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
492792 2o80 cing 1-original 5 AMBER stereochemistry chirality


#
#  chirality for residue 1 atoms:  C2' O4' N1 H1'
 &rst iat=25,8,11,10, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 10., rk3=10.,  &end
#
#  chirality for residue 1 atoms:  C3' C1' H2'1 H2'2
 &rst iat=23,9,26,27, &end
#
#  chirality for residue 1 atoms:  O3' C2' C4' H3'
 &rst iat=28,25,6,24, &end
#
#  chirality for residue 1 atoms:  C3' C5' O4' H4'
 &rst iat=23,3,8,7, &end
#
#  chirality for residue 1 atoms:  C4' O5' H5'1 H5'2
 &rst iat=6,2,4,5, &end
#
#  chirality for residue 2 atoms:  C2' O4' N1 H1'
 &rst iat=55,38,41,40, &end
#
#  chirality for residue 2 atoms:  C3' C1' H2'1 H2'2
 &rst iat=53,39,56,57, &end
#
#  chirality for residue 2 atoms:  O3' C2' C4' H3'
 &rst iat=58,55,36,54, &end
#
#  chirality for residue 2 atoms:  C3' C5' O4' H4'
 &rst iat=53,33,38,37, &end
#
#  chirality for residue 2 atoms:  C4' O5' H5'1 H5'2
 &rst iat=36,32,34,35, &end
#
#  chirality for residue 3 atoms:  C2' O4' N9 H1'
 &rst iat=87,68,71,70, &end
#
#  chirality for residue 3 atoms:  C3' C1' H2'1 H2'2
 &rst iat=85,69,88,89, &end
#
#  chirality for residue 3 atoms:  O3' C2' C4' H3'
 &rst iat=90,87,66,86, &end
#
#  chirality for residue 3 atoms:  C3' C5' O4' H4'
 &rst iat=85,63,68,67, &end
#
#  chirality for residue 3 atoms:  C4' O5' H5'1 H5'2
 &rst iat=66,62,64,65, &end
#
#  chirality for residue 4 atoms:  C2' O4' N9 H1'
 &rst iat=119,100,103,102, &end
#
#  chirality for residue 4 atoms:  C3' C1' H2'1 H2'2
 &rst iat=117,101,120,121, &end
#
#  chirality for residue 4 atoms:  O3' C2' C4' H3'
 &rst iat=122,119,98,118, &end
#
#  chirality for residue 4 atoms:  C3' C5' O4' H4'
 &rst iat=117,95,100,99, &end
#
#  chirality for residue 4 atoms:  C4' O5' H5'1 H5'2
 &rst iat=98,94,96,97, &end
#
#  chirality for residue 5 atoms:  C2' O4' N9 H1'
 &rst iat=151,132,135,134, &end
#
#  chirality for residue 5 atoms:  C3' C1' H2'1 H2'2
 &rst iat=149,133,152,153, &end
#
#  chirality for residue 5 atoms:  O3' C2' C4' H3'
 &rst iat=154,151,130,150, &end
#
#  chirality for residue 5 atoms:  C3' C5' O4' H4'
 &rst iat=149,127,132,131, &end
#
#  chirality for residue 5 atoms:  C4' O5' H5'1 H5'2
 &rst iat=130,126,128,129, &end
#
#  chirality for residue 6 atoms:  C2' O4' N9 H1'
 &rst iat=184,164,167,166, &end
#
#  chirality for residue 6 atoms:  C3' C1' H2'1 H2'2
 &rst iat=182,165,185,186, &end
#
#  chirality for residue 6 atoms:  O3' C2' C4' H3'
 &rst iat=187,184,162,183, &end
#
#  chirality for residue 6 atoms:  C3' C5' O4' H4'
 &rst iat=182,159,164,163, &end
#
#  chirality for residue 6 atoms:  C4' O5' H5'1 H5'2
 &rst iat=162,158,160,161, &end
#
#  chirality for residue 8 atoms:  C2' O4' N9 H1'
 &rst iat=236,217,220,219, &end
