NMR Restraints Grid

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

image mrblock_id pdb_id bmrb_id cing stage position program type subtype subsubtype
646942 6tcg 34445 cing 1-original 1 AMBER distance NOE simple


# Restraints file 1: RST
#
#    1  DG5  H8       1  DG5  H1'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat=  13,  10, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50, 
      rk2=40.0, rk3=40.0, ir6=1, ialtd=0,
 /
#
#    1  DG5  H8       1  DG5  H2'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat=  13,  29, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    1  DG5  H8       1  DG5  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat=  13,  30, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    1  DG5  H8       1  DG5  H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat=  13,  27, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#    2  DG  H8       2  DG  H1'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat=  46,  43, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#    2  DG  H8       2  DG  H2'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat=  46,  62, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    2  DG  H8       2  DG  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat=  46,  63, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    2  DG  H8       2  DG  H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat=  46,  60, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#    3  DG  H8       3  DG  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat=  79,  76, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    3  DG  H8       3  DG  H2'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat=  79,  95, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#    3  DG  H8       3  DG  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat=  79,  96, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    3  DG  H8       3  DG  H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat=  79,  93, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#    4  DA  H8       4  DA  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 109, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    4  DA  H8       4  DA  H2'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 127, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#    4  DA  H8       4  DA  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 128, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    4  DA  H8       4  DA  H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 125, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#    5  DT  H6       5  DT  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 141, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    5  DT  H6       5  DT  H2'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 159, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#    5  DT  H6       5  DT  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 160, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    5  DT  H6       5  DT  H3'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 157, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    6  DG  H8       6  DG  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 173, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    6  DG  H8       6  DG  H2'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 192, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#    6  DG  H8       6  DG  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 193, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    6  DG  H8       6  DG  H3'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 190, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    7  DG  H8       7  DG  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 209, 206, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    7  DG  H8       7  DG  H2'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 209, 225, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#    7  DG  H8       7  DG  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 209, 226, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    7  DG  H8       7  DG  H3'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 209, 223, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    8  DG  H8       8  DG  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 239, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    8  DG  H8       8  DG  H2'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 258, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#    8  DG  H8       8  DG  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 259, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    8  DG  H8       8  DG  H3'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 256, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   10  DC  H6      10  DC  H1'           3.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 304, r1= 2.50, r2= 3.00, r3= 7.00, r4= 7.50,  /
#
#   10  DC  H6      10  DC  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 321, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   11  DA  H8      11  DA  H1'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 334, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#   11  DA  H8      11  DA  H2'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 352, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#   11  DA  H8      11  DA  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 353, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   11  DA  H8      11  DA  H3'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 350, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   12  DC  H6      12  DC  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 369, 366, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   12  DC  H6      12  DC  H2'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 369, 382, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#   12  DC  H6      12  DC  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 369, 383, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   13  DA  H8      13  DA  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 396, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   13  DA  H8      13  DA  H2'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 414, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   13  DA  H8      13  DA  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 415, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   13  DA  H8      13  DA  H3'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 412, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   14  2F  H8      14  2F  H1'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 443, 431, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#   15  FA  H8      15  FA  H1'           3.