820
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   (( segid "   B" and resid 74   and name  HA1 ))
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      2.010     0.600     0.600
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   (( segid "   B" and resid 74   and name  HN  ))
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      2.670     0.800     0.800
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   (( segid "   B" and resid 74   and name  HN  ))
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      2.670     0.800     0.800
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   (( segid "   B" and resid 75   and name  HN  ))
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      2.820     0.850     0.850
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   (( segid "   B" and resid 75   and name  HN  ))
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      2.700     0.810     0.810
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   (( segid "   B" and resid 74   and name  HN  ))
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      2.840     0.850     0.850
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   (( segid "   B" and resid 75   and name  HB1 ))
   (( segid "   B" and resid 75   and name  HA  ))

      2.410     0.720     0.720
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   (( segid "   B" and resid 75   and name  HB2 ))
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      2.300     0.690     0.690
 assi 
   (( segid "   B" and resid 75   and name  HN  ))
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      2.220     0.670     0.670
 assi 
   (( segid "   B" and resid 75   and name  HN  ))
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      2.890     0.870     0.870
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   (( segid "   B" and resid 76   and name  HN  ))
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      2.670     0.800     0.800
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   (( segid "   B" and resid 77   and name  HN  ))
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      3.800     1.140     1.140
 assi 
   (( segid "   B" and resid 76   and name  HN  ))
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      2.650     0.800     0.800
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   (( segid "   B" and resid 76   and name  HN  ))
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      2.430     0.730     0.730
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   (( segid "   B" and resid 76   and name  HA2 ))
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      1.840     0.550     0.550
 assi 
   (( segid "   B" and resid 77   and name  HN  ))
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      2.720     0.820     0.820
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   (( segid "   B" and resid 77   and name  HN  ))
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      3.320     1.000     1.000
 assi 
   (( segid "   B" and resid 77   and name  HN  ))
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      3.010     0.900     0.900
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   (( segid "   B" and resid 77   and name  HE  ))
   (( segid "   B" and resid 77   and name  HA  ))

      2.930     0.880     0.880
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   (( segid "   B" and resid 77   and name  HN  ))
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      2.650     0.800     0.800
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   (( segid "   B" and resid 77   and name  HE  ))
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      2.270     0.680     0.680
 assi 
   (( segid "   B" and resid 77   and name  HE  ))
   (  segid "   B" and resid 77   and name  HG# )

      2.730     0.820     0.820
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   (( segid "   B" and resid 77   and name  HN  ))
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      2.230     0.670     1.100
 assi 
   (( segid "   B" and resid 77   and name  HD1 ))
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      1.940     0.580     0.580
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   (( segid "   B" and resid 77   and name  HN  ))
   (( segid "   B" and resid 77   and name  HA  ))

      2.780     0.830     0.830
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   (( segid "   B" and resid 77   and name  HG1 ))
   (( segid "   B" and resid 77   and name  HA  ))

      2.470     0.740     1.000
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   (( segid "   B" and resid 77   and name  HE  ))
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      2.440     0.730     0.730
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   (( segid "   B" and resid 77   and name  HG1 ))
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      2.450     0.730     0.730
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   (( segid "   B" and resid 77   and name  HE  ))
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      2.350     0.700     0.700
 assi 
   (( segid "   B" and resid 77   and name  HN  ))
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      2.730     0.820     1.200
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   (( segid "   B" and resid 77   and name  HN  ))
   (( segid "   B" and resid 77   and name  HD2 ))

      3.310     0.990     0.990
 assi 
   (( segid "   B" and resid 77   and name  HN  ))
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      3.370     1.010     1.010
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   (( segid "   B" and resid 77   and name  HN  ))
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      2.590     0.780     1.200
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   (( segid "   B" and resid 77   and name  HE  ))
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      2.410     0.720     0.720
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   (( segid "   B" and resid 78   and name  HN  ))
   (( segid "   B" and resid 77   and name  HN  ))

      2.900     0.870     0.870
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   (( segid "   B" and resid 78   and name  HN  ))
   (( segid "   B" and resid 77   and name  HA  ))

      2.220     0.670     0.670
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   (( segid "   B" and resid 78   and name  HE  ))
   (  segid "   B" and resid 78   and name  HD# )

