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
616820 5uz3 30252 cing 1-original 2 AMBER distance NOE simple


# Restraints file 2: RST
#################AVERAGE
#
# 8	DT	H3'	8	DT	H6	2.92	4.32
 &rst
  ixpk= 0, nxpk= 0, iat= 248, 235, r1= 2.42, r2= 2.92, r3= 4.32, r4= 4.82, 
      rk2=32.0, rk3=32.0, ir6=1, ialtd=0,
 &end
#
# 5	DA	H2	6	DA	H1'	3.91	5.31
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 168, r1= 3.41, r2= 3.91, r3= 5.31, r4= 5.81,  &end
#
# 21	DMC	M7	21	DMC	H6	2.28	3.28
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 664, r1= 1.78, r2= 2.28, r3= 3.94, r4= 4.44,
 igr1= 665, 666, 667,
 &end
#
# 11	DC	H2'	11	DC	H5	3.48	4.88
 &rst
  ixpk= 0, nxpk= 0, iat= 347, 336, r1= 2.98, r2= 3.48, r3= 4.88, r4= 5.38,  &end
#
# 6	DA	H2''	7	DT	M7	2.53	3.93
 &rst
  ixpk= 0, nxpk= 0, iat= 187,  -1, r1= 2.03, r2= 2.53, r3= 4.72, r4= 5.22,
 igr2= 206, 207, 208,
 &end
#
# 23	DC	H2''	23	DC	H3'	2.60	4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 731, 728, r1= 2.10, r2= 2.60, r3= 4.00, r4= 4.50,  &end
#
# 15	DC	H1'	15	DC	H2''	2.35	3.35
 &rst
  ixpk= 0, nxpk= 0, iat= 456, 473, r1= 1.85, r2= 2.35, r3= 3.35, r4= 3.85,  &end
#
# 8	DT	H1'	9	DMC	H6	3.29	4.69
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 281, r1= 2.79, r2= 3.29, r3= 4.69, r4= 5.19,  &end
#
# 3	DC	H2'	3	DC	H6	2.27	3.27
 &rst
  ixpk= 0, nxpk= 0, iat=  89,  76, r1= 1.77, r2= 2.27, r3= 3.27, r4= 3.77,  &end
#
# 3	DC	H2'	3	DC	H3'	2.31	3.71
 &rst
  ixpk= 0, nxpk= 0, iat=  89,  87, r1= 1.81, r2= 2.31, r3= 3.71, r4= 4.21,  &end
#
# 16	DG	H1'	17	DA	H8	2.78	4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 486, 522, r1= 2.28, r2= 2.78, r3= 4.18, r4= 4.68,  &end
#
# 8	DT	H2'	9	DMC	H6	2.78	4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 250, 281, r1= 2.28, r2= 2.78, r3= 4.18, r4= 4.68,  &end
#
# 6	DA	H1'	6	DA	H8	3.43	4.83
 &rst
  ixpk= 0, nxpk= 0, iat= 168, 171, r1= 2.93, r2= 3.43, r3= 4.83, r4= 5.33,  &end
#
# 1	DC	H2'	1	DC	H6	2.31	3.31
 &rst
  ixpk= 0, nxpk= 0, iat=  26,  13, r1= 1.81, r2= 2.31, r3= 3.31, r4= 3.81,  &end
#
# 18	DA	H2'	18	DA	H8	2.34	3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 569, 554, r1= 1.84, r2= 2.34, r3= 3.34, r4= 3.84,  &end
#
# 9	DMC	H2'	9	DMC	H3'	2.31	3.31
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 263, r1= 1.81, r2= 2.31, r3= 3.31, r4= 3.81,  &end
#
# 14	DG	H1'	15	DC	H6	2.95	4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 423, 459, r1= 2.45, r2= 2.95, r3= 4.35, r4= 4.85,  &end
#
# 18	DA	H8	19	DT	M7	2.47	3.87
 &rst
  ixpk= 0, nxpk= 0, iat= 554,  -1, r1= 1.97, r2= 2.47, r3= 4.65, r4= 5.15,
 igr2= 589, 590, 591,
 &end
#
# 4	DG	H2''	4	DG	H8	2.35	3.75
 &rst
  ixpk= 0, nxpk= 0, iat= 123, 106, r1= 1.85, r2= 2.35, r3= 3.75, r4= 4.25,  &end
#
# 2	DG	H2''	2	DG	H8	2.35	3.75
 &rst
  ixpk= 0, nxpk= 0, iat=  60,  43, r1= 1.85, r2= 2.35, r3= 3.75, r4= 4.25,  &end
#
# 7	DT	H1'	7	DT	H2'	2.45	3.85
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 218, r1= 1.95, r2= 2.45, r3= 3.85, r4= 4.35,  &end
#
# 24	DG	H2'	24	DG	H8	2.10	3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 763, 747, r1= 1.60, r2= 2.10, r3= 3.10, r4= 3.60,  &end
#
# 5	DA	H3'	5	DA	H8	2.81	4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 152, 139, r1= 2.31, r2= 2.81, r3= 4.21, r4= 4.71,  &end
#
# 24	DG	H1'	24	DG	H8	3.24	4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 744, 747, r1= 2.74, r2= 3.24, r3= 4.64, r4= 5.14,  &end
#
# 18	DA	H2''	18	DA	H3'	2.31	3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 570, 567, r1= 1.81, r2= 2.31, r3= 3.71, r4= 4.21,  &end
#
# 10	8OG	H1'	10	8OG	H3'	3.36	4.76
 &rst
  ixpk= 0, nxpk= 0, iat= 297, 315, r1= 2.86, r2= 3.36, r3= 4.76, r4= 5.26,  &end
#
# 8	DT	H2'	8	DT	H6	2.22	3.22
 &rst
  ixpk= 0, nxpk= 0, iat= 250, 235, r1= 1.72, r2= 2.22, r3= 3.22, r4= 3.72,  &end
#
# 4	DG	H1'	4	DG	H2'	2.44	3.84
 &rst
  ixpk= 0, nxpk= 0, iat= 103, 122, r1= 1.94, r2= 2.44, r3= 3.84, r4= 4.34,  &end
#
# 3	DC	H2'	4	DG	H8	2.85	4.25
 &rst
  ixpk= 0, nxpk= 0, iat=  89, 106, r1= 2.35, r2= 2.85, r3= 4.25, r4= 4.75,  &end
#
# 20	DT	M7	21	DMC	M7	2.66	4.06
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 2.16, r2= 2.66, r3= 5.86, r4= 6.36,
 igr1= 621, 622, 623,
 igr2= 665, 666, 667,
 &end
#
# 14	DG	H1'	14	DG	H8	3.15	4.55
 &rst
  ixpk= 0, nxpk= 0, iat= 423, 426, r1= 2.65, r2= 3.15, r3= 4.55, r4= 5.05,  &end
#
# 23	DC	H1'	23	DC	H6	3.12	4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 714, 717, r1= 2.62, r2= 3.12, r3= 4.52, r4= 5.02,  &end
#
# 5	DA	H1'	5	DA	H3'	3.26	4.66
 &rst
  ixpk= 0, nxpk= 0, iat= 136, 152, r1= 2.76, r2= 3.26, r3= 4.66, r4= 5.16,  &end
#
# 14	DG	H2''	14	DG	H8	2.35	3.75
 &rst
  ixpk= 0, nxpk= 0, iat= 443, 426, r1= 1.85, r2= 2.35, r3= 3.75, r4= 4.25,  &end
#
# 11	DC	H2''	11	DC	H3'	2.60	4.00
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 345, r1= 2.10, r2= 2.60, r3= 4.00, r4= 4.50,  &end
#
# 12	DG	H3'	12	DG	H8	2.93	4.33
 &rst
  ixpk= 0, nxpk= 0, iat= 378, 364, r1= 2.43, r2= 2.93, r3= 4.33, r4= 4.83,  &end
#
# 10	8OG	H2''	11	DC	H6	2.75	4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 334, r1= 2.25, r2= 2.75, r3= 4.15, r4= 4.65,  &end
#
# 19	DT	H2'	19	DT	H3'	2.32	3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 601, 599, r1= 1.82, r2= 2.32, r3= 3.32, r4= 3.82,  &end
#
# 17	DA	H3'	17	DA	H8	2.81	4.21
 &rst
  ixpk= 0, nxpk= 0, iat= 535, 522, r1= 2.31, r2= 2.81, r3= 4.21, r4= 4.71,  &end
#
# 7	DT	H1'	7	DT	H6	3.26	4.66
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 203, r1= 2.76, r2= 3.26, r3= 4.66, r4= 5.16,  &end
#
# 22	8OG	H1'	22	8OG	H3'	3.36	4.76
 &rst
  ixpk= 0, nxpk= 0, iat= 680, 698, r1= 2.86, r2= 3.36, r3= 4.76, r4= 5.26,  &end
#
# 14	DG	H1'	14	DG	H3'	3.36	4.76
 &rst
  ixpk= 0, nxpk= 0, iat= 423, 440, r1= 2.86, r2= 3.36, r3= 4.76, r4= 5.26,  &end
#
# 21	DMC	H1'	21	DMC	H2''	2.30	3.30
 &rst
  ixpk= 0, nxpk= 0, iat= 651, 649, r1= 1.80, r2= 2.30, r3= 3.30, r4= 3.80,  &end
#
# 23	DC	H1'	23	DC	H2''	2.24	3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 714, 731, r1= 1.74, r2= 2.24, r3= 3.24, r4= 3.74,  &end
#
# 18	DA	H3'	19	DT	M7	3.24	4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 567,  -1, r1= 2.74, r2= 3.24, r3= 5.57, r4= 6.07,
 igr2= 589, 590, 591,
 &end
#
# 19	DT	H1'	19	DT	H2'	2.45	3.85
 &rst
  ixpk= 0, nxpk= 0, iat= 583, 601, r1= 1.95, r2= 2.45, r3= 3.85, r4= 4.35,  &end
#
# 15	DC	H3'	16	DG	H8	4.16	5.56
 &rst
  ixpk= 0, nxpk= 0, iat= 470, 489, r1= 3.66, r2= 4.16, r3= 5.56, r4= 6.06,  &end