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 476, 464, r1= 2.50, r2= 3.00, r3= 7.00, r4= 7.50,  /
#
#   15  FA  H8      15  FA  F2'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 476, 467, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   15  FA  H8      15  FA  H2'1          4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 476, 466, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   16  DG  H8      16  DG  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 494, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   16  DG  H8      16  DG  H2'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 513, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#   16  DG  H8      16  DG  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 514, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   16  DG  H8      16  DG  H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 511, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   17  DG  H8      17  DG  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 527, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   17  DG  H8      17  DG  H2'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 546, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#   17  DG  H8      17  DG  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 547, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   17  DG  H8      17  DG  H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 544, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   18  DA  H8      18  DA  H1'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 560, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#   18  DA  H8      18  DA  H2'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 578, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#   18  DA  H8      18  DA  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 579, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   19  DC  H6      19  DC  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 595, 592, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   19  DC  H6      19  DC  H2'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 595, 608, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   19  DC  H6      19  DC  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 595, 609, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   20  DG  H8      20  DG  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 625, 622, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   20  DG  H8      20  DG  H2'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 625, 641, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   20  DG  H8      20  DG  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 625, 642, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   20  DG  H8      20  DG  H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 625, 639, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   21  DG  H8      21  DG  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 655, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   21  DG  H8      21  DG  H2'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 674, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#   21  DG  H8      21  DG  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 675, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   21  DG  H8      21  DG  H3'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 672, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   22  DG3 H8      22  DG3 H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 688, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   22  DG3 H8      22  DG3 H2'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 707, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#   22  DG3 H8      22  DG3 H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 708, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   22  DG3 H8      22  DG3 H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 705, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   13  DA  H2      13  DA  H1'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 408, 396, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   18  DA  H2      18  DA  H1'           4.5    7.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 572, 560, r1= 4.00, r2= 4.50, r3= 7.50, r4= 8.00,  /
#
#    2  DG  H8       1  DG5  H8            4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat=  46,  13, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#    4  DA  H8       3  DG  H1'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 112,  76, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#    4  DA  H8       3  DG  H2'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 112,  95, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    4  DA  H8       3  DG  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 112,  96, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    4  DA  H8       3  DG  H3'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 112,  93, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    5  DT  H6       4  DA  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 109, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    5  DT  H6       4  DA  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 128, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    5  DT  H6       4  DA  H3'           4.5    7.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 125, r1= 4.00, r2= 4.50, r3= 7.50, r4= 8.00,  /
#
#    6  DG  H8       5  DT  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 141, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    6  DG  H8       5  DT  H2'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 159, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    6  DG  H8       5  DT  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 160, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    6  DG  H8       5  DT  H3'           4.5    7.