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
	647024	6jpp	cing	1-original	2	AMBER	stereochemistry	chirality

# Restraints file 2: RST.disang
#
#  chirality for residue 1 atoms:  N C HA2 HA3
 &rst iat=1,8,6,7, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 250., rk3 = 250.,  &end
#
#  chirality for residue 2 atoms:  CA CG HB2 HB3
 &rst iat=12,17,15,16, &end
#
#  chirality for residue 2 atoms:  CB SD HG2 HG3
 &rst iat=14,20,18,19, &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=10,25,13,14, &end
#
#  chirality for residue 3 atoms:  CA CG HB2 HB3
 &rst iat=37,31,35,36, &end
#
#  chirality for residue 3 atoms:  CB CD HG2 HG3
 &rst iat=34,28,32,33, &end
#
#  chirality for residue 3 atoms:  CG N HD2 HD3
 &rst iat=31,27,29,30, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=27,39,38,34, &end
#
#  chirality for residue 4 atoms:  CA CG HB2 HB3
 &rst iat=51,45,49,50, &end
#
#  chirality for residue 4 atoms:  CB CD HG2 HG3
 &rst iat=48,42,46,47, &end
#
#  chirality for residue 4 atoms:  CG N HD2 HD3
 &rst iat=45,41,43,44, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=41,53,52,48, &end
#
#  chirality for residue 5 atoms:  CA CG HB2 HB3
 &rst iat=65,59,63,64, &end
#
#  chirality for residue 5 atoms:  CB CD HG2 HG3
 &rst iat=62,56,60,61, &end
#
#  chirality for residue 5 atoms:  CG N HD2 HD3
 &rst iat=59,55,57,58, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=55,67,66,62, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=69,77,72,73, &end
#
#  chirality for residue 7 atoms:  CA CG HB2 HB3
 &rst iat=81,86,84,85, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=79,89,82,83, &end
#
#  chirality for residue 8 atoms:  CA CG2 CG1 HB
 &rst iat=93,97,101,96, &end
#
#  chirality for residue 8 atoms:  CB CD1 HG12 HG13
 &rst iat=95,104,102,103, &end
#
#  chirality for residue 8 atoms:  N C HA CB
 &rst iat=91,108,94,95, &end
#
#  chirality for residue 9 atoms:  CA CG1 CG2 HB
 &rst iat=112,116,120,115, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=110,124,113,114, &end
#
#  chirality for residue 10 atoms:  CA CG HB2 HB3
 &rst iat=128,133,131,132, &end
#
#  chirality for residue 10 atoms:  CB CD HG2 HG3
 &rst iat=130,136,134,135, &end
#
#  chirality for residue 10 atoms:  CD NZ HE2 HE3
 &rst iat=136,142,140,141, &end
#
#  chirality for residue 10 atoms:  CG CE HD2 HD3
 &rst iat=133,139,137,138, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=126,146,129,130, &end
#
#  chirality for residue 11 atoms:  CA CG1 CG2 HB
 &rst iat=150,154,158,153, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=148,162,151,152, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=164,172,167,168, &end
#
#  chirality for residue 13 atoms:  CA CG2 CG1 HB
 &rst iat=176,180,184,179, &end
#
#  chirality for residue 13 atoms:  CB CD1 HG12 HG13
 &rst iat=178,187,185,186, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=174,191,177,178, &end
#
#  chirality for residue 14 atoms:  CA CG HB2 HB3
 &rst iat=195,200,198,199, &end
#
#  chirality for residue 14 atoms:  CB CD HG2 HG3
 &rst iat=197,203,201,202, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=193,206,196,197, &end
#
#  chirality for residue 15 atoms:  CA CG HB2 HB3
 &rst iat=210,215,213,214, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=208,230,211,212, &end
