NMR Restraints Grid

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

image mrblock_id pdb_id cing stage position program type subtype subsubtype
655564 7d0z cing 1-original 5 AMBER distance NOE simple


# cctg2pH5_noe_03
# 1	CP5	H5	1	CP5	H6	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat=  15,  13, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, 
      rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
 /
#
# 1	CP5	H5	1	CP5	H2'	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  15,  27, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 1	CP5	H6	1	CP5	H1'	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat=  13,  10, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 1	CP5	H6	1	CP5	H2'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat=  13,  27, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 1	CP5	H1'	1	CP5	H2'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat=  10,  27, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 1	CP5	H1'	1	CP5	H3'	4.0	6.0
 &rst
  ixpk= 0, nxpk= 0, iat=  10,  25, r1= 3.50, r2= 4.00, r3= 6.00, r4= 6.50,  /
#
# 1	CP5	H2'	1	CP5	H3'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat=  27,  25, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 1	CP5	H1'	2	DCP	H6	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat=  10,  44, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 1	CP5	H1'	2	DCP	H2'	2.5	4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  10,  58, r1= 2.00, r2= 2.50, r3= 4.50, r4= 5.00,  /
#
# 1	CP5	H2'	2	DCP	H3'	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat=  27,  56, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 1	CP5	H5	3	DT	H7	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  15,  -1, r1= 3.00, r2= 3.50, r3= 6.61, r4= 7.11,
 igr2=  78,  79,  80,
 /
#
# 1	CP5	H6	3	DT	H7	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  13,  -1, r1= 3.00, r2= 3.50, r3= 6.61, r4= 7.11,
 igr2=  78,  79,  80,
 /
#
# 1	CP5	H1'	3	DT	H7	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  10,  -1, r1= 3.00, r2= 3.50, r3= 6.61, r4= 7.11,
 igr2=  78,  79,  80,
 /
#
# 1	CP5	H2'	3	DT	H7	2.5	4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  27,  -1, r1= 2.00, r2= 2.50, r3= 5.40, r4= 5.90,
 igr2=  78,  79,  80,
 /
#
# 1	CP5	H3'	3	DT	H7	4.0	6.0
 &rst
  ixpk= 0, nxpk= 0, iat=  25,  -1, r1= 3.50, r2= 4.00, r3= 7.21, r4= 7.71,
 igr2=  78,  79,  80,
 /
#
# 1	CP5	H5	8	DG3	H8	4.0	6.0
 &rst
  ixpk= 0, nxpk= 0, iat=  15, 232, r1= 3.50, r2= 4.00, r3= 6.00, r4= 6.50,  /
#
# 1	CP5	H5	8	DG3	H2'	4.0	6.0
 &rst
  ixpk= 0, nxpk= 0, iat=  15, 248, r1= 3.50, r2= 4.00, r3= 6.00, r4= 6.50,  /
#
# 1	CP5	H6	8	DG3	H1'	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat=  13, 229, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 1	CP5	H6	8	DG3	H2'	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat=  13, 248, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 1	CP5	H6	8	DG3	H2''	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat=  13, 249, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 1	CP5	H1'	8	DG3	H2'	4.0	6.0
 &rst
  ixpk= 0, nxpk= 0, iat=  10, 248, r1= 3.50, r2= 4.00, r3= 6.00, r4= 6.50,  /
#
# 1	CP5	H1'	8	DG3	H2''	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  10, 249, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 2	DCP	H5	2	DCP	H6	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat=  46,  44, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 2	DCP	H6	2	DCP	H1'	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  44,  41, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 2	DCP	H6	2	DCP	H2'	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat=  44,  58, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 2	DCP	H6	2	DCP	H2''	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat=  44,  59, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 2	DCP	H1'	2	DCP	H2'	2.5	4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  41,  58, r1= 2.00, r2= 2.50, r3= 4.50, r4= 5.00,  /
#
# 2	DCP	H1'	2	DCP	H2''	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat=  41,  59, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 2	DCP	H2'	2	DCP	H2''	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  59, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 2	DCP	H2'	2	DCP	H3'	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  56, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 2	DCP	H2''	2	DCP	H3'	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat=  59,  56, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 2	DCP	H1'	3	DT	H6	4.0	6.0
 &rst
  ixpk= 0, nxpk= 0, iat=  41,  75, r1= 3.50, r2= 4.00, r3= 6.00, r4= 6.50,  /
#
# 2	DCP	H2'	3	DT	H6	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  75, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 2	DCP	H2'	3	DT	H7	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat=  58,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=  78,  79,  80,
 /
#
# 2	DCP	H2''	3	DT	H6	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat=  59,  75, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 2	DCP	H2''	3	DT	H7	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat=  59,  -1, r1= 2.50, r2= 3.00, r3= 6.00, r4= 6.50,
 igr2=  78,  79,  80,
 /
#
# 2	DCP	H3'	3	DT	H7	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat=  56,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2=  78,  79,  80,
 /
#
# 2	DCP	H1'	4	DG	H8	4.0	6.0
 &rst
  ixpk= 0, nxpk= 0, iat=  41, 107, r1= 3.50, r2= 4.00, r3= 6.00, r4= 6.50,  /
#
# 2	DCP	H2''	4	DG	H8	4.0	6.0
 &rst
  ixpk= 0, nxpk= 0, iat=  59, 107, r1= 3.50, r2= 4.00, r3= 6.00, r4= 6.50,  /
#
# 3	DT	H6	3	DT	H7	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat=  75,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2=  78,  79,  80,
 /
#
# 3	DT	H6	3	DT	H2'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat=  75,  90, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 3	DT	H6	3	DT	H2''	2.5	4.5
 &rst
