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
15631 1yne cing 1-original 3 AMBER stereochemistry chirality



#
#  chirality for residue 1 atoms:  C2' O4' N9 H1'
 &rst iat=28,8,11,10, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 10., rk3=10.,  &end
#
#  chirality for residue 1 atoms:  C3' C1' H2'1 O2'
 &rst iat=26,9,29,30, &end
#
#  chirality for residue 1 atoms:  O3' C2' C4' H3'
 &rst iat=32,28,6,27, &end
#
#  chirality for residue 1 atoms:  C3' C5' O4' H4'
 &rst iat=26,3,8,7, &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' N9 H1'
 &rst iat=62,42,45,44, &end
#
#  chirality for residue 2 atoms:  C3' C1' H2'1 O2'
 &rst iat=60,43,63,64, &end
#
#  chirality for residue 2 atoms:  O3' C2' C4' H3'
 &rst iat=66,62,40,61, &end
#
#  chirality for residue 2 atoms:  C3' C5' O4' H4'
 &rst iat=60,37,42,41, &end
#
#  chirality for residue 2 atoms:  C4' O5' H5'1 H5'2
 &rst iat=40,36,38,39, &end
#
#  chirality for residue 3 atoms:  C2' O4' N9 H1'
 &rst iat=95,76,79,78, &end
#
#  chirality for residue 3 atoms:  C3' C1' H2'1 O2'
 &rst iat=93,77,96,97, &end
#
#  chirality for residue 3 atoms:  O3' C2' C4' H3'
 &rst iat=99,95,74,94, &end
#
#  chirality for residue 3 atoms:  C3' C5' O4' H4'
 &rst iat=93,71,76,75, &end
#
#  chirality for residue 3 atoms:  C4' O5' H5'1 H5'2
 &rst iat=74,70,72,73, &end
#
#  chirality for residue 4 atoms:  C2' O4' N1 H1'
 &rst iat=125,109,112,111, &end
#
#  chirality for residue 4 atoms:  C3' C1' H2'1 O2'
 &rst iat=123,110,126,127, &end
#
#  chirality for residue 4 atoms:  O3' C2' C4' H3'
 &rst iat=129,125,107,124, &end
#
#  chirality for residue 4 atoms:  C3' C5' O4' H4'
 &rst iat=123,104,109,108, &end
#
#  chirality for residue 4 atoms:  C4' O5' H5'1 H5'2
 &rst iat=107,103,105,106, &end
#
#  chirality for residue 5 atoms:  C2' O4' N9 H1'
 &rst iat=158,139,142,141, &end
#
#  chirality for residue 5 atoms:  C3' C1' H2'1 O2'
 &rst iat=156,140,159,160, &end
#
#  chirality for residue 5 atoms:  O3' C2' C4' H3'
 &rst iat=162,158,137,157, &end
#
#  chirality for residue 5 atoms:  C3' C5' O4' H4'
 &rst iat=156,134,139,138, &end
#
#  chirality for residue 5 atoms:  C4' O5' H5'1 H5'2
 &rst iat=137,133,135,136, &end
#
#  chirality for residue 6 atoms:  C2' O4' N1 H1'
 &rst iat=188,172,175,174, &end
#
#  chirality for residue 6 atoms:  C3' C1' H2'1 O2'
 &rst iat=186,173,189,190, &end
#
#  chirality for residue 6 atoms:  O3' C2' C4' H3'
 &rst iat=192,188,170,187, &end
#
#  chirality for residue 6 atoms:  C3' C5' O4' H4'
 &rst iat=186,167,172,171, &end
#
#  chirality for residue 6 atoms:  C4' O5' H5'1 H5'2
 &rst iat=170,166,168,169, &end
#
#  chirality for residue 7 atoms:  C2' O4' N9 H1'
 &rst iat=221,202,205,204, &end