#
# 4	DG	H3'	4	DG	H8	3.10	4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 120, 106, r1= 2.60, r2= 3.10, r3= 4.50, r4= 5.00,  &end
#
# 6	DA	H2	7	DT	H1'	3.28	4.68
 &rst
  ixpk= 0, nxpk= 0, iat= 180, 200, r1= 2.78, r2= 3.28, r3= 4.68, r4= 5.18,  &end
#
# 3	DC	H5	3	DC	H6	2.28	3.28
 &rst
  ixpk= 0, nxpk= 0, iat=  78,  76, r1= 1.78, r2= 2.28, r3= 3.28, r4= 3.78,  &end
#
# 14	DG	H2'	15	DC	H6	3.01	4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 442, 459, r1= 2.51, r2= 3.01, r3= 4.41, r4= 4.91,  &end
#
# 1	DC	H1'	2	DG	H8	3.60	5.00
 &rst
  ixpk= 0, nxpk= 0, iat=  10,  43, r1= 3.10, r2= 3.60, r3= 5.00, r4= 5.50,  &end
#
# 9	DMC	H2'	9	DMC	H6	2.20	3.20
 &rst
  ixpk= 0, nxpk= 0, iat= 265, 281, r1= 1.70, r2= 2.20, r3= 3.20, r4= 3.70,  &end
#
# 8	DT	H1'	8	DT	H3'	3.16	4.56
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 248, r1= 2.66, r2= 3.16, r3= 4.56, r4= 5.06,  &end
#
# 13	DC	H2'	13	DC	H3'	2.48	3.48
 &rst
  ixpk= 0, nxpk= 0, iat= 409, 407, r1= 1.98, r2= 2.48, r3= 3.48, r4= 3.98,  &end
#
# 5	DA	H2'	5	DA	H3'	2.34	3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 152, r1= 1.84, r2= 2.34, r3= 3.34, r4= 3.84,  &end
#
# 11	DC	H3'	12	DG	H8	3.74	5.14
 &rst
  ixpk= 0, nxpk= 0, iat= 345, 364, r1= 3.24, r2= 3.74, r3= 5.14, r4= 5.64,  &end
#
# 11	DC	H3'	11	DC	H6	3.08	4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 345, 334, r1= 2.58, r2= 3.08, r3= 4.48, r4= 4.98,  &end
#
# 21	DMC	H2'	21	DMC	H3'	2.31	3.31
 &rst
  ixpk= 0, nxpk= 0, iat= 648, 646, r1= 1.81, r2= 2.31, r3= 3.31, r4= 3.81,  &end
#
# 2	DG	H2''	3	DC	H6	2.57	3.97
 &rst
  ixpk= 0, nxpk= 0, iat=  60,  76, r1= 2.07, r2= 2.57, r3= 3.97, r4= 4.47,  &end
#
# 20	DT	H1'	20	DT	H3'	3.16	4.56
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 631, r1= 2.66, r2= 3.16, r3= 4.56, r4= 5.06,  &end
#
# 22	8OG	H2''	23	DC	H5	2.73	4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 701, 719, r1= 2.23, r2= 2.73, r3= 4.13, r4= 4.63,  &end
#
# 2	DG	H2'	3	DC	H5	3.35	4.75
 &rst
  ixpk= 0, nxpk= 0, iat=  59,  78, r1= 2.85, r2= 3.35, r3= 4.75, r4= 5.25,  &end
#
# 11	DC	H5	11	DC	H6	2.29	3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 336, 334, r1= 1.79, r2= 2.29, r3= 3.29, r4= 3.79,  &end
#
# 13	DC	H2''	14	DG	H8	2.68	4.08
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 426, r1= 2.18, r2= 2.68, r3= 4.08, r4= 4.58,  &end
#
# 23	DC	H2''	23	DC	H6	2.54	3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 731, 717, r1= 2.04, r2= 2.54, r3= 3.94, r4= 4.44,  &end
#
# 1	DC	H1'	1	DC	H6	2.73	4.13
 &rst
  ixpk= 0, nxpk= 0, iat=  10,  13, r1= 2.23, r2= 2.73, r3= 4.13, r4= 4.63,  &end
#
# 7	DT	H2'	8	DT	M7	2.32	3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 218,  -1, r1= 1.82, r2= 2.32, r3= 4.47, r4= 4.97,
 igr2= 238, 239, 240,
 &end
#
# 22	8OG	H2'	23	DC	H5	3.20	4.60
 &rst
  ixpk= 0, nxpk= 0, iat= 700, 719, r1= 2.70, r2= 3.20, r3= 4.60, r4= 5.10,  &end
#
# 19	DT	H2'	19	DT	H6	2.35	3.35
 &rst
  ixpk= 0, nxpk= 0, iat= 601, 586, r1= 1.85, r2= 2.35, r3= 3.35, r4= 3.85,  &end
#
# 18	DA	H2	19	DT	H1'	3.28	4.68
 &rst
  ixpk= 0, nxpk= 0, iat= 563, 583, r1= 2.78, r2= 3.28, r3= 4.68, r4= 5.18,  &end
#
# 3	DC	H1'	3	DC	H6	3.21	4.61
 &rst
  ixpk= 0, nxpk= 0, iat=  73,  76, r1= 2.71, r2= 3.21, r3= 4.61, r4= 5.11,  &end
#
# 3	DC	H1'	3	DC	H2''	2.35	3.35
 &rst
  ixpk= 0, nxpk= 0, iat=  73,  90, r1= 1.85, r2= 2.35, r3= 3.35, r4= 3.85,  &end
#
# 15	DC	H1'	16	DG	H8	3.66	5.06
 &rst
  ixpk= 0, nxpk= 0, iat= 456, 489, r1= 3.16, r2= 3.66, r3= 5.06, r4= 5.56,  &end
#
# 17	DA	H2'	17	DA	H3'	2.34	3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 537, 535, r1= 1.84, r2= 2.34, r3= 3.34, r4= 3.84,  &end
#
# 6	DA	H8	7	DT	M7	2.47	3.87
 &rst
  ixpk= 0, nxpk= 0, iat= 171,  -1, r1= 1.97, r2= 2.47, r3= 4.65, r4= 5.15,
 igr2= 206, 207, 208,
 &end
#
# 6	DA	H2''	7	DT	H6	2.30	3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 187, 203, r1= 1.80, r2= 2.30, r3= 3.70, r4= 4.20,  &end
#
# 8	DT	M7	9	DMC	M7	2.66	4.06
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 2.16, r2= 2.66, r3= 5.86, r4= 6.36,
 igr1= 238, 239, 240,
 igr2= 282, 283, 284,
 &end
#
# 7	DT	H1'	8	DT	H6	3.30	4.70
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 235, r1= 2.80, r2= 3.30, r3= 4.70, r4= 5.20,  &end
#
# 4	DG	H2''	4	DG	H3'	2.40	3.40
 &rst
  ixpk= 0, nxpk= 0, iat= 123, 120, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 13	DC	H1'	13	DC	H6	2.73	4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 393, 396, r1= 2.23, r2= 2.73, r3= 4.13, r4= 4.63,  &end
#
# 11	DC	H1'	11	DC	H2''	2.24	3.24
 &rst
  ixpk= 0, nxpk= 0, iat= 331, 348, r1= 1.74, r2= 2.24, r3= 3.24, r4= 3.74,  &end
#
# 14	DG	H2'	14	DG	H3'	2.26	3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 442, 440, r1= 1.76, r2= 2.26, r3= 3.26, r4= 3.76,  &end
#
# 17	DA	H2	18	DA	H1'	3.91	5.31
 &rst
  ixpk= 0, nxpk= 0, iat= 531, 551, r1= 3.41, r2= 3.91, r3= 5.31, r4= 5.81,  &end
#
# 3	DC	H2''	3	DC	H3'	2.78	4.18
 &rst
  ixpk= 0, nxpk= 0, iat=  90,  87, r1= 2.28, r2= 2.78, r3= 4.18, r4= 4.68,  &end
#
# 20	DT	H3'	20	DT	H6	2.92	4.32
 &rst
  ixpk= 0, nxpk= 0, iat= 631, 618, r1= 2.42, r2= 2.92, r3= 4.32, r4= 4.82,  &end
#
# 23	DC	H2'	24	DG	H8	2.91	4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 730, 747, r1= 2.41, r2= 2.91, r3= 4.31, r4= 4.81,  &end
#
# 8	DT	H3'	9	DMC	M7	3.01	4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 248,  -1, r1= 2.51, r2= 3.01, r3= 5.30, r4= 5.80,
 igr2= 282, 283, 284,
 &end
#
# 19	DT	H1'	19	DT	H6	3.26	4.66
 &rst
  ixpk= 0, nxpk= 0, iat= 583, 586, r1= 2.76, r2= 3.26, r3= 4.66, r4= 5.16,  &end
#
# 19	DT	H3'	19	DT	H6	3.13	4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 599, 586, r1= 2.63, r2= 3.13, r3= 4.53, r4= 5.03,  &end
#
# 6	DA	H3'	7	DT	H6	3.78	5.18
 &rst
  ixpk= 0, nxpk= 0, iat= 184, 203, r1= 3.28, r2= 3.78, r3= 5.18, r4= 5.68,  &end
#
# 7	DT	H1'	7	DT	H2''	2.25	3.25
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 219, r1= 1.75, r2= 2.25, r3= 3.25, r4= 3.75,  &end
#
# 8	DT	H1'	8	DT	H2'	2.49	3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 250, r1= 1.99, r2= 2.49, r3= 3.89, r4= 4.39,  &end
#
# 18	DA	H2''	19	DT	M7	2.53	3.93
 &rst
  ixpk= 0, nxpk= 0, iat= 570,  -1, r1= 2.03, r2= 2.53, r3= 4.72, r4= 5.22,
 igr2= 589, 590, 591,
 &end
#
# 10	8OG	H1'	10	8OG	H2''	2.34	3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 297, 318, r1= 1.84, r2= 2.34, r3= 3.34, r4= 3.84,  &end
#
# 11	DC	H2'	11	DC	H6	2.19	3.19
 &rst
  ixpk= 0, nxpk= 0, iat= 347, 334, r1= 1.69, r2= 2.19, r3= 3.19, r4= 3.69,  &end