      2.810     0.840     0.840
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   (( segid "   B" and resid 78   and name  HN  ))
   (( segid "   B" and resid 78   and name  HA  ))

      2.630     0.790     0.790
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   (( segid "   B" and resid 78   and name  HN  ))
   (  segid "   B" and resid 78   and name  HD# )

      3.370     1.010     1.010
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   (( segid "   B" and resid 78   and name  HE  ))
   (  segid "   B" and resid 78   and name  HB# )

      2.950     0.890     0.890
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   (( segid "   B" and resid 78   and name  HE  ))
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      2.850     0.850     0.850
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      2.500     0.750     0.750
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      2.880     0.860     0.860
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   (( segid "   B" and resid 79   and name  HN  ))
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      2.180     0.650     0.650
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   (( segid "   B" and resid 78   and name  HN  ))
   (( segid "   B" and resid 79   and name  HN  ))

      3.250     0.970     0.970
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   (( segid "   B" and resid 79   and name  HN  ))
   (  segid "   B" and resid 78   and name  HB# )

      2.740     0.820     0.820
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   (( segid "   B" and resid 79   and name  HN  ))
   (  segid "   B" and resid 78   and name  HD# )

      3.770     1.130     1.130
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   (( segid "   B" and resid 79   and name  HN  ))
   (  segid "   B" and resid 78   and name  HG# )

      3.060     0.920     0.920
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   (  segid "   B" and resid 79   and name  HG2#)
   (  segid "   B" and resid 81   and name  HD# )

      4.880     1.460     1.460
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   (( segid "   B" and resid 79   and name  HN  ))
   (( segid "   B" and resid 79   and name  HB  ))

      2.170     0.650     0.650
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   (( segid "   B" and resid 79   and name  HN  ))
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      2.650     0.800     0.800
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   (( segid "   B" and resid 79   and name  HN  ))
   (( segid "   B" and resid 79   and name  HG11))

      2.610     0.780     0.780
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   (( segid "   B" and resid 79   and name  HN  ))
   (  segid "   B" and resid 79   and name  HD1#)

      3.600     1.080     1.080
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      3.360     1.010     1.010
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      3.300     0.990     0.990
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      2.340     0.700     0.700
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   (( segid "   B" and resid 80   and name  HN  ))
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      3.770     1.130     1.130
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      3.790     1.140     1.140
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      3.290     0.990     0.990
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      3.990     1.200     1.200
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      4.460     1.340     1.340
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   (( segid "   B" and resid 81   and name  HE  ))
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      3.180     0.950     0.950
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      2.600     0.780     0.780
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      3.430     1.030     1.030
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      2.670     0.800     0.800
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   (( segid "   B" and resid 80   and name  HN  ))
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      2.920     0.880     0.880
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      2.500     0.750     0.750
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   (( segid "   B" and resid 80   and name  HN  ))
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      2.860     0.860     0.860
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      2.730     0.820     0.820
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   (( segid "   B" and resid 81   and name  HN  ))
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      2.130     0.640     0.640
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   (( segid "   B" and resid 81   and name  HN  ))
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      3.050     0.920     0.920
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   (( segid "   B" and resid 81   and name  HE  ))
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      2.760     0.830     1.300
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      2.520     0.760     0.760
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      2.750     0.820     0.820
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   (( segid "   B" and resid 81   and name  HN  ))
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      2.710     0.810     0.810
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   (( segid "   B" and resid 81   and name  HN  ))
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      2.770     0.830     0.830
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   (( segid "   B" and resid 81   and name  HN  ))
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      2.520     0.760     0.760
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   (( segid "   B" and resid 81   and name  HN  ))
   (  segid "   B" and resid 81   and name  HD# )

      3.470     1.040     1.040
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   (( segid "   B" and resid 81   and name  HE  ))
   (  segid "   B" and resid 81   and name  HD# )

      2.700     0.810     0.810
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   (( segid "   B" and resid 81   and name  HN  ))
   (( segid "   B" and resid 81   and name  HG1 ))

      2.330     0.700     0.700
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   (( segid "   B" and resid 81   and name  HE  ))
   (( segid "   B" and resid 81   and name  HG2 ))

      2.690     0.810     0.810


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