#
#  chirality for residue 7 atoms:  C3' C1' H2'1 O2'
 &rst iat=219,203,222,223, &end
#
#  chirality for residue 7 atoms:  O3' C2' C4' H3'
 &rst iat=225,221,200,220, &end
#
#  chirality for residue 7 atoms:  C3' C5' O4' H4'
 &rst iat=219,197,202,201, &end
#
#  chirality for residue 7 atoms:  C4' O5' H5'1 H5'2
 &rst iat=200,196,198,199, &end
#
#  chirality for residue 8 atoms:  C2' O4' N1 H1'
 &rst iat=251,235,238,237, &end
#
#  chirality for residue 8 atoms:  C3' C1' H2'1 O2'
 &rst iat=249,236,252,253, &end
#
#  chirality for residue 8 atoms:  O3' C2' C4' H3'
 &rst iat=255,251,233,250, &end
#
#  chirality for residue 8 atoms:  C3' C5' O4' H4'
 &rst iat=249,230,235,234, &end
#
#  chirality for residue 8 atoms:  C4' O5' H5'1 H5'2
 &rst iat=233,229,231,232, &end
#
#  chirality for residue 9 atoms:  C2' O4' N9 H1'
 &rst iat=285,265,268,267, &end
#
#  chirality for residue 9 atoms:  C3' C1' H2'1 O2'
 &rst iat=283,266,286,287, &end
#
#  chirality for residue 9 atoms:  O3' C2' C4' H3'
 &rst iat=289,285,263,284, &end
#
#  chirality for residue 9 atoms:  C3' C5' O4' H4'
 &rst iat=283,260,265,264, &end
#
#  chirality for residue 9 atoms:  C4' O5' H5'1 H5'2
 &rst iat=263,259,261,262, &end
#
#  chirality for residue 10 atoms:  C2' O4' N9 H1'
 &rst iat=318,299,302,301, &end
#
#  chirality for residue 10 atoms:  C3' C1' H2'1 O2'
 &rst iat=316,300,319,320, &end
#
#  chirality for residue 10 atoms:  O3' C2' C4' H3'
 &rst iat=322,318,297,317, &end
#
#  chirality for residue 10 atoms:  C3' C5' O4' H4'
 &rst iat=316,294,299,298, &end
#
#  chirality for residue 10 atoms:  C4' O5' H5'1 H5'2
 &rst iat=297,293,295,296, &end
#
#  chirality for residue 11 atoms:  C2' O4' N1 H1'
 &rst iat=348,332,335,334, &end
#
#  chirality for residue 11 atoms:  C3' C1' H2'1 O2'
 &rst iat=346,333,349,350, &end
#
#  chirality for residue 11 atoms:  O3' C2' C4' H3'
 &rst iat=352,348,330,347, &end
#
#  chirality for residue 11 atoms:  C3' C5' O4' H4'
 &rst iat=346,327,332,331, &end
#
#  chirality for residue 11 atoms:  C4' O5' H5'1 H5'2
 &rst iat=330,326,328,329, &end
#
#  chirality for residue 12 atoms:  C2' O4' N9 H1'
 &rst iat=381,362,365,364, &end
#
#  chirality for residue 12 atoms:  C3' C1' H2'1 O2'
 &rst iat=379,363,382,383, &end
#
#  chirality for residue 12 atoms:  O3' C2' C4' H3'
 &rst iat=385,381,360,380, &end
#
#  chirality for residue 12 atoms:  C3' C5' O4' H4'
 &rst iat=379,357,362,361, &end
#
#  chirality for residue 12 atoms:  C4' O5' H5'1 H5'2
 &rst iat=360,356,358,359, &end
#
#  chirality for residue 13 atoms:  C2' O4' N1 H1'
 &rst iat=411,395,398,397, &end
#
#  chirality for residue 13 atoms:  C3' C1' H2'1 O2'
 &rst iat=409,396,412,413, &end