#
# 2	DG	H1'	2	DG	H2''	2.29	3.29
 &rst
  ixpk= 0, nxpk= 0, iat=  40,  60, r1= 1.79, r2= 2.29, r3= 3.29, r4= 3.79,  &end
#
# 5	DA	H2''	5	DA	H3'	2.32	3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 155, 152, r1= 1.82, r2= 2.32, r3= 3.72, r4= 4.22,  &end
#
# 2	DG	H3'	2	DG	H8	3.04	4.44
 &rst
  ixpk= 0, nxpk= 0, iat=  57,  43, r1= 2.54, r2= 3.04, r3= 4.44, r4= 4.94,  &end
#
# 17	DA	H2''	17	DA	H3'	2.32	3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 538, 535, r1= 1.82, r2= 2.32, r3= 3.72, r4= 4.22,  &end
#
# 9	DMC	H1'	9	DMC	H2''	2.30	3.30
 &rst
  ixpk= 0, nxpk= 0, iat= 268, 266, r1= 1.80, r2= 2.30, r3= 3.30, r4= 3.80,  &end
#
# 22	8OG	H1'	22	8OG	H2'	2.57	3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 680, 700, r1= 2.07, r2= 2.57, r3= 3.97, r4= 4.47,  &end
#
# 23	DC	H1'	23	DC	H2'	2.58	3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 714, 730, r1= 2.08, r2= 2.58, r3= 3.98, r4= 4.48,  &end
#
# 23	DC	H5	23	DC	H6	2.29	3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 719, 717, r1= 1.79, r2= 2.29, r3= 3.29, r4= 3.79,  &end
#
# 1	DC	H3'	1	DC	H6	3.27	4.67
 &rst
  ixpk= 0, nxpk= 0, iat=  24,  13, r1= 2.77, r2= 3.27, r3= 4.67, r4= 5.17,  &end
#
# 18	DA	H2''	19	DT	H6	2.30	3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 570, 586, r1= 1.80, r2= 2.30, r3= 3.70, r4= 4.20,  &end
#
# 13	DC	H3'	13	DC	H6	3.27	4.67
 &rst
  ixpk= 0, nxpk= 0, iat= 407, 396, r1= 2.77, r2= 3.27, r3= 4.67, r4= 5.17,  &end
#
# 20	DT	H2''	20	DT	H6	2.41	3.81
 &rst
  ixpk= 0, nxpk= 0, iat= 634, 618, r1= 1.91, r2= 2.41, r3= 3.81, r4= 4.31,  &end
#
# 20	DT	H2'	20	DT	H3'	2.33	3.33
 &rst
  ixpk= 0, nxpk= 0, iat= 633, 631, r1= 1.83, r2= 2.33, r3= 3.33, r4= 3.83,  &end
#
# 6	DA	H2''	6	DA	H3'	2.31	3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 187, 184, r1= 1.81, r2= 2.31, r3= 3.71, r4= 4.21,  &end
#
# 16	DG	H2'	16	DG	H8	2.21	3.21
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 489, r1= 1.71, r2= 2.21, r3= 3.21, r4= 3.71,  &end
#
# 7	DT	H2'	7	DT	H3'	2.32	3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 216, r1= 1.82, r2= 2.32, r3= 3.32, r4= 3.82,  &end
#
# 22	8OG	H1'	22	8OG	H2''	2.34	3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 680, 701, r1= 1.84, r2= 2.34, r3= 3.34, r4= 3.84,  &end
#
# 19	DT	H3'	20	DT	M7	2.97	4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 599,  -1, r1= 2.47, r2= 2.97, r3= 5.25, r4= 5.75,
 igr2= 621, 622, 623,
 &end
#
# 20	DT	H1'	20	DT	H2'	2.49	3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 633, r1= 1.99, r2= 2.49, r3= 3.89, r4= 4.39,  &end
#
# 10	8OG	H1'	10	8OG	H2'	2.57	3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 297, 317, r1= 2.07, r2= 2.57, r3= 3.97, r4= 4.47,  &end
#
# 22	8OG	H2'	22	8OG	H3'	2.36	3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 700, 698, r1= 1.86, r2= 2.36, r3= 3.36, r4= 3.86,  &end
#
# 2	DG	H1'	3	DC	H6	2.95	4.35
 &rst
  ixpk= 0, nxpk= 0, iat=  40,  76, r1= 2.45, r2= 2.95, r3= 4.35, r4= 4.85,  &end
#
# 1	DC	H1'	1	DC	H2''	2.48	3.88
 &rst
  ixpk= 0, nxpk= 0, iat=  10,  27, r1= 1.98, r2= 2.48, r3= 3.88, r4= 4.38,  &end
#
# 8	DT	H1'	8	DT	H2''	2.23	3.23
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 251, r1= 1.73, r2= 2.23, r3= 3.23, r4= 3.73,  &end
#
# 15	DC	H2'	15	DC	H3'	2.31	3.71
 &rst
  ixpk= 0, nxpk= 0, iat= 472, 470, r1= 1.81, r2= 2.31, r3= 3.71, r4= 4.21,  &end
#
# 12	DG	H1'	12	DG	H2''	2.26	3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 361, 381, r1= 1.76, r2= 2.26, r3= 3.26, r4= 3.76,  &end
#
# 15	DC	H2'	16	DG	H8	2.85	4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 472, 489, r1= 2.35, r2= 2.85, r3= 4.25, r4= 4.75,  &end
#
# 13	DC	H2'	14	DG	H8	2.92	4.32
 &rst
  ixpk= 0, nxpk= 0, iat= 409, 426, r1= 2.42, r2= 2.92, r3= 4.32, r4= 4.82,  &end
#
# 13	DC	H3'	14	DG	H8	3.56	4.96
 &rst
  ixpk= 0, nxpk= 0, iat= 407, 426, r1= 3.06, r2= 3.56, r3= 4.96, r4= 5.46,  &end
#
# 22	8OG	H2''	22	8OG	H3'	2.32	3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 701, 698, r1= 1.82, r2= 2.32, r3= 3.72, r4= 4.22,  &end
#
# 14	DG	H1'	14	DG	H2'	2.37	3.77
 &rst
  ixpk= 0, nxpk= 0, iat= 423, 442, r1= 1.87, r2= 2.37, r3= 3.77, r4= 4.27,  &end
#
# 24	DG	H1'	24	DG	H2''	2.26	3.26
 &rst
  ixpk= 0, nxpk= 0, iat= 744, 764, r1= 1.76, r2= 2.26, r3= 3.26, r4= 3.76,  &end
#
# 3	DC	H1'	3	DC	H2'	2.58	3.98
 &rst
  ixpk= 0, nxpk= 0, iat=  73,  89, r1= 2.08, r2= 2.58, r3= 3.98, r4= 4.48,  &end
#
# 11	DC	H2'	12	DG	H8	2.91	4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 347, 364, r1= 2.41, r2= 2.91, r3= 4.31, r4= 4.81,  &end
#
# 16	DG	H2''	16	DG	H8	2.35	3.75
 &rst
  ixpk= 0, nxpk= 0, iat= 506, 489, r1= 1.85, r2= 2.35, r3= 3.75, r4= 4.25,  &end
#
# 7	DT	M7	8	DT	M7	2.70	4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 2.20, r2= 2.70, r3= 5.91, r4= 6.41,
 igr1= 206, 207, 208,
 igr2= 238, 239, 240,
 &end
#
# 14	DG	H2'	14	DG	H8	2.10	3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 442, 426, r1= 1.60, r2= 2.10, r3= 3.10, r4= 3.60,  &end
#
# 11	DC	H1'	12	DG	H8	3.60	5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 331, 364, r1= 3.10, r2= 3.60, r3= 5.00, r4= 5.50,  &end
#
# 4	DG	H1'	4	DG	H2''	2.43	3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 103, 123, r1= 1.93, r2= 2.43, r3= 3.43, r4= 3.93,  &end
#
# 21	DMC	H1'	21	DMC	H2'	2.49	3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 651, 648, r1= 1.99, r2= 2.49, r3= 3.89, r4= 4.39,  &end
#
# 7	DT	H6	8	DT	M7	2.48	3.88
 &rst
  ixpk= 0, nxpk= 0, iat= 203,  -1, r1= 1.98, r2= 2.48, r3= 4.66, r4= 5.16,
 igr2= 238, 239, 240,
 &end
#
# 14	DG	H3'	14	DG	H8	3.04	4.44
 &rst
  ixpk= 0, nxpk= 0, iat= 440, 426, r1= 2.54, r2= 3.04, r3= 4.44, r4= 4.94,  &end
#
# 6	DA	H2'	6	DA	H3'	2.32	3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 186, 184, r1= 1.82, r2= 2.32, r3= 3.32, r4= 3.82,  &end
#
# 20	DT	H2'	21	DMC	M7	2.40	3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 633,  -1, r1= 1.90, r2= 2.40, r3= 4.56, r4= 5.06,
 igr2= 665, 666, 667,
 &end
#
# 2	DG	H1'	2	DG	H8	3.15	4.55
 &rst
  ixpk= 0, nxpk= 0, iat=  40,  43, r1= 2.65, r2= 3.15, r3= 4.55, r4= 5.05,  &end
#
# 1	DC	H3'	2	DG	H8	3.56	4.96
 &rst
  ixpk= 0, nxpk= 0, iat=  24,  43, r1= 3.06, r2= 3.56, r3= 4.96, r4= 5.46,  &end
#
# 12	DG	H2''	12	DG	H8	2.30	3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 381, 364, r1= 1.80, r2= 2.30, r3= 3.70, r4= 4.20,  &end
#
# 3	DC	H2''	3	DC	H6	2.84	4.24
 &rst
  ixpk= 0, nxpk= 0, iat=  90,  76, r1= 2.34, r2= 2.84, r3= 4.24, r4= 4.74,  &end