  ixpk= 0, nxpk= 0, iat=  75,  91, r1= 2.00, r2= 2.50, r3= 4.50, r4= 5.00,  /
#
# 3	DT	H6	3	DT	H3'	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat=  75,  88, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 3	DT	H1'	3	DT	H2'	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  90, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 3	DT	H1'	3	DT	H2''	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat=  72,  91, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 3	DT	H2'	3	DT	H3'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat=  90,  88, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 3	DT	H2''	3	DT	H3'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat=  91,  88, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 4	DG	H8	4	DG	H1'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 107, 104, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 4	DG	H8	4	DG	H2'	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 107, 123, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 4	DG	H8	4	DG	H2''	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 107, 124, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 4	DG	H1'	4	DG	H4'	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 104, 101, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 4	DG	H2'	4	DG	H1'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 123, 104, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 4	DG	H2'	4	DG	H2''	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 123, 124, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 4	DG	H2'	4	DG	H4'	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 123, 101, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 4	DG	H2''	4	DG	H1'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 104, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 4	DG	H2''	4	DG	H4'	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 101, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 4	DG	H2'	5	DC	H1'	2.5	4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 123, 137, r1= 2.00, r2= 2.50, r3= 4.50, r4= 5.00,  /
#
# 4	DG	H2''	5	DC	H1'	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 137, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 4	DG	H2'	6	DC	H5	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 123, 172, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 4	DG	H2''	6	DC	H5	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 124, 172, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 4	DG	H1	8	DG3	H1	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 113, 238, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 5	DC	H5	5	DC	H6	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 142, 140, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 5	DC	H5	5	DC	H2'	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 142, 153, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 5	DC	H6	5	DC	H1'	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 140, 137, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 5	DC	H6	5	DC	H2'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 140, 153, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 5	DC	H6	5	DC	H2''	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 140, 154, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 5	DC	H6	5	DC	H3'	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 140, 151, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 5	DC	H1'	5	DC	H2'	2.5	4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 137, 153, r1= 2.00, r2= 2.50, r3= 4.50, r4= 5.00,  /
#
# 5	DC	H1'	5	DC	H2''	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 137, 154, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 5	DC	H1'	5	DC	H3'	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 137, 151, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 5	DC	H2'	5	DC	H3'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 153, 151, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 5	DC	H2''	5	DC	H3'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 151, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 5	DC	H1'	6	DC	H6	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 137, 170, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 5	DC	H1'	6	DC	H2'	2.5	4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 137, 183, r1= 2.00, r2= 2.50, r3= 4.50, r4= 5.00,  /
#
# 5	DC	H1'	6	DC	H2''	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 137, 184, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 5	DC	H2''	6	DC	H1'	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 167, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 5	DC	H5	7	DT	H7	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 142,  -1, r1= 3.00, r2= 3.50, r3= 6.61, r4= 7.11,
 igr2= 203, 204, 205,
 /
#
# 5	DC	H6	7	DT	H7	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 140,  -1, r1= 2.50, r2= 3.00, r3= 6.00, r4= 6.50,
 igr2= 203, 204, 205,
 /
#
# 5	DC	H1'	7	DT	H7	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 137,  -1, r1= 3.00, r2= 3.50, r3= 6.61, r4= 7.11,
 igr2= 203, 204, 205,
 /
#
# 5	DC	H2''	7	DT	H7	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 154,  -1, r1= 1.30, r2= 1.80, r3= 7.21, r4= 7.71,
 igr2= 203, 204, 205,
 /
#
# 5	DC	H3'	7	DT	H7	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 151,  -1, r1= 3.00, r2= 3.50, r3= 6.61, r4= 7.11,
 igr2= 203, 204, 205,
 /