#
#  chirality for residue 13 atoms:  O3' C2' C4' H3'
 &rst iat=415,411,393,410, &end
#
#  chirality for residue 13 atoms:  C3' C5' O4' H4'
 &rst iat=409,390,395,394, &end
#
#  chirality for residue 13 atoms:  C4' O5' H5'1 H5'2
 &rst iat=393,389,391,392, &end
#
#  chirality for residue 14 atoms:  C2' O4' N9 H1'
 &rst iat=444,425,428,427, &end
#
#  chirality for residue 14 atoms:  C3' C1' H2'1 O2'
 &rst iat=442,426,445,446, &end
#
#  chirality for residue 14 atoms:  O3' C2' C4' H3'
 &rst iat=448,444,423,443, &end
#
#  chirality for residue 14 atoms:  C3' C5' O4' H4'
 &rst iat=442,420,425,424, &end
#
#  chirality for residue 14 atoms:  C4' O5' H5'1 H5'2
 &rst iat=423,419,421,422, &end
#
#  chirality for residue 15 atoms:  C2' O4' N9 H1'
 &rst iat=477,458,461,460, &end
#
#  chirality for residue 15 atoms:  C3' C1' H2'1 O2'
 &rst iat=475,459,478,479, &end
#
#  chirality for residue 15 atoms:  O3' C2' C4' H3'
 &rst iat=481,477,456,476, &end
#
#  chirality for residue 15 atoms:  C3' C5' O4' H4'
 &rst iat=475,453,458,457, &end
#
#  chirality for residue 15 atoms:  C4' O5' H5'1 H5'2
 &rst iat=456,452,454,455, &end
#
#  chirality for residue 16 atoms:  C2' O4' N1 H1'
 &rst iat=507,491,494,493, &end
#
#  chirality for residue 16 atoms:  C3' C1' H2'1 O2'
 &rst iat=505,492,508,509, &end
#
#  chirality for residue 16 atoms:  O3' C2' C4' H3'
 &rst iat=511,507,489,506, &end
#
#  chirality for residue 16 atoms:  C3' C5' O4' H4'
 &rst iat=505,486,491,490, &end
#
#  chirality for residue 16 atoms:  C4' O5' H5'1 H5'2
 &rst iat=489,485,487,488, &end
#
#  chirality for residue 17 atoms:  C2' O4' N1 H1'
 &rst iat=537,521,524,523, &end
#
#  chirality for residue 17 atoms:  C3' C1' H2'1 O2'
 &rst iat=535,522,538,539, &end
#
#  chirality for residue 17 atoms:  O3' C2' C4' H3'
 &rst iat=541,537,519,536, &end
#
#  chirality for residue 17 atoms:  C3' C5' O4' H4'
 &rst iat=535,516,521,520, &end
#
#  chirality for residue 17 atoms:  C4' O5' H5'1 H5'2
 &rst iat=519,515,517,518, &end
#
#  chirality for residue 18 atoms:  C2' O4' N1 H1'
 &rst iat=567,551,554,553, &end
#
#  chirality for residue 18 atoms:  C3' C1' H2'1 O2'
 &rst iat=565,552,568,569, &end
#
#  chirality for residue 18 atoms:  O3' C2' C4' H3'
 &rst iat=571,567,549,566, &end
#
#  chirality for residue 18 atoms:  C3' C5' O4' H4'
 &rst iat=565,546,551,550, &end
#
#  chirality for residue 18 atoms:  C4' O5' H5'1 H5'2
 &rst iat=549,545,547,548, &end
#
#  chirality for residue 19 atoms:  C2' O4' N9 H1'
 &rst iat=601,581,584,583, &end
#
#  chirality for residue 19 atoms:  C3' C1' H2'1 O2'
 &rst iat=599,582,602,603, &end
#
#  chirality for residue 19 atoms:  O3' C2' C4' H3'
 &rst iat=605,601,579,600, &end