#
# 7	DT	H2'	7	DT	H6	2.35	3.35
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 203, r1= 1.85, r2= 2.35, r3= 3.35, r4= 3.85,  &end
#
# 7	DT	H2'	8	DT	H6	2.68	4.08
 &rst
  ixpk= 0, nxpk= 0, iat= 218, 235, r1= 2.18, r2= 2.68, r3= 4.08, r4= 4.58,  &end
#
# 20	DT	H2'	21	DMC	H6	2.78	4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 633, 664, r1= 2.28, r2= 2.78, r3= 4.18, r4= 4.68,  &end
#
# 6	DA	H3'	7	DT	M7	3.24	4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 184,  -1, r1= 2.74, r2= 3.24, r3= 5.57, r4= 6.07,
 igr2= 206, 207, 208,
 &end
#
# 4	DG	H2''	5	DA	H8	2.43	3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 123, 139, r1= 1.93, r2= 2.43, r3= 3.83, r4= 4.33,  &end
#
# 6	DA	H1'	7	DT	M7	3.68	5.08
 &rst
  ixpk= 0, nxpk= 0, iat= 168,  -1, r1= 3.18, r2= 3.68, r3= 6.10, r4= 6.60,
 igr2= 206, 207, 208,
 &end
#
# 15	DC	H2''	16	DG	H8	2.85	4.25
 &rst
  ixpk= 0, nxpk= 0, iat= 473, 489, r1= 2.35, r2= 2.85, r3= 4.25, r4= 4.75,  &end
#
# 5	DA	H2	6	DA	H2	3.74	5.14
 &rst
  ixpk= 0, nxpk= 0, iat= 148, 180, r1= 3.24, r2= 3.74, r3= 5.14, r4= 5.64,  &end
#
# 8	DT	H1'	18	DA	H2	3.26	4.66
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 563, r1= 2.76, r2= 3.26, r3= 4.66, r4= 5.16,  &end
#
# 10	8OG	H2''	11	DC	H5	2.73	4.13
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 336, r1= 2.23, r2= 2.73, r3= 4.13, r4= 4.63,  &end
#
# 19	DT	H2'	20	DT	H6	2.68	4.08
 &rst
  ixpk= 0, nxpk= 0, iat= 601, 618, r1= 2.18, r2= 2.68, r3= 4.08, r4= 4.58,  &end
#
# 2	DG	H2''	3	DC	H5	2.95	4.35
 &rst
  ixpk= 0, nxpk= 0, iat=  60,  78, r1= 2.45, r2= 2.95, r3= 4.35, r4= 4.85,  &end
#
# 10	8OG	H2'	10	8OG	H3'	2.36	3.36
 &rst
  ixpk= 0, nxpk= 0, iat= 317, 315, r1= 1.86, r2= 2.36, r3= 3.36, r4= 3.86,  &end
#
# 20	DT	M7	20	DT	H6	2.36	3.36
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 618, r1= 1.86, r2= 2.36, r3= 4.04, r4= 4.54,
 igr1= 621, 622, 623,
 &end
#
# 15	DC	H1'	15	DC	H6	3.21	4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 456, 459, r1= 2.71, r2= 3.21, r3= 4.61, r4= 5.11,  &end
#
# 17	DA	H1'	17	DA	H2'	2.63	4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 537, r1= 2.13, r2= 2.63, r3= 4.03, r4= 4.53,  &end
#
# 16	DG	H2''	17	DA	H8	2.43	3.83
 &rst
  ixpk= 0, nxpk= 0, iat= 506, 522, r1= 1.93, r2= 2.43, r3= 3.83, r4= 4.33,  &end
#
# 17	DA	H2	18	DA	H2	3.74	5.14
 &rst
  ixpk= 0, nxpk= 0, iat= 531, 563, r1= 3.24, r2= 3.74, r3= 5.14, r4= 5.64,  &end
#
# 2	DG	H8	3	DC	H5	3.44	4.84
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  78, r1= 2.94, r2= 3.44, r3= 4.84, r4= 5.34,  &end
#
# 11	DC	H1'	11	DC	H6	3.12	4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 331, 334, r1= 2.62, r2= 3.12, r3= 4.52, r4= 5.02,  &end
#
# 15	DC	H3'	15	DC	H6	3.16	4.56
 &rst
  ixpk= 0, nxpk= 0, iat= 470, 459, r1= 2.66, r2= 3.16, r3= 4.56, r4= 5.06,  &end
#
# 11	DC	H2'	11	DC	H3'	2.38	3.38
 &rst
  ixpk= 0, nxpk= 0, iat= 347, 345, r1= 1.88, r2= 2.38, r3= 3.38, r4= 3.88,  &end
#
# 13	DC	H1'	14	DG	H8	3.60	5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 393, 426, r1= 3.10, r2= 3.60, r3= 5.00, r4= 5.50,  &end
#
# 24	DG	H3'	24	DG	H8	2.93	4.33
 &rst
  ixpk= 0, nxpk= 0, iat= 761, 747, r1= 2.43, r2= 2.93, r3= 4.33, r4= 4.83,  &end
#
# 9	DMC	M7	9	DMC	H6	2.28	3.28
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 281, r1= 1.78, r2= 2.28, r3= 3.94, r4= 4.44,
 igr1= 282, 283, 284,
 &end
#
# 6	DA	H1'	6	DA	H3'	3.37	4.77
 &rst
  ixpk= 0, nxpk= 0, iat= 168, 184, r1= 2.87, r2= 3.37, r3= 4.77, r4= 5.27,  &end
#
# 11	DC	H1'	11	DC	H2'	2.58	3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 331, 347, r1= 2.08, r2= 2.58, r3= 3.98, r4= 4.48,  &end
#
# 16	DG	H1'	16	DG	H2''	2.43	3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 486, 506, r1= 1.93, r2= 2.43, r3= 3.43, r4= 3.93,  &end
#
# 9	DMC	H1'	9	DMC	H2'	2.49	3.89
 &rst
  ixpk= 0, nxpk= 0, iat= 268, 265, r1= 1.99, r2= 2.49, r3= 3.89, r4= 4.39,  &end
#
# 24	DG	H2''	24	DG	H8	2.30	3.70
 &rst
  ixpk= 0, nxpk= 0, iat= 764, 747, r1= 1.80, r2= 2.30, r3= 3.70, r4= 4.20,  &end
#
# 4	DG	H1'	4	DG	H8	3.23	4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 103, 106, r1= 2.73, r2= 3.23, r3= 4.63, r4= 5.13,  &end
#
# 18	DA	H1'	18	DA	H8	3.43	4.83
 &rst
  ixpk= 0, nxpk= 0, iat= 551, 554, r1= 2.93, r2= 3.43, r3= 4.83, r4= 5.33,  &end
#
# 6	DA	H3'	6	DA	H8	2.91	4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 184, 171, r1= 2.41, r2= 2.91, r3= 4.31, r4= 4.81,  &end
#
# 14	DG	H8	15	DC	H5	3.44	4.84
 &rst
  ixpk= 0, nxpk= 0, iat= 426, 461, r1= 2.94, r2= 3.44, r3= 4.84, r4= 5.34,  &end
#
# 11	DC	H2''	11	DC	H6	2.54	3.94
 &rst
  ixpk= 0, nxpk= 0, iat= 348, 334, r1= 2.04, r2= 2.54, r3= 3.94, r4= 4.44,  &end
#
# 20	DT	H1'	20	DT	H2''	2.23	3.23
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 634, r1= 1.73, r2= 2.23, r3= 3.23, r4= 3.73,  &end
#
# 15	DC	H2''	15	DC	H6	2.84	4.24
 &rst
  ixpk= 0, nxpk= 0, iat= 473, 459, r1= 2.34, r2= 2.84, r3= 4.24, r4= 4.74,  &end
#
# 5	DA	H1'	5	DA	H2'	2.63	4.03
 &rst
  ixpk= 0, nxpk= 0, iat= 136, 154, r1= 2.13, r2= 2.63, r3= 4.03, r4= 4.53,  &end
#
# 18	DA	H8	19	DT	H6	4.12	5.52
 &rst
  ixpk= 0, nxpk= 0, iat= 554, 586, r1= 3.62, r2= 4.12, r3= 5.52, r4= 6.02,  &end
#
# 6	DA	H2'	6	DA	H8	2.34	3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 186, 171, r1= 1.84, r2= 2.34, r3= 3.34, r4= 3.84,  &end
#
# 15	DC	H2'	15	DC	H6	2.27	3.27
 &rst
  ixpk= 0, nxpk= 0, iat= 472, 459, r1= 1.77, r2= 2.27, r3= 3.27, r4= 3.77,  &end
#
# 6	DA	H1'	7	DT	H6	2.99	4.39
 &rst
  ixpk= 0, nxpk= 0, iat= 168, 203, r1= 2.49, r2= 2.99, r3= 4.39, r4= 4.89,  &end
#
# 14	DG	H2''	15	DC	H5	2.95	4.35
 &rst
  ixpk= 0, nxpk= 0, iat= 443, 461, r1= 2.45, r2= 2.95, r3= 4.35, r4= 4.85,  &end
#
# 19	DT	M7	19	DT	H6	2.35	3.35
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 586, r1= 1.85, r2= 2.35, r3= 4.02, r4= 4.52,
 igr1= 589, 590, 591,
 &end
#
# 2	DG	H1'	2	DG	H2'	2.37	3.77
 &rst
  ixpk= 0, nxpk= 0, iat=  40,  59, r1= 1.87, r2= 2.37, r3= 3.77, r4= 4.27,  &end
#
# 20	DT	H3'	21	DMC	M7	3.01	4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 631,  -1, r1= 2.51, r2= 3.01, r3= 5.30, r4= 5.80,
 igr2= 665, 666, 667,
 &end
#
# 2	DG	H2'	3	DC	H6	3.01	4.41
 &rst
  ixpk= 0, nxpk= 0, iat=  59,  76, r1= 2.51, r2= 3.01, r3= 4.41, r4= 4.91,  &end
#
# 2	DG	H2'	2	DG	H3'	2.26	3.26
 &rst
  ixpk= 0, nxpk= 0, iat=  59,  57, r1= 1.76, r2= 2.26, r3= 3.26, r4= 3.76,  &end