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 157, r1= 4.00, r2= 4.50, r3= 7.50, r4= 8.00,  /
#
#    6  DG  H8       5  DT  H6            4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 144, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#    7  DG  H8       6  DG  H1'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 209, 173, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#    7  DG  H8       6  DG  H2'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 209, 192, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    7  DG  H8       6  DG  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 209, 193, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    7  DG  H8       6  DG  H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 209, 190, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#    8  DG  H8       7  DG  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 206, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    8  DG  H8       7  DG  H2'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 225, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    8  DG  H8       7  DG  H2''          1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 226, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#    8  DG  H8       7  DG  H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 223, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#    8  DG  H8       7  DG  H8            4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 209, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#    9  DA  H8       8  DG  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 239, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    9  DA  H8       8  DG  H2'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 258, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#    9  DA  H8       8  DG  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 259, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    9  DA  H8       8  DG  H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 256, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#    9  DA  H8       8  DG  H8            4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 242, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   10  DC  H6       9  DA  H2''          4.5    7.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 291, r1= 4.00, r2= 4.50, r3= 7.50, r4= 8.00,  /
#
#   11  DA  H8      10  DC  H1'           4.5    7.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 304, r1= 4.00, r2= 4.50, r3= 7.50, r4= 8.00,  /
#
#   11  DA  H8      10  DC  H2''          4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 337, 321, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   12  DC  H6      11  DA  H2''          4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 369, 353, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   13  DA  H8      12  DC  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 366, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   13  DA  H8      12  DC  H2'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 382, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   13  DA  H8      12  DC  H2''          3.5    7.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 383, r1= 3.00, r2= 3.50, r3= 7.50, r4= 8.00,  /
#
#   16  DG  H8      15  FA  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 464, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   16  DG  H8      15  FA  F2'           1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 467, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#   16  DG  H8      15  FA  H2'1          1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 466, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#   17  DG  H8      16  DG  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 494, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   17  DG  H8      16  DG  H2'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 513, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   17  DG  H8      16  DG  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 514, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   17  DG  H8      16  DG  H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 530, 511, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   18  DA  H8      17  DG  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 527, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   19  DC  H6      18  DA  H2'           4.5    7.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 595, 578, r1= 4.00, r2= 4.50, r3= 7.50, r4= 8.00,  /
#
#   21  DG  H8      20  DG  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 622, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   21  DG  H8      20  DG  H2'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 641, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   21  DG  H8      20  DG  H2''          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 642, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   21  DG  H8      20  DG  H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 639, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   22  DG3 H8      21  DG  H1'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 655, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   22  DG3 H8      21  DG  H2'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 674, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   22  DG3 H8      21  DG  H2''          1.8    4.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 675, r1= 1.30, r2= 1.80, r3= 4.00, r4= 4.50,  /
#
#   22  DG3 H8      21  DG  H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 672, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   22  DG3 H8      21  DG  H8            4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 658, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#    4  DA  H1'      5  DT  C7            2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 109, 146, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#    4  DA  H2       5  DT  C7            4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 121, 146, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#    4  DA  H8       5  DT  C7            4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 146, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   18  DA  H2      17  DG  H1'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 572, 527, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   14  2F  H8      13  DA  H2            2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 443, 408, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   14  2F  H1       1  DG5  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 449,  19, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#    1  DG5  H1       2  DG  H1            2.8    5.2 
 &rst
  ixpk= 0, nxpk= 0, iat=  19,  52, r1= 2.30, r2= 2.80, r3= 5.20, r4= 5.70,  /