#
#  chirality for residue 19 atoms:  C3' C5' O4' H4'
 &rst iat=599,576,581,580, &end
#
#  chirality for residue 19 atoms:  C4' O5' H5'1 H5'2
 &rst iat=579,575,577,578, &end
#
#  chirality for residue 20 atoms:  C2' O4' N9 H1'
 &rst iat=634,615,618,617, &end
#
#  chirality for residue 20 atoms:  C3' C1' H2'1 O2'
 &rst iat=632,616,635,636, &end
#
#  chirality for residue 20 atoms:  O3' C2' C4' H3'
 &rst iat=638,634,613,633, &end
#
#  chirality for residue 20 atoms:  C3' C5' O4' H4'
 &rst iat=632,610,615,614, &end
#
#  chirality for residue 20 atoms:  C4' O5' H5'1 H5'2
 &rst iat=613,609,611,612, &end
#
#  chirality for residue 21 atoms:  C2' O4' N1 H1'
 &rst iat=664,648,651,650, &end
#
#  chirality for residue 21 atoms:  C3' C1' H2'1 O2'
 &rst iat=662,649,665,666, &end
#
#  chirality for residue 21 atoms:  O3' C2' C4' H3'
 &rst iat=668,664,646,663, &end
#
#  chirality for residue 21 atoms:  C3' C5' O4' H4'
 &rst iat=662,643,648,647, &end
#
#  chirality for residue 21 atoms:  C4' O5' H5'1 H5'2
 &rst iat=646,642,644,645, &end
#
#  chirality for residue 22 atoms:  C2' O4' N1 H1'
 &rst iat=695,678,681,680, &end
#
#  chirality for residue 22 atoms:  C3' C1' H2'1 O2'
 &rst iat=693,679,696,697, &end
#
#  chirality for residue 22 atoms:  O3' C2' C4' H3'
 &rst iat=699,695,676,694, &end
#
#  chirality for residue 22 atoms:  C3' C5' O4' H4'
 &rst iat=693,673,678,677, &end
#
#  chirality for residue 22 atoms:  C4' O5' H5'1 H5'2
 &rst iat=676,672,674,675, &end
#
#  chirality for residue 23 atoms:  C2' O4' N9 H1'
 &rst iat=728,709,712,711, &end
#
#  chirality for residue 23 atoms:  C3' C1' H2'1 O2'
 &rst iat=726,710,729,730, &end
#
#  chirality for residue 23 atoms:  O3' C2' C4' H3'
 &rst iat=732,728,707,727, &end
#
#  chirality for residue 23 atoms:  C3' C5' O4' H4'
 &rst iat=726,704,709,708, &end
#
#  chirality for residue 23 atoms:  C4' O5' H5'1 H5'2
 &rst iat=707,703,705,706, &end
#
#  chirality for residue 24 atoms:  C2' O4' N9 H1'
 &rst iat=762,742,745,744, &end
#
#  chirality for residue 24 atoms:  C3' C1' H2'1 O2'
 &rst iat=760,743,763,764, &end
#
#  chirality for residue 24 atoms:  O3' C2' C4' H3'
 &rst iat=766,762,740,761, &end
#
#  chirality for residue 24 atoms:  C3' C5' O4' H4'
 &rst iat=760,737,742,741, &end
#
#  chirality for residue 24 atoms:  C4' O5' H5'1 H5'2
 &rst iat=740,736,738,739, &end
#
#  chirality for residue 25 atoms:  C2' O4' N1 H1'
 &rst iat=792,776,779,778, &end
#
#  chirality for residue 25 atoms:  C3' C1' H2'1 O2'
 &rst iat=790,777,793,794, &end
#
#  chirality for residue 25 atoms:  O3' C2' C4' H3'
 &rst iat=796,792,774,791, &end
#
#  chirality for residue 25 atoms:  C3' C5' O4' H4'
 &rst iat=790,771,776,775, &end
#
#  chirality for residue 25 atoms:  C4' O5' H5'1 H5'2
 &rst iat=774,770,772,773, &end