#
#  chirality for residue 16 atoms:  CA CG HB2 HB3
 &rst iat=242,236,240,241, &end
#
#  chirality for residue 16 atoms:  CB CD HG2 HG3
 &rst iat=239,233,237,238, &end
#
#  chirality for residue 16 atoms:  CG N HD2 HD3
 &rst iat=236,232,234,235, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=232,244,243,239, &end
#
#  chirality for residue 17 atoms:  N C HA2 HA3
 &rst iat=246,251,249,250, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=253,261,256,257, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=265,270,268,269, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=263,282,266,267, &end
#
#  chirality for residue 20 atoms:  CA CG HB2 HB3
 &rst iat=294,288,292,293, &end
#
#  chirality for residue 20 atoms:  CB CD HG2 HG3
 &rst iat=291,285,289,290, &end
#
#  chirality for residue 20 atoms:  CG N HD2 HD3
 &rst iat=288,284,286,287, &end
#
#  chirality for residue 20 atoms:  N C HA CB
 &rst iat=284,296,295,291, &end
#
#  chirality for residue 21 atoms:  CA CG HB2 HB3
 &rst iat=300,305,303,304, &end
#
#  chirality for residue 21 atoms:  CB CD HG2 HG3
 &rst iat=302,308,306,307, &end
#
#  chirality for residue 21 atoms:  CD NZ HE2 HE3
 &rst iat=308,314,312,313, &end
#
#  chirality for residue 21 atoms:  CG CE HD2 HD3
 &rst iat=305,311,309,310, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=298,318,301,302, &end
#
#  chirality for residue 22 atoms:  CA CG HB2 HB3
 &rst iat=322,327,325,326, &end
#
#  chirality for residue 22 atoms:  CB CD1 CD2 HG
 &rst iat=324,329,333,328, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=320,337,323,324, &end
#
#  chirality for residue 23 atoms:  CA CG HB2 HB3
 &rst iat=341,346,344,345, &end
#
#  chirality for residue 23 atoms:  CB SD HG2 HG3
 &rst iat=343,349,347,348, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=339,354,342,343, &end
#
#  chirality for residue 24 atoms:  CA CG HB2 HB3
 &rst iat=358,363,361,362, &end
#
#  chirality for residue 24 atoms:  CB CD HG2 HG3
 &rst iat=360,366,364,365, &end
#
#  chirality for residue 24 atoms:  N C HA CB
 &rst iat=356,369,359,360, &end
#
#  chirality for residue 25 atoms:  CA CG2 CG1 HB
 &rst iat=373,377,381,376, &end
#
#  chirality for residue 25 atoms:  CB CD1 HG12 HG13
 &rst iat=375,384,382,383, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=371,388,374,375, &end
#
#  chirality for residue 26 atoms:  CA CG HB2 HB3
 &rst iat=392,397,395,396, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=390,400,393,394, &end
#
#  chirality for residue 27 atoms:  CA CG HB2 HB3
 &rst iat=404,409,407,408, &end
#
#  chirality for residue 27 atoms:  CB CD HG2 HG3
 &rst iat=406,412,410,411, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=402,417,405,406, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=421,426,424,425, &end
#
#  chirality for residue 28 atoms:  CB CD HG2 HG3
 &rst iat=423,429,427,428, &end
#
#  chirality for residue 28 atoms:  CD NZ HE2 HE3
 &rst iat=429,435,433,434, &end
#
#  chirality for residue 28 atoms:  CG CE HD2 HD3
 &rst iat=426,432,430,431, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=419,439,422,423, &end
#
#  chirality for residue 29 atoms:  CA CG HB2 HB3
 &rst iat=443,448,446,447, &end
#
#  chirality for residue 29 atoms:  CB CD HG2 HG3
 &rst iat=445,451,449,450, &end
