NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
|
|
492182 |
2k4g   |
cing | 1-original | 1 | AMBER | distance | NOE | simple |
#
# 3 GPN H1 18 CPN H4 3.10 3.50
&rst
ixpk= 0, nxpk= 0, iat= 63, -1, r1= 2.60, r2= 3.10, r3= 3.93, r4= 4.43,
rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
igr2= 500, 501,
&end
#
# 3 GPN H1 17 GPN H1 4.19 4.59
&rst
ixpk= 0, nxpk= 0, iat= 63, 467, r1= 3.69, r2= 4.19, r3= 4.59, r4= 5.09, &end
#
# 4 CPN H1' 4 CPN H6 3.83 4.23
&rst
ixpk= 0, nxpk= 0, iat= 76, 91, r1= 3.33, r2= 3.83, r3= 4.23, r4= 4.73, &end
#
# 5 APN H1' 5 APN H8 3.89 4.29
&rst
ixpk= 0, nxpk= 0, iat= 107, 122, r1= 3.39, r2= 3.89, r3= 4.29, r4= 4.79, &end
#
# 5 APN H8 4 CPN H6 4.48 4.88
&rst
ixpk= 0, nxpk= 0, iat= 122, 91, r1= 3.98, r2= 4.48, r3= 4.88, r4= 5.38, &end
#
# 5 APN H8 6 TPN H6 4.82 5.22
&rst
ixpk= 0, nxpk= 0, iat= 122, 155, r1= 4.32, r2= 4.82, r3= 5.22, r4= 5.72, &end
#
# 5 APN H2 6 TPN H6 4.30 4.70
&rst
ixpk= 0, nxpk= 0, iat= 131, 155, r1= 3.80, r2= 4.30, r3= 4.70, r4= 5.20, &end
#
# 6 TPN H7 6 TPN H6 2.80 3.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 155, r1= 2.30, r2= 2.80, r3= 3.84, r4= 4.34,
igr1= 158, 159, 160,
&end
#
# 6 TPN H3 15 APN H2 2.84 3.24
&rst
ixpk= 0, nxpk= 0, iat= 164, 404, r1= 2.34, r2= 2.84, r3= 3.24, r4= 3.74, &end
#
# 6 TPN H3 5 APN H2 2.84 3.24
&rst
ixpk= 0, nxpk= 0, iat= 164, 131, r1= 2.34, r2= 2.84, r3= 3.24, r4= 3.74, &end
#
# 6 TPN H7 5 APN H8 3.47 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 122, r1= 2.97, r2= 3.47, r3= 4.65, r4= 5.15,
igr1= 158, 159, 160,
&end
#
# 6 TPN H7 5 APN H2 3.76 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 131, r1= 3.26, r2= 3.76, r3= 5.00, r4= 5.50,
igr1= 158, 159, 160,
&end
#
# 6 TPN H7 7 GPN H8 3.81 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 188, r1= 3.31, r2= 3.81, r3= 5.06, r4= 5.56,
igr1= 158, 159, 160,
&end
#
# 6 TPN H1' 6 TPN H6 4.32 4.72
&rst
ixpk= 0, nxpk= 0, iat= 140, 155, r1= 3.82, r2= 4.32, r3= 4.72, r4= 5.22, &end
#
# 7 GPN H1 14 CPN H4 3.13 3.53
&rst
ixpk= 0, nxpk= 0, iat= 194, -1, r1= 2.63, r2= 3.13, r3= 3.96, r4= 4.46,
igr2= 369, 370,
&end
#
# 7 GPN H8 6 TPN H6 4.36 4.76
&rst
ixpk= 0, nxpk= 0, iat= 188, 155, r1= 3.86, r2= 4.36, r3= 4.76, r4= 5.26, &end
#
# 7 GPN H1' 7 GPN H8 4.79 5.19
&rst
ixpk= 0, nxpk= 0, iat= 173, 188, r1= 4.29, r2= 4.79, r3= 5.19, r4= 5.69, &end
#
# 8 CPN H1' 8 CPN H6 4.15 4.55
&rst
ixpk= 0, nxpk= 0, iat= 207, 222, r1= 3.65, r2= 4.15, r3= 4.55, r4= 5.05, &end
#
# 13 GPN H1 8 CPN H4 3.10 3.50
&rst
ixpk= 0, nxpk= 0, iat= 336, -1, r1= 2.60, r2= 3.10, r3= 3.93, r4= 4.43,
igr2= 227, 228,
&end
#
# 13 GPN H1 7 GPN H1 4.19 4.59
&rst
ixpk= 0, nxpk= 0, iat= 336, 194, r1= 3.69, r2= 4.19, r3= 4.59, r4= 5.09, &end
#
# 14 CPN H1' 14 CPN H6 3.83 4.23
&rst
ixpk= 0, nxpk= 0, iat= 349, 364, r1= 3.33, r2= 3.83, r3= 4.23, r4= 4.73, &end
#
# 15 APN H1' 15 APN H8 3.89 4.29
&rst
ixpk= 0, nxpk= 0, iat= 380, 395, r1= 3.39, r2= 3.89, r3= 4.29, r4= 4.79, &end
#
# 15 APN H8 14 CPN H6 4.48 4.88
&rst
ixpk= 0, nxpk= 0, iat= 395, 364, r1= 3.98, r2= 4.48, r3= 4.88, r4= 5.38, &end
#
# 15 APN H8 16 TPN H6 4.82 5.22
&rst
ixpk= 0, nxpk= 0, iat= 395, 428, r1= 4.32, r2= 4.82, r3= 5.22, r4= 5.72, &end