#
#   16  DG  H1      15  FA  H1            2.8    5.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 503, 482, r1= 2.30, r2= 2.80, r3= 5.20, r4= 5.70,  /
#
#   17  DG  H1      16  DG  H1            2.8    5.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 536, 503, r1= 2.30, r2= 2.80, r3= 5.20, r4= 5.70,  /
#
#   22  DG3 H1      21  DG  H1            2.8    5.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 697, 664, r1= 2.30, r2= 2.80, r3= 5.20, r4= 5.70,  /
#
#    8  DG  H1       7  DG  H1            2.8    5.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 215, r1= 2.30, r2= 2.80, r3= 5.20, r4= 5.70,  /
#
#    7  DG  H1       6  DG  H1            2.8    5.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 215, 182, r1= 2.30, r2= 2.80, r3= 5.20, r4= 5.70,  /
#
#    2  DG  H8       6  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat=  46, 182, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#    6  DG  H8      20  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 631, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   20  DG  H8      15  FA  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 625, 482, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   15  FA  H8       2  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 476,  52, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#    1  DG5  H8       7  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat=  13, 215, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   16  DG  H8       1  DG5  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 497,  19, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   21  DG  H8      16  DG  H1            4.8    7.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 503, r1= 4.30, r2= 4.80, r3= 7.20, r4= 7.70,  /
#
#    7  DG  H8      21  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 209, 664, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   14  2F  H8       8  DG  H1            4.8    7.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 443, 248, r1= 4.30, r2= 4.80, r3= 7.20, r4= 7.70,  /
#
#   22  DG3 H8      17  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 691, 536, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#    8  DG  H8      22  DG3 H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 697, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#    2  DG  H8       7  DG  H1            4.8    7.2 
 &rst
  ixpk= 0, nxpk= 0, iat=  46, 215, r1= 4.30, r2= 4.80, r3= 7.20, r4= 7.70,  /
#
#    6  DG  H8      21  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 664, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   20  DG  H8      16  DG  H1            4.8    7.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 625, 503, r1= 4.30, r2= 4.80, r3= 7.20, r4= 7.70,  /
#
#   15  FA  H8       1  DG5  H1            4.8    7.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 476,  19, r1= 4.30, r2= 4.80, r3= 7.20, r4= 7.70,  /
#
#    1  DG5  H8       8  DG  H1            4.8    7.2 
 &rst
  ixpk= 0, nxpk= 0, iat=  13, 248, r1= 4.30, r2= 4.80, r3= 7.20, r4= 7.70,  /
#
#   21  DG  H8      17  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 658, 536, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#    7  DG  H8      22  DG3 H1            4.8    7.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 209, 697, r1= 4.30, r2= 4.80, r3= 7.20, r4= 7.70,  /
#
#    5  DT  C7      20  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 631, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   12  DC  H6      17  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 369, 536, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   12  DC  H1'     17  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 366, 536, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   12  DC  H1'     22  DG3 H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 366, 697, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   12  DC  H1'     14  2F  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 366, 449, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   12  DC  H5      17  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 371, 536, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   12  DC  H2''    14  2F  H1            2.8    5.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 383, 449, r1= 2.30, r2= 2.80, r3= 5.20, r4= 5.70,  /
#
#   16  DG  H22     21  DG  H8            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 507, 658, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   16  DG  H21     21  DG  H8            2.8    5.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 506, 658, r1= 2.30, r2= 2.80, r3= 5.20, r4= 5.70,  /
#
#    1  DG5  H22     16  DG  H8            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat=  23, 497, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#    1  DG5  H21     16  DG  H8            2.8    5.2 
 &rst
  ixpk= 0, nxpk= 0, iat=  22, 497, r1= 2.30, r2= 2.80, r3= 5.20, r4= 5.70,  /
#
#    1  DG5  H21     14  2F  H2'2          3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat=  22, 434, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   16  DG  H22     20  DG  H8            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 507, 625, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   13  DA  H62      8  DG  H1            2.8    5.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 405, 248, r1= 2.30, r2= 2.80, r3= 5.20, r4= 5.70,  /
#
#   13  DA  H62     22  DG3 H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 405, 697, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   13  DA  H62     11  DA  H1'           4.8    7.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 405, 334, r1= 4.30, r2= 4.80, r3= 7.20, r4= 7.70,  /
#
#   13  DA  H62     11  DA  H8            4.8    7.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 405, 337, r1= 4.30, r2= 4.80, r3= 7.20, r4= 7.70,  /
#
#   13  DA  H61     11  DA  H8            2.8    5.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 404, 337, r1= 2.30, r2= 2.80, r3= 5.20, r4= 5.70,  /
#
#   13  DA  H8      14  2F  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 399, 449, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   13  DA  H2      14  2F  H1            4.8    7.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 408, 449, r1= 4.30, r2= 4.80, r3= 7.20, r4= 7.70,  /
#
#    3  DG  H1'      2  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat=  76,  52, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#    1  DG5  H2'      2  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat=  29,  52, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#    1  DG5  H2''     2  DG  H1            3.8    6.2 
 &rst
  ixpk= 0, nxpk= 0, iat=  30,  52, r1= 3.30, r2= 3.80, r3= 6.20, r4= 6.70,  /
#
#   13  DA  H62     12  DC  H1'           2.8    5.2 
 &rst
  ixpk= 0, nxpk= 0, iat= 405, 366, r1= 2.30, r2= 2.80, r3= 5.20, r4= 5.70,  /
#
#   16  DG  H8      14  2F  H2'2          2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 497, 434, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   20  DG  H1'      5  DT  C7            4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 622, 146, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   18  DA  H8      20  DG  H3'           4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 639, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   18  DA  H8      20  DG  H2'           2.5    5.5 
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 641, r1= 2.00, r2= 2.50, r3= 5.50, r4= 6.00,  /
#
#   18  DA  H8      20  DG  H2''          4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 642, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /
#
#   18  DA  H8      21  DG  H8            4.0    7.0 
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 658, r1= 3.50, r2= 4.00, r3= 7.00, r4= 7.50,  /


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