#
#  chirality for residue 8 atoms:  C3' C1' H2'1 H2'2
 &rst iat=234,218,237,238, &end
#
#  chirality for residue 8 atoms:  O3' C2' C4' H3'
 &rst iat=239,236,215,235, &end
#
#  chirality for residue 8 atoms:  C3' C5' O4' H4'
 &rst iat=234,212,217,216, &end
#
#  chirality for residue 8 atoms:  C4' O5' H5'1 H5'2
 &rst iat=215,211,213,214, &end
#
#  chirality for residue 9 atoms:  C2' O4' N1 H1'
 &rst iat=266,249,252,251, &end
#
#  chirality for residue 9 atoms:  C3' C1' H2'1 H2'2
 &rst iat=264,250,267,268, &end
#
#  chirality for residue 9 atoms:  O3' C2' C4' H3'
 &rst iat=269,266,247,265, &end
#
#  chirality for residue 9 atoms:  C3' C5' O4' H4'
 &rst iat=264,244,249,248, &end
#
#  chirality for residue 9 atoms:  C4' O5' H5'1 H5'2
 &rst iat=247,243,245,246, &end
#
#  chirality for residue 10 atoms:  C2' O4' N1 H1'
 &rst iat=296,279,282,281, &end
#
#  chirality for residue 10 atoms:  C3' C1' H2'1 H2'2
 &rst iat=294,280,297,298, &end
#
#  chirality for residue 10 atoms:  O3' C2' C4' H3'
 &rst iat=299,296,277,295, &end
#
#  chirality for residue 10 atoms:  C3' C5' O4' H4'
 &rst iat=294,274,279,278, &end
#
#  chirality for residue 10 atoms:  C4' O5' H5'1 H5'2
 &rst iat=277,273,275,276, &end
#
#  chirality for residue 11 atoms:  C2' O4' N9 H1'
 &rst iat=329,309,312,311, &end
#
#  chirality for residue 11 atoms:  C3' C1' H2'1 H2'2
 &rst iat=327,310,330,331, &end
#
#  chirality for residue 11 atoms:  O3' C2' C4' H3'
 &rst iat=332,329,307,328, &end
#
#  chirality for residue 11 atoms:  C3' C5' O4' H4'
 &rst iat=327,304,309,308, &end
#
#  chirality for residue 11 atoms:  C4' O5' H5'1 H5'2
 &rst iat=307,303,305,306, &end
#
#  chirality for residue 12 atoms:  C2' O4' N9 H1'
 &rst iat=362,342,345,344, &end
#
#  chirality for residue 12 atoms:  C3' C1' H2'1 H2'2
 &rst iat=360,343,363,364, &end
#
#  chirality for residue 12 atoms:  O3' C2' C4' H3'
 &rst iat=365,362,340,361, &end
#
#  chirality for residue 12 atoms:  C3' C5' O4' H4'
 &rst iat=360,337,342,341, &end
#
#  chirality for residue 12 atoms:  C4' O5' H5'1 H5'2
 &rst iat=340,336,338,339, &end
#
#  chirality for residue 13 atoms:  C2' O4' N9 H1'
 &rst iat=395,375,378,377, &end
#
#  chirality for residue 13 atoms:  C3' C1' H2'1 H2'2
 &rst iat=393,376,396,397, &end
#
#  chirality for residue 13 atoms:  O3' C2' C4' H3'
 &rst iat=398,395,373,394, &end
#
#  chirality for residue 13 atoms:  C3' C5' O4' H4'
 &rst iat=393,370,375,374, &end
#
#  chirality for residue 13 atoms:  C4' O5' H5'1 H5'2
 &rst iat=373,369,371,372, &end
#
#  chirality for residue 14 atoms:  C2' O4' N1 H1'
 &rst iat=424,407,410,409, &end
#
#  chirality for residue 14 atoms:  C3' C1' H2'1 H2'2
 &rst iat=422,408,425,426, &end