#
# 7	DT	H2''	7	DT	H3'	2.40	3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 219, 216, r1= 1.90, r2= 2.40, r3= 3.80, r4= 4.30,  &end
#
# 19	DT	H2'	20	DT	M7	2.32	3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 601,  -1, r1= 1.82, r2= 2.32, r3= 4.47, r4= 4.97,
 igr2= 621, 622, 623,
 &end
#
# 9	DMC	H1'	9	DMC	H6	3.15	4.55
 &rst
  ixpk= 0, nxpk= 0, iat= 268, 281, r1= 2.65, r2= 3.15, r3= 4.55, r4= 5.05,  &end
#
# 7	DT	H3'	7	DT	H6	3.13	4.53
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 203, r1= 2.63, r2= 3.13, r3= 4.53, r4= 5.03,  &end
#
# 16	DG	H1'	16	DG	H8	3.23	4.63
 &rst
  ixpk= 0, nxpk= 0, iat= 486, 489, r1= 2.73, r2= 3.23, r3= 4.63, r4= 5.13,  &end
#
# 8	DT	M7	8	DT	H6	2.36	3.36
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 235, r1= 1.86, r2= 2.36, r3= 4.04, r4= 4.54,
 igr1= 238, 239, 240,
 &end
#
# 8	DT	H6	9	DMC	M7	2.47	3.87
 &rst
  ixpk= 0, nxpk= 0, iat= 235,  -1, r1= 1.97, r2= 2.47, r3= 4.65, r4= 5.15,
 igr2= 282, 283, 284,
 &end
#
# 10	8OG	H2'	11	DC	H5	3.20	4.60
 &rst
  ixpk= 0, nxpk= 0, iat= 317, 336, r1= 2.70, r2= 3.20, r3= 4.60, r4= 5.10,  &end
#
# 7	DT	H6	8	DT	H6	4.19	5.59
 &rst
  ixpk= 0, nxpk= 0, iat= 203, 235, r1= 3.69, r2= 4.19, r3= 5.59, r4= 6.09,  &end
#
# 7	DT	H3'	8	DT	M7	2.97	4.37
 &rst
  ixpk= 0, nxpk= 0, iat= 216,  -1, r1= 2.47, r2= 2.97, r3= 5.25, r4= 5.75,
 igr2= 238, 239, 240,
 &end
#
# 16	DG	H2''	16	DG	H3'	2.40	3.40
 &rst
  ixpk= 0, nxpk= 0, iat= 506, 503, r1= 1.90, r2= 2.40, r3= 3.40, r4= 3.90,  &end
#
# 2	DG	H2'	2	DG	H8	2.10	3.10
 &rst
  ixpk= 0, nxpk= 0, iat=  59,  43, r1= 1.60, r2= 2.10, r3= 3.10, r4= 3.60,  &end
#
# 6	DA	H8	7	DT	H6	4.12	5.52
 &rst
  ixpk= 0, nxpk= 0, iat= 171, 203, r1= 3.62, r2= 4.12, r3= 5.52, r4= 6.02,  &end
#
# 15	DC	H5	15	DC	H6	2.28	3.28
 &rst
  ixpk= 0, nxpk= 0, iat= 461, 459, r1= 1.78, r2= 2.28, r3= 3.28, r4= 3.78,  &end
#
# 19	DT	H1'	20	DT	H6	3.30	4.70
 &rst
  ixpk= 0, nxpk= 0, iat= 583, 618, r1= 2.80, r2= 3.30, r3= 4.70, r4= 5.20,  &end
#
# 15	DC	H1'	15	DC	H2'	2.58	3.98
 &rst
  ixpk= 0, nxpk= 0, iat= 456, 472, r1= 2.08, r2= 2.58, r3= 3.98, r4= 4.48,  &end
#
# 15	DC	H2''	15	DC	H3'	2.78	4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 473, 470, r1= 2.28, r2= 2.78, r3= 4.18, r4= 4.68,  &end
#
# 17	DA	H1'	17	DA	H2''	2.32	3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 538, r1= 1.82, r2= 2.32, r3= 3.32, r4= 3.82,  &end
#
# 7	DT	M7	7	DT	H6	2.35	3.35
 &rst
  ixpk= 0, nxpk= 0, iat=  -1, 203, r1= 1.85, r2= 2.35, r3= 4.02, r4= 4.52,
 igr1= 206, 207, 208,
 &end
#
# 3	DC	H2''	4	DG	H8	2.85	4.25
 &rst
  ixpk= 0, nxpk= 0, iat=  90, 106, r1= 2.35, r2= 2.85, r3= 4.25, r4= 4.75,  &end
#
# 20	DT	H2'	20	DT	H6	2.22	3.22
 &rst
  ixpk= 0, nxpk= 0, iat= 633, 618, r1= 1.72, r2= 2.22, r3= 3.22, r4= 3.72,  &end
#
# 23	DC	H3'	24	DG	H8	3.74	5.14
 &rst
  ixpk= 0, nxpk= 0, iat= 728, 747, r1= 3.24, r2= 3.74, r3= 5.14, r4= 5.64,  &end
#
# 5	DA	H2'	5	DA	H8	2.05	3.05
 &rst
  ixpk= 0, nxpk= 0, iat= 154, 139, r1= 1.55, r2= 2.05, r3= 3.05, r4= 3.55,  &end
#
# 4	DG	H1'	5	DA	H8	2.78	4.18
 &rst
  ixpk= 0, nxpk= 0, iat= 103, 139, r1= 2.28, r2= 2.78, r3= 4.18, r4= 4.68,  &end
#
# 17	DA	H1'	17	DA	H3'	3.26	4.66
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 535, r1= 2.76, r2= 3.26, r3= 4.66, r4= 5.16,  &end
#
# 23	DC	H2'	23	DC	H6	2.19	3.19
 &rst
  ixpk= 0, nxpk= 0, iat= 730, 717, r1= 1.69, r2= 2.19, r3= 3.19, r4= 3.69,  &end
#
# 9	DMC	H1'	9	DMC	H3'	3.40	4.80
 &rst
  ixpk= 0, nxpk= 0, iat= 268, 263, r1= 2.90, r2= 3.40, r3= 4.80, r4= 5.30,  &end
#
# 7	DT	H3'	8	DT	H6	4.18	5.58
 &rst
  ixpk= 0, nxpk= 0, iat= 216, 235, r1= 3.68, r2= 4.18, r3= 5.58, r4= 6.08,  &end
#
# 19	DT	H1'	19	DT	H2''	2.25	3.25
 &rst
  ixpk= 0, nxpk= 0, iat= 583, 602, r1= 1.75, r2= 2.25, r3= 3.25, r4= 3.75,  &end
#
# 21	DMC	H1'	21	DMC	H3'	3.40	4.80
 &rst
  ixpk= 0, nxpk= 0, iat= 651, 646, r1= 2.90, r2= 3.40, r3= 4.80, r4= 5.30,  &end
#
# 16	DG	H3'	16	DG	H8	3.10	4.50
 &rst
  ixpk= 0, nxpk= 0, iat= 503, 489, r1= 2.60, r2= 3.10, r3= 4.50, r4= 5.00,  &end
#
# 23	DC	H2'	23	DC	H3'	2.38	3.38
 &rst
  ixpk= 0, nxpk= 0, iat= 730, 728, r1= 1.88, r2= 2.38, r3= 3.38, r4= 3.88,  &end
#
# 18	DA	H3'	19	DT	H6	3.78	5.18
 &rst
  ixpk= 0, nxpk= 0, iat= 567, 586, r1= 3.28, r2= 3.78, r3= 5.18, r4= 5.68,  &end
#
# 3	DC	H3'	3	DC	H6	3.16	4.56
 &rst
  ixpk= 0, nxpk= 0, iat=  87,  76, r1= 2.66, r2= 3.16, r3= 4.56, r4= 5.06,  &end
#
# 1	DC	H2'	1	DC	H3'	2.48	3.48
 &rst
  ixpk= 0, nxpk= 0, iat=  26,  24, r1= 1.98, r2= 2.48, r3= 3.48, r4= 3.98,  &end
#
# 14	DG	H2''	15	DC	H6	2.57	3.97
 &rst
  ixpk= 0, nxpk= 0, iat= 443, 459, r1= 2.07, r2= 2.57, r3= 3.97, r4= 4.47,  &end
#
# 5	DA	H1'	5	DA	H2	3.40	4.80
 &rst
  ixpk= 0, nxpk= 0, iat= 136, 148, r1= 2.90, r2= 3.40, r3= 4.80, r4= 5.30,  &end
#
# 19	DT	H6	20	DT	H6	4.19	5.59
 &rst
  ixpk= 0, nxpk= 0, iat= 586, 618, r1= 3.69, r2= 4.19, r3= 5.59, r4= 6.09,  &end
#
# 20	DT	H1'	20	DT	H6	3.14	4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 618, r1= 2.64, r2= 3.14, r3= 4.54, r4= 5.04,  &end
#
# 8	DT	H1'	8	DT	H6	3.14	4.54
 &rst
  ixpk= 0, nxpk= 0, iat= 232, 235, r1= 2.64, r2= 3.14, r3= 4.54, r4= 5.04,  &end
#
# 19	DT	H3'	20	DT	H6	4.18	5.58
 &rst
  ixpk= 0, nxpk= 0, iat= 599, 618, r1= 3.68, r2= 4.18, r3= 5.58, r4= 6.08,  &end
#
# 21	DMC	H1'	21	DMC	H6	3.15	4.55
 &rst
  ixpk= 0, nxpk= 0, iat= 651, 664, r1= 2.65, r2= 3.15, r3= 4.55, r4= 5.05,  &end
#
# 13	DC	H5	13	DC	H6	2.28	3.28
 &rst
  ixpk= 0, nxpk= 0, iat= 398, 396, r1= 1.78, r2= 2.28, r3= 3.28, r4= 3.78,  &end
#
# 17	DA	H2'	17	DA	H8	2.05	3.05
 &rst
  ixpk= 0, nxpk= 0, iat= 537, 522, r1= 1.55, r2= 2.05, r3= 3.05, r4= 3.55,  &end
#
# 13	DC	H2''	13	DC	H6	2.90	4.30
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 396, r1= 2.40, r2= 2.90, r3= 4.30, r4= 4.80,  &end
#
# 19	DT	H2''	20	DT	H6	2.43	3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 602, 618, r1= 1.93, r2= 2.43, r3= 3.43, r4= 3.93,  &end
#
# 16	DG	H1'	16	DG	H2'	2.44	3.84
 &rst
  ixpk= 0, nxpk= 0, iat= 486, 505, r1= 1.94, r2= 2.44, r3= 3.84, r4= 4.34,  &end
#
# 18	DA	H1'	18	DA	H2''	2.34	3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 551, 570, r1= 1.84, r2= 2.34, r3= 3.34, r4= 3.84,  &end
#
# 17	DA	H1'	17	DA	H2	3.40	4.80
 &rst
  ixpk= 0, nxpk= 0, iat= 519, 531, r1= 2.90, r2= 3.40, r3= 4.80, r4= 5.30,  &end
#
# 3	DC	H1'	4	DG	H8	3.66	5.06
 &rst
  ixpk= 0, nxpk= 0, iat=  73, 106, r1= 3.16, r2= 3.66, r3= 5.06, r4= 5.56,  &end
#
# 19	DT	H6	20	DT	M7	2.48	3.88
 &rst
  ixpk= 0, nxpk= 0, iat= 586,  -1, r1= 1.98, r2= 2.48, r3= 4.66, r4= 5.16,
 igr2= 621, 622, 623,
 &end