#
# 15 APN H2 16 TPN H6 4.30 4.70
&rst
ixpk= 0, nxpk= 0, iat= 404, 428, r1= 3.80, r2= 4.30, r3= 4.70, r4= 5.20, &end
#
# 16 TPN H7 16 TPN H6 2.80 3.20
&rst
ixpk= 0, nxpk= 0, iat= -1, 428, r1= 2.30, r2= 2.80, r3= 3.84, r4= 4.34,
igr1= 431, 432, 433,
&end
#
# 16 TPN H3 5 APN H2 2.84 3.24
&rst
ixpk= 0, nxpk= 0, iat= 437, 131, r1= 2.34, r2= 2.84, r3= 3.24, r4= 3.74, &end
#
# 16 TPN H3 15 APN H2 2.84 3.24
&rst
ixpk= 0, nxpk= 0, iat= 437, 404, r1= 2.34, r2= 2.84, r3= 3.24, r4= 3.74, &end
#
# 16 TPN H7 15 APN H8 3.47 3.87
&rst
ixpk= 0, nxpk= 0, iat= -1, 395, r1= 2.97, r2= 3.47, r3= 4.65, r4= 5.15,
igr1= 431, 432, 433,
&end
#
# 16 TPN H7 15 APN H2 3.76 4.16
&rst
ixpk= 0, nxpk= 0, iat= -1, 404, r1= 3.26, r2= 3.76, r3= 5.00, r4= 5.50,
igr1= 431, 432, 433,
&end
#
# 16 TPN H7 17 GPN H8 3.81 4.21
&rst
ixpk= 0, nxpk= 0, iat= -1, 461, r1= 3.31, r2= 3.81, r3= 5.06, r4= 5.56,
igr1= 431, 432, 433,
&end
#
# 16 TPN H1' 16 TPN H6 4.32 4.72
&rst
ixpk= 0, nxpk= 0, iat= 413, 428, r1= 3.82, r2= 4.32, r3= 4.72, r4= 5.22, &end
#
# 17 GPN H1 4 CPN H4 3.13 3.53
&rst
ixpk= 0, nxpk= 0, iat= 467, -1, r1= 2.63, r2= 3.13, r3= 3.96, r4= 4.46,
igr2= 96, 97,
&end
#
# 17 GPN H8 16 TPN H6 4.36 4.76
&rst
ixpk= 0, nxpk= 0, iat= 461, 428, r1= 3.86, r2= 4.36, r3= 4.76, r4= 5.26, &end
#
# 17 GPN H1' 17 GPN H8 4.79 5.19
&rst
ixpk= 0, nxpk= 0, iat= 446, 461, r1= 4.29, r2= 4.79, r3= 5.19, r4= 5.69, &end
#
# 18 CPN H1' 18 CPN H6 4.15 4.55
&rst
ixpk= 0, nxpk= 0, iat= 480, 495, r1= 3.65, r2= 4.15, r3= 4.55, r4= 5.05, &end
#
# 2 GPN H1 19 CPN N3 1.84 2.04
&rst
ixpk= 0, nxpk= 0, iat= 29, 533, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54,
rk2=20.0, rk3=20.0, ir6=1, ialtd=0,
&end
#
# 2 GPN H22 19 CPN O2 1.75 1.95
&rst
ixpk= 0, nxpk= 0, iat= 33, 535, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45, &end
#
# 2 GPN N1 19 CPN N3 2.85 3.05
&rst
ixpk= 0, nxpk= 0, iat= 28, 533, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55, &end
#
# 2 GPN O6 19 CPN H42 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat= 27, 532, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 2 GPN O6 19 CPN N4 2.81 3.01
&rst
ixpk= 0, nxpk= 0, iat= 27, 530, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51, &end
#
# 3 GPN H1 18 CPN N3 1.84 2.04
&rst
ixpk= 0, nxpk= 0, iat= 63, 502, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54, &end
#
# 3 GPN H22 18 CPN O2 1.75 1.95
&rst
ixpk= 0, nxpk= 0, iat= 67, 504, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45, &end
#
# 3 GPN N1 18 CPN N3 2.85 3.05
&rst
ixpk= 0, nxpk= 0, iat= 62, 502, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55, &end
#
# 3 GPN O6 18 CPN H42 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat= 61, 501, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 3 GPN O6 18 CPN N4 2.81 3.01
&rst
ixpk= 0, nxpk= 0, iat= 61, 499, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51, &end
#
# 4 CPN H42 17 GPN O6 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat= 97, 465, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 4 CPN N3 17 GPN H1 1.84 2.04
&rst
ixpk= 0, nxpk= 0, iat= 98, 467, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54, &end