#
#  chirality for residue 14 atoms:  O3' C2' C4' H3'
 &rst iat=427,424,405,423, &end
#
#  chirality for residue 14 atoms:  C3' C5' O4' H4'
 &rst iat=422,402,407,406, &end
#
#  chirality for residue 14 atoms:  C4' O5' H5'1 H5'2
 &rst iat=405,401,403,404, &end
#
#  chirality for residue 15 atoms:  C2' O4' N1 H1'
 &rst iat=454,437,440,439, &end
#
#  chirality for residue 15 atoms:  C3' C1' H2'1 H2'2
 &rst iat=452,438,455,456, &end
#
#  chirality for residue 15 atoms:  O3' C2' C4' H3'
 &rst iat=457,454,435,453, &end
#
#  chirality for residue 15 atoms:  C3' C5' O4' H4'
 &rst iat=452,432,437,436, &end
#
#  chirality for residue 15 atoms:  C4' O5' H5'1 H5'2
 &rst iat=435,431,433,434, &end
#
#  chirality for residue 16 atoms:  C2' O4' N1 H1'
 &rst iat=484,467,470,469, &end
#
#  chirality for residue 16 atoms:  C3' C1' H2'1 H2'2
 &rst iat=482,468,485,486, &end
#
#  chirality for residue 16 atoms:  O3' C2' C4' H3'
 &rst iat=487,484,465,483, &end
#
#  chirality for residue 16 atoms:  C3' C5' O4' H4'
 &rst iat=482,462,467,466, &end
#
#  chirality for residue 16 atoms:  C4' O5' H5'1 H5'2
 &rst iat=465,461,463,464, &end
#
#  chirality for residue 17 atoms:  C2' O4' N9 H1'
 &rst iat=517,497,500,499, &end
#
#  chirality for residue 17 atoms:  C3' C1' H2'1 H2'2
 &rst iat=515,498,518,519, &end
#
#  chirality for residue 17 atoms:  O3' C2' C4' H3'
 &rst iat=520,517,495,516, &end
#
#  chirality for residue 17 atoms:  C3' C5' O4' H4'
 &rst iat=515,492,497,496, &end
#
#  chirality for residue 17 atoms:  C4' O5' H5'1 H5'2
 &rst iat=495,491,493,494, &end
#
#  chirality for residue 18 atoms:  C2' O4' N9 H1'
 &rst iat=550,530,533,532, &end
#
#  chirality for residue 18 atoms:  C3' C1' H2'1 H2'2
 &rst iat=548,531,551,552, &end
#
#  chirality for residue 18 atoms:  O3' C2' C4' H3'
 &rst iat=553,550,528,549, &end
#
#  chirality for residue 18 atoms:  C3' C5' O4' H4'
 &rst iat=548,525,530,529, &end
#
#  chirality for residue 18 atoms:  C4' O5' H5'1 H5'2
 &rst iat=528,524,526,527, &end
#
#  chirality for residue 19 atoms:  C2' O4' N1 H1'
 &rst iat=582,563,566,565, &end
#
#  chirality for residue 19 atoms:  C3' C1' H2'1 H2'2
 &rst iat=580,564,583,584, &end
#
#  chirality for residue 19 atoms:  O3' C2' C4' H3'
 &rst iat=585,582,561,581, &end
#
#  chirality for residue 19 atoms:  C3' C5' O4' H4'
 &rst iat=580,558,563,562, &end
#
#  chirality for residue 19 atoms:  C4' O5' H5'1 H5'2
 &rst iat=561,557,559,560, &end
#
#  chirality for residue 20 atoms:  C2' O4' N1 H1'
 &rst iat=612,595,598,597, &end
#
#  chirality for residue 20 atoms:  C3' C1' H2'1 H2'2
 &rst iat=610,596,613,614, &end
#
#  chirality for residue 20 atoms:  O3' C2' C4' H3'
 &rst iat=615,612,593,611, &end
#
#  chirality for residue 20 atoms:  C3' C5' O4' H4'
 &rst iat=610,590,595,594, &end