#
# 5	DC	H41	8	DG3	H1	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 145, 238, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 5	DC	H42	8	DG3	H1	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 238, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 6	DC	H5	6	DC	H6	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 172, 170, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 6	DC	H6	6	DC	H1'	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 167, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 6	DC	H6	6	DC	H2'	2.5	4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 183, r1= 2.00, r2= 2.50, r3= 4.50, r4= 5.00,  /
#
# 6	DC	H6	6	DC	H2''	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 170, 184, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 6	DC	H1'	6	DC	H2'	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 167, 183, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 6	DC	H1'	6	DC	H2''	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 167, 184, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 6	DC	H2'	6	DC	H2''	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 183, 184, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 6	DC	H2'	6	DC	H3'	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 183, 181, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 6	DC	H2''	6	DC	H3'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 184, 181, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 6	DC	H1'	7	DT	H6	4.0	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 167, 200, r1= 3.50, r2= 4.00, r3= 6.00, r4= 6.50,  /
#
# 6	DC	H1'	7	DT	H2'	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 167, 215, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 6	DC	H2'	7	DT	H6	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 183, 200, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 6	DC	H2'	7	DT	H7	2.5	4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 183,  -1, r1= 2.00, r2= 2.50, r3= 5.40, r4= 5.90,
 igr2= 203, 204, 205,
 /
#
# 6	DC	H2''	7	DT	H6	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 184, 200, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 6	DC	H3'	7	DT	H6	4.0	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 181, 200, r1= 3.50, r2= 4.00, r3= 6.00, r4= 6.50,  /
#
# 6	DC	H3'	7	DT	H7	2.5	4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 181,  -1, r1= 2.00, r2= 2.50, r3= 5.40, r4= 5.90,
 igr2= 203, 204, 205,
 /
#
# 6	DC	H3'	7	DT	H2'	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 181, 215, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 7	DT	H6	7	DT	H7	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 200,  -1, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr2= 203, 204, 205,
 /
#
# 7	DT	H6	7	DT	H1'	4.0	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 197, r1= 3.50, r2= 4.00, r3= 6.00, r4= 6.50,  /
#
# 7	DT	H6	7	DT	H2'	1.8	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 215, r1= 1.30, r2= 1.80, r3= 6.00, r4= 6.50,  /
#
# 7	DT	H6	7	DT	H2''	2.5	4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 216, r1= 2.00, r2= 2.50, r3= 4.50, r4= 5.00,  /
#
# 7	DT	H6	7	DT	H3'	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 213, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 7	DT	H7	7	DT	H2''	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 216, r1= 1.30, r2= 1.80, r3= 4.80, r4= 5.30,
 igr1= 203, 204, 205,
 /
#
# 7	DT	H1'	7	DT	H2'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 215, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 7	DT	H1'	7	DT	H2''	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 216, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 7	DT	H1'	7	DT	H3'	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 197, 213, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 7	DT	H2'	7	DT	H3'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 213, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 7	DT	H2''	7	DT	H3'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 213, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 8	DG3	H8	8	DG3	H1'	2.5	4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 229, r1= 2.00, r2= 2.50, r3= 4.50, r4= 5.00,  /
#
# 8	DG3	H8	8	DG3	H2'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 248, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 8	DG3	H8	8	DG3	H2''	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 249, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 8	DG3	H8	8	DG3	H3'	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 246, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 8	DG3	H8	8	DG3	H4'	4.0	6.0
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 226, r1= 3.50, r2= 4.00, r3= 6.00, r4= 6.50,  /
#
# 8	DG3	H8	8	DG3	H5'	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 223, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 8	DG3	H8	8	DG3	H5''	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 224, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 8	DG3	H1'	8	DG3	H2'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 229, 248, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 8	DG3	H1'	8	DG3	H2''	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 229, 249, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 8	DG3	H1'	8	DG3	H4'	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 229, 226, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 8	DG3	H1'	8	DG3	H5'	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 229, 223, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 8	DG3	H2'	8	DG3	H2''	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 249, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
# 8	DG3	H2'	8	DG3	H3'	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 246, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 8	DG3	H2'	8	DG3	H4'	3.0	5.0
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 226, r1= 2.50, r2= 3.00, r3= 5.00, r4= 5.50,  /
#
# 8	DG3	H2'	8	DG3	H5'	2.5	4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 223, r1= 2.00, r2= 2.50, r3= 4.50, r4= 5.00,  /
#
# 8	DG3	H2''	8	DG3	H3'	3.5	5.5
 &rst
  ixpk= 0, nxpk= 0, iat= 249, 246, r1= 3.00, r2= 3.50, r3= 5.50, r4= 6.00,  /
#
# 8	DG3	H2''	8	DG3	H4'	2.5	4.5
 &rst
  ixpk= 0, nxpk= 0, iat= 249, 226, r1= 2.00, r2= 2.50, r3= 4.50, r4= 5.00,  /
#
# 8	DG3	H2''	8	DG3	H5'	1.8	4.0
 &rst
  ixpk= 0, nxpk= 0, iat= 249, 223, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /




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