#
# 4 CPN N3 17 GPN N1 2.85 3.05
&rst
ixpk= 0, nxpk= 0, iat= 98, 466, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55, &end
#
# 4 CPN N4 17 GPN O6 2.81 3.01
&rst
ixpk= 0, nxpk= 0, iat= 95, 465, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51, &end
#
# 4 CPN O2 17 GPN H22 1.75 1.95
&rst
ixpk= 0, nxpk= 0, iat= 100, 471, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45, &end
#
# 5 APN H61 16 TPN O4 1.84 2.04
&rst
ixpk= 0, nxpk= 0, iat= 127, 435, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54, &end
#
# 5 APN N1 16 TPN H3 1.71 1.91
&rst
ixpk= 0, nxpk= 0, iat= 129, 437, r1= 1.21, r2= 1.71, r3= 1.91, r4= 2.41, &end
#
# 5 APN N1 16 TPN N3 2.72 2.92
&rst
ixpk= 0, nxpk= 0, iat= 129, 436, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42, &end
#
# 6 TPN H3 15 APN N1 1.71 1.91
&rst
ixpk= 0, nxpk= 0, iat= 164, 402, r1= 1.21, r2= 1.71, r3= 1.91, r4= 2.41, &end
#
# 6 TPN N3 15 APN N1 2.72 2.92
&rst
ixpk= 0, nxpk= 0, iat= 163, 402, r1= 2.22, r2= 2.72, r3= 2.92, r4= 3.42, &end
#
# 6 TPN O4 15 APN H61 1.84 2.04
&rst
ixpk= 0, nxpk= 0, iat= 162, 400, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54, &end
#
# 7 GPN H1 14 CPN N3 1.84 2.04
&rst
ixpk= 0, nxpk= 0, iat= 194, 371, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54, &end
#
# 7 GPN H22 14 CPN O2 1.75 1.95
&rst
ixpk= 0, nxpk= 0, iat= 198, 373, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45, &end
#
# 7 GPN N1 14 CPN N3 2.85 3.05
&rst
ixpk= 0, nxpk= 0, iat= 193, 371, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55, &end
#
# 7 GPN O6 14 CPN H42 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat= 192, 370, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 7 GPN O6 14 CPN N4 2.81 3.01
&rst
ixpk= 0, nxpk= 0, iat= 192, 368, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51, &end
#
# 8 CPN H42 13 GPN O6 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat= 228, 334, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 8 CPN N3 13 GPN H1 1.84 2.04
&rst
ixpk= 0, nxpk= 0, iat= 229, 336, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54, &end
#
# 8 CPN N3 13 GPN N1 2.85 3.05
&rst
ixpk= 0, nxpk= 0, iat= 229, 335, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55, &end
#
# 8 CPN N4 13 GPN O6 2.81 3.01
&rst
ixpk= 0, nxpk= 0, iat= 226, 334, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51, &end
#
# 8 CPN O2 13 GPN H22 1.75 1.95
&rst
ixpk= 0, nxpk= 0, iat= 231, 340, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45, &end
#
# 9 CPN H42 12 GPN O6 1.80 2.00
&rst
ixpk= 0, nxpk= 0, iat= 259, 300, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, &end
#
# 9 CPN N3 12 GPN H1 1.84 2.04
&rst
ixpk= 0, nxpk= 0, iat= 260, 302, r1= 1.34, r2= 1.84, r3= 2.04, r4= 2.54, &end
#
# 9 CPN N3 12 GPN N1 2.85 3.05
&rst
ixpk= 0, nxpk= 0, iat= 260, 301, r1= 2.35, r2= 2.85, r3= 3.05, r4= 3.55, &end
#
# 9 CPN N4 12 GPN O6 2.81 3.01
&rst
ixpk= 0, nxpk= 0, iat= 257, 300, r1= 2.31, r2= 2.81, r3= 3.01, r4= 3.51, &end
#
# 9 CPN O2 12 GPN H22 1.75 1.95
&rst
ixpk= 0, nxpk= 0, iat= 262, 306, r1= 1.25, r2= 1.75, r3= 1.95, r4= 2.45, &end
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