#
#  chirality for residue 20 atoms:  C4' O5' H5'1 H5'2
 &rst iat=593,589,591,592, &end
#
#  chirality for residue 21 atoms:  C2' O4' N1 H1'
 &rst iat=642,625,628,627, &end
#
#  chirality for residue 21 atoms:  C3' C1' H2'1 H2'2
 &rst iat=640,626,643,644, &end
#
#  chirality for residue 21 atoms:  O3' C2' C4' H3'
 &rst iat=645,642,623,641, &end
#
#  chirality for residue 21 atoms:  C3' C5' O4' H4'
 &rst iat=640,620,625,624, &end
#
#  chirality for residue 21 atoms:  C4' O5' H5'1 H5'2
 &rst iat=623,619,621,622, &end
#
#  chirality for residue 22 atoms:  C2' O4' N1 H1'
 &rst iat=674,655,658,657, &end
#
#  chirality for residue 22 atoms:  C3' C1' H2'1 H2'2
 &rst iat=672,656,675,676, &end
#
#  chirality for residue 22 atoms:  O3' C2' C4' H3'
 &rst iat=677,674,653,673, &end
#
#  chirality for residue 22 atoms:  C3' C5' O4' H4'
 &rst iat=672,650,655,654, &end
#
#  chirality for residue 22 atoms:  C4' O5' H5'1 H5'2
 &rst iat=653,649,651,652, &end
#
#  chirality for residue 23 atoms:  C2' O4' N1 H1'
 &rst iat=706,687,690,689, &end
#
#  chirality for residue 23 atoms:  C3' C1' H2'1 H2'2
 &rst iat=704,688,707,708, &end
#
#  chirality for residue 23 atoms:  O3' C2' C4' H3'
 &rst iat=709,706,685,705, &end
#
#  chirality for residue 23 atoms:  C3' C5' O4' H4'
 &rst iat=704,682,687,686, &end
#
#  chirality for residue 23 atoms:  C4' O5' H5'1 H5'2
 &rst iat=685,681,683,684, &end
#
#  chirality for residue 24 atoms:  C2' O4' N1 H1'
 &rst iat=738,719,722,721, &end
#
#  chirality for residue 24 atoms:  C3' C1' H2'1 H2'2
 &rst iat=736,720,739,740, &end
#
#  chirality for residue 24 atoms:  O3' C2' C4' H3'
 &rst iat=741,738,717,737, &end
#
#  chirality for residue 24 atoms:  C3' C5' O4' H4'
 &rst iat=736,714,719,718, &end
#
#  chirality for residue 24 atoms:  C4' O5' H5'1 H5'2
 &rst iat=717,713,715,716, &end
#
#  chirality for residue 25 atoms:  C2' O4' N9 H1'
 &rst iat=771,751,754,753, &end
#
#  chirality for residue 25 atoms:  C3' C1' H2'1 H2'2
 &rst iat=769,752,772,773, &end
#
#  chirality for residue 25 atoms:  O3' C2' C4' H3'
 &rst iat=774,771,749,770, &end
#
#  chirality for residue 25 atoms:  C3' C5' O4' H4'
 &rst iat=769,746,751,750, &end
#
#  chirality for residue 25 atoms:  C4' O5' H5'1 H5'2
 &rst iat=749,745,747,748, &end
#
#  chirality for residue 26 atoms:  C2' O4' N9 H1'
 &rst iat=804,784,787,786, &end
#
#  chirality for residue 26 atoms:  C3' C1' H2'1 H2'2
 &rst iat=802,785,805,806, &end
#
#  chirality for residue 26 atoms:  O3' C2' C4' H3'
 &rst iat=807,804,782,803, &end
#
#  chirality for residue 26 atoms:  C3' C5' O4' H4'
 &rst iat=802,779,784,783, &end
#
#  chirality for residue 26 atoms:  C4' O5' H5'1 H5'2
 &rst iat=782,778,780,781, &end



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