#
# 23	DC	H1'	24	DG	H8	3.60	5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 714, 747, r1= 3.10, r2= 3.60, r3= 5.00, r4= 5.50,  &end
#
# 2	DG	H1'	2	DG	H3'	3.36	4.76
 &rst
  ixpk= 0, nxpk= 0, iat=  40,  57, r1= 2.86, r2= 3.36, r3= 4.76, r4= 5.26,  &end
#
# 12	DG	H2'	12	DG	H8	2.10	3.10
 &rst
  ixpk= 0, nxpk= 0, iat= 380, 364, r1= 1.60, r2= 2.10, r3= 3.10, r4= 3.60,  &end
#
# 21	DMC	H2'	21	DMC	H6	2.20	3.20
 &rst
  ixpk= 0, nxpk= 0, iat= 648, 664, r1= 1.70, r2= 2.20, r3= 3.20, r4= 3.70,  &end
#
# 12	DG	H1'	12	DG	H8	3.24	4.64
 &rst
  ixpk= 0, nxpk= 0, iat= 361, 364, r1= 2.74, r2= 3.24, r3= 4.64, r4= 5.14,  &end
#
# 20	DT	H1'	21	DMC	M7	3.48	4.88
 &rst
  ixpk= 0, nxpk= 0, iat= 615,  -1, r1= 2.98, r2= 3.48, r3= 5.86, r4= 6.36,
 igr2= 665, 666, 667,
 &end
#
# 14	DG	H2'	15	DC	H5	3.35	4.75
 &rst
  ixpk= 0, nxpk= 0, iat= 442, 461, r1= 2.85, r2= 3.35, r3= 4.75, r4= 5.25,  &end
#
# 18	DA	H3'	18	DA	H8	2.91	4.31
 &rst
  ixpk= 0, nxpk= 0, iat= 567, 554, r1= 2.41, r2= 2.91, r3= 4.31, r4= 4.81,  &end
#
# 5	DA	H1'	5	DA	H2''	2.32	3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 136, 155, r1= 1.82, r2= 2.32, r3= 3.32, r4= 3.82,  &end
#
# 6	DA	H2	20	DT	H1'	3.26	4.66
 &rst
  ixpk= 0, nxpk= 0, iat= 180, 615, r1= 2.76, r2= 3.26, r3= 4.66, r4= 5.16,  &end
#
# 16	DG	H1'	16	DG	H3'	3.21	4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 486, 503, r1= 2.71, r2= 3.21, r3= 4.61, r4= 5.11,  &end
#
# 4	DG	H2'	4	DG	H8	2.21	3.21
 &rst
  ixpk= 0, nxpk= 0, iat= 122, 106, r1= 1.71, r2= 2.21, r3= 3.21, r4= 3.71,  &end
#
# 1	DC	H5	1	DC	H6	2.28	3.28
 &rst
  ixpk= 0, nxpk= 0, iat=  15,  13, r1= 1.78, r2= 2.28, r3= 3.28, r4= 3.78,  &end
#
# 19	DT	H2''	19	DT	H3'	2.40	3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 602, 599, r1= 1.90, r2= 2.40, r3= 3.80, r4= 4.30,  &end
#
# 23	DC	H3'	23	DC	H6	3.08	4.48
 &rst
  ixpk= 0, nxpk= 0, iat= 728, 717, r1= 2.58, r2= 3.08, r3= 4.48, r4= 4.98,  &end
#
# 20	DT	H6	21	DMC	M7	2.47	3.87
 &rst
  ixpk= 0, nxpk= 0, iat= 618,  -1, r1= 1.97, r2= 2.47, r3= 4.65, r4= 5.15,
 igr2= 665, 666, 667,
 &end
#
# 6	DA	H1'	6	DA	H2''	2.34	3.34
 &rst
  ixpk= 0, nxpk= 0, iat= 168, 187, r1= 1.84, r2= 2.34, r3= 3.34, r4= 3.84,  &end
#
# 8	DT	H1'	9	DMC	M7	3.48	4.88
 &rst
  ixpk= 0, nxpk= 0, iat= 232,  -1, r1= 2.98, r2= 3.48, r3= 5.86, r4= 6.36,
 igr2= 282, 283, 284,
 &end
#
# 18	DA	H1'	19	DT	H6	2.99	4.39
 &rst
  ixpk= 0, nxpk= 0, iat= 551, 586, r1= 2.49, r2= 2.99, r3= 4.39, r4= 4.89,  &end
#
# 1	DC	H2'	2	DG	H8	2.92	4.32
 &rst
  ixpk= 0, nxpk= 0, iat=  26,  43, r1= 2.42, r2= 2.92, r3= 4.32, r4= 4.82,  &end
#
# 14	DG	H1'	14	DG	H2''	2.29	3.29
 &rst
  ixpk= 0, nxpk= 0, iat= 423, 443, r1= 1.79, r2= 2.29, r3= 3.29, r4= 3.79,  &end
#
# 22	8OG	H2''	23	DC	H6	2.75	4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 701, 717, r1= 2.25, r2= 2.75, r3= 4.15, r4= 4.65,  &end
#
# 19	DT	M7	20	DT	M7	2.70	4.10
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 2.20, r2= 2.70, r3= 5.91, r4= 6.41,
 igr1= 589, 590, 591,
 igr2= 621, 622, 623,
 &end
#
# 13	DC	H2'	13	DC	H6	2.31	3.31
 &rst
  ixpk= 0, nxpk= 0, iat= 409, 396, r1= 1.81, r2= 2.31, r3= 3.31, r4= 3.81,  &end
#
# 10	8OG	H2''	10	8OG	H3'	2.32	3.72
 &rst
  ixpk= 0, nxpk= 0, iat= 318, 315, r1= 1.82, r2= 2.32, r3= 3.72, r4= 4.22,  &end
#
# 18	DA	H1'	18	DA	H3'	3.37	4.77
 &rst
  ixpk= 0, nxpk= 0, iat= 551, 567, r1= 2.87, r2= 3.37, r3= 4.77, r4= 5.27,  &end
#
# 8	DT	H2''	8	DT	H6	2.41	3.81
 &rst
  ixpk= 0, nxpk= 0, iat= 251, 235, r1= 1.91, r2= 2.41, r3= 3.81, r4= 4.31,  &end
#
# 18	DA	H2'	18	DA	H3'	2.32	3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 569, 567, r1= 1.82, r2= 2.32, r3= 3.32, r4= 3.82,  &end
#
# 3	DC	H3'	4	DG	H8	4.16	5.56
 &rst
  ixpk= 0, nxpk= 0, iat=  87, 106, r1= 3.66, r2= 4.16, r3= 5.56, r4= 6.06,  &end
#
# 8	DT	H2'	8	DT	H3'	2.33	3.33
 &rst
  ixpk= 0, nxpk= 0, iat= 250, 248, r1= 1.83, r2= 2.33, r3= 3.33, r4= 3.83,  &end
#
# 1	DC	H2''	2	DG	H8	2.68	4.08
 &rst
  ixpk= 0, nxpk= 0, iat=  27,  43, r1= 2.18, r2= 2.68, r3= 4.08, r4= 4.58,  &end
#
# 13	DC	H1'	13	DC	H2''	2.48	3.88
 &rst
  ixpk= 0, nxpk= 0, iat= 393, 410, r1= 1.98, r2= 2.48, r3= 3.88, r4= 4.38,  &end
#
# 18	DA	H1'	19	DT	M7	3.68	5.08
 &rst
  ixpk= 0, nxpk= 0, iat= 551,  -1, r1= 3.18, r2= 3.68, r3= 6.10, r4= 6.60,
 igr2= 589, 590, 591,
 &end
#
# 4	DG	H1'	4	DG	H3'	3.21	4.61
 &rst
  ixpk= 0, nxpk= 0, iat= 103, 120, r1= 2.71, r2= 3.21, r3= 4.61, r4= 5.11,  &end
#
# 1	DC	H2''	1	DC	H6	2.90	4.30
 &rst
  ixpk= 0, nxpk= 0, iat=  27,  13, r1= 2.40, r2= 2.90, r3= 4.30, r4= 4.80,  &end
#
# 8	DT	H2'	9	DMC	M7	2.40	3.80
 &rst
  ixpk= 0, nxpk= 0, iat= 250,  -1, r1= 1.90, r2= 2.40, r3= 4.56, r4= 5.06,
 igr2= 282, 283, 284,
 &end
#
# 20	DT	H1'	21	DMC	H6	3.29	4.69
 &rst
  ixpk= 0, nxpk= 0, iat= 615, 664, r1= 2.79, r2= 3.29, r3= 4.69, r4= 5.19,  &end
#
# 23	DC	H2'	23	DC	H5	3.48	4.88
 &rst
  ixpk= 0, nxpk= 0, iat= 730, 719, r1= 2.98, r2= 3.48, r3= 4.88, r4= 5.38,  &end
#
# 7	DT	H2''	8	DT	H6	2.43	3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 219, 235, r1= 1.93, r2= 2.43, r3= 3.43, r4= 3.93,  &end
#
#################################################### NONAVERAGED
# 10	8OG	H1'	11	DC	H5	3.12	4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 297, 336, r1= 2.62, r2= 3.12, r3= 4.52, r4= 5.02, 
      rk2=32.0, rk3=32.0, ir6=1, ialtd=0,
 &end
#
# 4	DG	H2'	4	DG	H3'	2.32	3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 122, 120, r1= 1.82, r2= 2.32, r3= 3.32, r4= 3.82,  &end
#
# 19	DT	H1'	20	DT	M7	3.01	4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 583,  -1, r1= 2.51, r2= 3.01, r3= 5.30, r4= 5.80,
 igr2= 621, 622, 623,
 &end
#
# 13	DC	H2''	13	DC	H3'	2.75	4.15
 &rst
  ixpk= 0, nxpk= 0, iat= 410, 407, r1= 2.25, r2= 2.75, r3= 4.15, r4= 4.65,  &end
#
# 15	DC	H2'	15	DC	H5	3.16	4.56
 &rst
  ixpk= 0, nxpk= 0, iat= 472, 461, r1= 2.66, r2= 3.16, r3= 4.56, r4= 5.06,  &end
#
# 19	DT	H1'	19	DT	H3'	3.11	4.51
 &rst
  ixpk= 0, nxpk= 0, iat= 583, 599, r1= 2.61, r2= 3.11, r3= 4.51, r4= 5.01,  &end
#
# 7	DT	H1'	8	DT	M7	3.01	4.41
 &rst
  ixpk= 0, nxpk= 0, iat= 200,  -1, r1= 2.51, r2= 3.01, r3= 5.30, r4= 5.80,
 igr2= 238, 239, 240,
 &end
#
# 15	DC	H6	16	DG	H8	3.95	5.35
 &rst
  ixpk= 0, nxpk= 0, iat= 459, 489, r1= 3.45, r2= 3.95, r3= 5.35, r4= 5.85,  &end
#
# 11	DC	H6	12	DG	H8	4.18	5.58
 &rst
  ixpk= 0, nxpk= 0, iat= 334, 364, r1= 3.68, r2= 4.18, r3= 5.58, r4= 6.08,  &end
#
# 10	8OG	H1'	11	DC	H6	2.98	4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 297, 334, r1= 2.48, r2= 2.98, r3= 4.38, r4= 4.88,  &end
#
# 22	8OG	H1'	23	DC	H5	3.12	4.52
 &rst