#
#  chirality for residue 26 atoms:  C2' O4' N9 H1'
 &rst iat=825,806,809,808, &end
#
#  chirality for residue 26 atoms:  C3' C1' H2'1 O2'
 &rst iat=823,807,826,827, &end
#
#  chirality for residue 26 atoms:  O3' C2' C4' H3'
 &rst iat=829,825,804,824, &end
#
#  chirality for residue 26 atoms:  C3' C5' O4' H4'
 &rst iat=823,801,806,805, &end
#
#  chirality for residue 26 atoms:  C4' O5' H5'1 H5'2
 &rst iat=804,800,802,803, &end
#
#  chirality for residue 27 atoms:  C2' O4' N1 H1'
 &rst iat=855,839,842,841, &end
#
#  chirality for residue 27 atoms:  C3' C1' H2'1 O2'
 &rst iat=853,840,856,857, &end
#
#  chirality for residue 27 atoms:  O3' C2' C4' H3'
 &rst iat=859,855,837,854, &end
#
#  chirality for residue 27 atoms:  C3' C5' O4' H4'
 &rst iat=853,834,839,838, &end
#
#  chirality for residue 27 atoms:  C4' O5' H5'1 H5'2
 &rst iat=837,833,835,836, &end
#
#  chirality for residue 28 atoms:  C2' O4' N9 H1'
 &rst iat=888,869,872,871, &end
#
#  chirality for residue 28 atoms:  C3' C1' H2'1 O2'
 &rst iat=886,870,889,890, &end
#
#  chirality for residue 28 atoms:  O3' C2' C4' H3'
 &rst iat=892,888,867,887, &end
#
#  chirality for residue 28 atoms:  C3' C5' O4' H4'
 &rst iat=886,864,869,868, &end
#
#  chirality for residue 28 atoms:  C4' O5' H5'1 H5'2
 &rst iat=867,863,865,866, &end
#
#  chirality for residue 29 atoms:  C2' O4' N1 H1'
 &rst iat=918,902,905,904, &end
#
#  chirality for residue 29 atoms:  C3' C1' H2'1 O2'
 &rst iat=916,903,919,920, &end
#
#  chirality for residue 29 atoms:  O3' C2' C4' H3'
 &rst iat=922,918,900,917, &end
#
#  chirality for residue 29 atoms:  C3' C5' O4' H4'
 &rst iat=916,897,902,901, &end
#
#  chirality for residue 29 atoms:  C4' O5' H5'1 H5'2
 &rst iat=900,896,898,899, &end
#
#  chirality for residue 30 atoms:  C2' O4' N1 H1'
 &rst iat=949,932,935,934, &end
#
#  chirality for residue 30 atoms:  C3' C1' H2'1 O2'
 &rst iat=947,933,950,951, &end
#
#  chirality for residue 30 atoms:  O3' C2' C4' H3'
 &rst iat=953,949,930,948, &end
#
#  chirality for residue 30 atoms:  C3' C5' O4' H4'
 &rst iat=947,927,932,931, &end
#
#  chirality for residue 30 atoms:  C4' O5' H5'1 H5'2
 &rst iat=930,926,928,929, &end
#
#  chirality for residue 31 atoms:  C2' O4' N1 H1'
 &rst iat=980,963,966,965, &end
#
#  chirality for residue 31 atoms:  C3' C1' H2'1 O2'
 &rst iat=978,964,981,982, &end
#
#  chirality for residue 31 atoms:  O3' C2' C4' H3'
 &rst iat=984,980,961,979, &end
#
#  chirality for residue 31 atoms:  C3' C5' O4' H4'
 &rst iat=978,958,963,962, &end
#
#  chirality for residue 31 atoms:  C4' O5' H5'1 H5'2
 &rst iat=961,957,959,960, &end

 


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