  ixpk= 0, nxpk= 0, iat= 680, 719, r1= 2.62, r2= 3.12, r3= 4.52, r4= 5.02,  &end
#
# 10	8OG	H2'	11	DC	H6	3.18	4.58
 &rst
  ixpk= 0, nxpk= 0, iat= 317, 334, r1= 2.68, r2= 3.18, r3= 4.58, r4= 5.08,  &end
#
# 3	DC	H6	4	DG	H8	3.95	5.35
 &rst
  ixpk= 0, nxpk= 0, iat=  76, 106, r1= 3.45, r2= 3.95, r3= 5.35, r4= 5.85,  &end
#
# 2	DG	H8	3	DC	H6	3.77	5.17
 &rst
  ixpk= 0, nxpk= 0, iat=  43,  76, r1= 3.27, r2= 3.77, r3= 5.17, r4= 5.67,  &end
#
# 2	DG	H1'	3	DC	H5	3.50	4.90
 &rst
  ixpk= 0, nxpk= 0, iat=  40,  78, r1= 3.00, r2= 3.50, r3= 4.90, r4= 5.40,  &end
#
# 12	DG	H1'	12	DG	H3'	3.17	4.57
 &rst
  ixpk= 0, nxpk= 0, iat= 361, 378, r1= 2.67, r2= 3.17, r3= 4.57, r4= 5.07,  &end
#
# 20	DT	H6	21	DMC	H6	3.60	5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 618, 664, r1= 3.10, r2= 3.60, r3= 5.00, r4= 5.50,  &end
#
# 23	DC	H6	24	DG	H8	4.18	5.58
 &rst
  ixpk= 0, nxpk= 0, iat= 717, 747, r1= 3.68, r2= 4.18, r3= 5.58, r4= 6.08,  &end
#
# 14	DG	H1'	15	DC	H5	3.50	4.90
 &rst
  ixpk= 0, nxpk= 0, iat= 423, 461, r1= 3.00, r2= 3.50, r3= 4.90, r4= 5.40,  &end
#
# 7	DT	H1'	7	DT	H3'	3.11	4.51
 &rst
  ixpk= 0, nxpk= 0, iat= 200, 216, r1= 2.61, r2= 3.11, r3= 4.51, r4= 5.01,  &end
#
# 24	DG	H1'	24	DG	H3'	3.17	4.57
 &rst
  ixpk= 0, nxpk= 0, iat= 744, 761, r1= 2.67, r2= 3.17, r3= 4.57, r4= 5.07,  &end
#
# 22	8OG	H2'	23	DC	H6	3.18	4.58
 &rst
  ixpk= 0, nxpk= 0, iat= 700, 717, r1= 2.68, r2= 3.18, r3= 4.58, r4= 5.08,  &end
#
# 14	DG	H2''	14	DG	H3'	2.43	3.43
 &rst
  ixpk= 0, nxpk= 0, iat= 443, 440, r1= 1.93, r2= 2.43, r3= 3.43, r4= 3.93,  &end
#
# 16	DG	H8	17	DA	H8	3.99	5.39
 &rst
  ixpk= 0, nxpk= 0, iat= 489, 522, r1= 3.49, r2= 3.99, r3= 5.39, r4= 5.89,  &end
#
# 8	DT	H6	9	DMC	H6	3.60	5.00
 &rst
  ixpk= 0, nxpk= 0, iat= 235, 281, r1= 3.10, r2= 3.60, r3= 5.00, r4= 5.50,  &end
#
# 1	DC	H1'	1	DC	H2'	2.86	4.26
 &rst
  ixpk= 0, nxpk= 0, iat=  10,  26, r1= 2.36, r2= 2.86, r3= 4.26, r4= 4.76,  &end
#
# 14	DG	H8	15	DC	H6	3.77	5.17
 &rst
  ixpk= 0, nxpk= 0, iat= 426, 459, r1= 3.27, r2= 3.77, r3= 5.17, r4= 5.67,  &end
#
# 16	DG	H2'	16	DG	H3'	2.32	3.32
 &rst
  ixpk= 0, nxpk= 0, iat= 505, 503, r1= 1.82, r2= 2.32, r3= 3.32, r4= 3.82,  &end
#
# 22	8OG	H1'	23	DC	H6	2.98	4.38
 &rst
  ixpk= 0, nxpk= 0, iat= 680, 717, r1= 2.48, r2= 2.98, r3= 4.38, r4= 4.88,  &end
#
# 2	DG	H2''	2	DG	H3'	2.43	3.43
 &rst
  ixpk= 0, nxpk= 0, iat=  60,  57, r1= 1.93, r2= 2.43, r3= 3.43, r4= 3.93,  &end
#
# 4	DG	H8	5	DA	H8	3.99	5.39
 &rst
  ixpk= 0, nxpk= 0, iat= 106, 139, r1= 3.49, r2= 3.99, r3= 5.39, r4= 5.89,  &end
#
# 3	DC	H2'	3	DC	H5	3.16	4.56
 &rst
  ixpk= 0, nxpk= 0, iat=  89,  78, r1= 2.66, r2= 3.16, r3= 4.56, r4= 5.06,  &end
#
# 1	DC	H2''	1	DC	H3'	2.75	4.15
 &rst
  ixpk= 0, nxpk= 0, iat=  27,  24, r1= 2.25, r2= 2.75, r3= 4.15, r4= 4.65,  &end
#
# 13	DC	H1'	13	DC	H2'	2.86	4.26
 &rst
  ixpk= 0, nxpk= 0, iat= 393, 409, r1= 2.36, r2= 2.86, r3= 4.26, r4= 4.76,  &end
#
# 10   8OG    H1    15    DC    N3    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 307, 466, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, 
      rk2=32.0, rk3=32.0, ir6=1, ialtd=0,
 &end
#
# 10   8OG    H21    15    DC    O2    1.7    2
 &rst
  ixpk= 0, nxpk= 0, iat= 310, 468, r1= 1.20, r2= 1.70, r3= 2.00, r4= 2.50,  &end
#
# 10   8OG    N1    15    DC    N3    2.8    3
 &rst
  ixpk= 0, nxpk= 0, iat= 306, 466, r1= 2.30, r2= 2.80, r3= 3.00, r4= 3.50,  &end
#
# 10   8OG    N2    15    DC    O2    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 309, 468, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 10   8OG    O6    15    DC    H41    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 464, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 10   8OG    O6    15    DC    N4    2.8    3
 &rst
  ixpk= 0, nxpk= 0, iat= 305, 463, r1= 2.30, r2= 2.80, r3= 3.00, r4= 3.50,  &end
#
# 11    DC    H41    14    DG    O6    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 339, 430, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 11    DC    N3    14    DG    H1    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 341, 432, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 11    DC    N3    14    DG    N1    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 341, 431, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 11    DC    N4    14    DG    O6    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 338, 430, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 11    DC    O2    14    DG    H21    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 343, 435, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 11    DC    O2    14    DG    N2    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 343, 434, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 12    DG    H1    13    DC    N3    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 370, 403, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 12    DG    H21    13    DC    O2    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 373, 405, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 12    DG    N1    13    DC    N3    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 369, 403, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 12    DG    N2    13    DC    O2    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 372, 405, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 12    DG    O6    13    DC    H41    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 368, 401, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 12    DG    O6    13    DC    N4    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 368, 400, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 1    DC    H41    24    DG    O6    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat=  18, 751, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 1    DC    N3    24    DG    H1    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat=  20, 753, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 1    DC    N3    24    DG    N1    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat=  20, 752, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 1    DC    N4    24    DG    O6    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat=  17, 751, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 1    DC    O2    24    DG    H21    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat=  22, 756, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 1    DC    O2    24    DG    N2    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat=  22, 755, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 2    DG    H1    23    DC    N3    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat=  49, 724, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 2    DG    H21    23    DC    O2    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat=  52, 726, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 2    DG    N1    23    DC    N3    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat=  48, 724, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 2    DG    N2    23    DC    O2    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat=  51, 726, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 2    DG    O6    23    DC    H41    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat=  47, 722, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 2    DG    O6    23    DC    N4    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat=  47, 721, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 3    DC    H41    22   8OG    O6    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat=  81, 688, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 3    DC    N3    22   8OG    H1    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat=  83, 690, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 3    DC    N3    22   8OG    N1    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat=  83, 689, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 3    DC    N4    22   8OG    O6    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat=  80, 688, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 3    DC    O2    22   8OG    H21    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat=  85, 693, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 3    DC    O2    22   8OG    N2    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat=  85, 692, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 4    DG     O6    21    DMC    H41    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 110, 659, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 4    DG     O6    21    DMC    N4    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 110, 658, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 4    DG     H1    21    DMC    N3    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 112, 656, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 4    DG     H21    21    DMC    O2    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 115, 655, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 4    DG     N1    21    DMC    N3    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 111, 656, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 4    DG     N2    21    DMC    O2    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 114, 655, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 5    DA    H61    20    DT    O4    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 144, 625, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 5    DA    N1    20    DT    H3    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 627, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 5    DA    N1    20    DT    N3    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 146, 626, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 5    DA    N6    20    DT    O4    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 143, 625, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 6    DA    H61    19    DT    O4    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 176, 593, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 6    DA    N1    19    DT    H3    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 178, 595, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 6    DA    N1    19    DT    N3    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 178, 594, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 6    DA    N6    19    DT    O4    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 175, 593, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 7    DT    H3    18    DA    N1    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 212, 561, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 7    DT    N3    18    DA    N1    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 211, 561, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 7    DT    O4    18    DA    H61    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 210, 559, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 7    DT    O4    18    DA    N6    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 210, 558, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 8    DT    H3    17    DA    N1    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 244, 529, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 8    DT    N3    17    DA    N1    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 243, 529, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 8    DT    O4    17    DA    H61    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 527, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 8    DT    O4    17    DA    N6    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 242, 526, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 9    DMC    H41    16    DG     O6    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 276, 493, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 9    DMC    N3    16    DG     H1    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 495, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 9    DMC    N3    16    DG     N1    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 273, 494, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 9    DMC    N4    16    DG     O6    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 275, 493, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end
#
# 9    DMC    O2    16    DG     H21    1.8    2
 &rst
  ixpk= 0, nxpk= 0, iat= 272, 498, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 9    DMC    O2    16    DG     N2    2.7    3
 &rst
  ixpk= 0, nxpk= 0, iat= 272, 497, r1= 2.20, r2= 2.70, r3= 3.00, r4= 3.50,  &end


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