#
#  chirality for residue 29 atoms:  CD NZ HE2 HE3
 &rst iat=451,457,455,456, &end
#
#  chirality for residue 29 atoms:  CG CE HD2 HD3
 &rst iat=448,454,452,453, &end
#
#  chirality for residue 29 atoms:  N C HA CB
 &rst iat=441,461,444,445, &end
#
#  chirality for residue 30 atoms:  CA CG HB2 HB3
 &rst iat=473,467,471,472, &end
#
#  chirality for residue 30 atoms:  CB CD HG2 HG3
 &rst iat=470,464,468,469, &end
#
#  chirality for residue 30 atoms:  CG N HD2 HD3
 &rst iat=467,463,465,466, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=463,475,474,470, &end
#
#  chirality for residue 31 atoms:  CA CG HB2 HB3
 &rst iat=479,484,482,483, &end
#
#  chirality for residue 31 atoms:  CB CD1 CD2 HG
 &rst iat=481,486,490,485, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=477,494,480,481, &end
#
#  chirality for residue 32 atoms:  CA OG HB2 HB3
 &rst iat=498,503,501,502, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=496,505,499,500, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=507,515,510,511, &end
#
#  chirality for residue 34 atoms:  CA CG2 CG1 HB
 &rst iat=519,523,527,522, &end
#
#  chirality for residue 34 atoms:  CB CD1 HG12 HG13
 &rst iat=521,530,528,529, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=517,534,520,521, &end
#
#  chirality for residue 35 atoms:  CA CG2 CG1 HB
 &rst iat=538,542,546,541, &end
#
#  chirality for residue 35 atoms:  CB CD1 HG12 HG13
 &rst iat=540,549,547,548, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=536,553,539,540, &end
#
#  chirality for residue 36 atoms:  CA CG HB2 HB3
 &rst iat=557,562,560,561, &end
#
#  chirality for residue 36 atoms:  CB CD HG2 HG3
 &rst iat=559,565,563,564, &end
#
#  chirality for residue 36 atoms:  CD NZ HE2 HE3
 &rst iat=565,571,569,570, &end
#
#  chirality for residue 36 atoms:  CG CE HD2 HD3
 &rst iat=562,568,566,567, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=555,575,558,559, &end
#
#  chirality for residue 37 atoms:  CA CG HB2 HB3
 &rst iat=579,584,582,583, &end
#
#  chirality for residue 37 atoms:  CB CD HG2 HG3
 &rst iat=581,587,585,586, &end
#
#  chirality for residue 37 atoms:  N C HA CB
 &rst iat=577,590,580,581, &end
#
#  chirality for residue 38 atoms:  CA CG1 CG2 HB
 &rst iat=594,598,602,597, &end
#
#  chirality for residue 38 atoms:  N C HA CB
 &rst iat=592,606,595,596, &end
#
#  chirality for residue 39 atoms:  CA SG HB2 HB3
 &rst iat=610,615,613,614, &end
#
#  chirality for residue 39 atoms:  N C HA CB
 &rst iat=608,617,611,612, &end
#
#  chirality for residue 40 atoms:  CA CG HB2 HB3
 &rst iat=621,626,624,625, &end
#
#  chirality for residue 40 atoms:  N C HA CB
 &rst iat=619,629,622,623, &end
#
#  chirality for residue 41 atoms:  N C HA2 HA3
 &rst iat=631,636,634,635, &end
#
#  chirality for residue 42 atoms:  CA CG HB2 HB3
 &rst iat=640,645,643,644, &end
#
#  chirality for residue 42 atoms:  N C HA CB
 &rst iat=638,660,641,642, &end
#
#  chirality for residue 43 atoms:  CA OG HB2 HB3
 &rst iat=664,669,667,668, &end
#
#  chirality for residue 43 atoms:  N C HA CB
 &rst iat=662,671,665,666, &end
#
#  chirality for residue 44 atoms:  CA CG HB2 HB3
 &rst iat=675,680,678,679, &end
#
#  chirality for residue 44 atoms:  CB CD1 CD2 HG
 &rst iat=677,682,686,681, &end
#
#  chirality for residue 44 atoms:  N C HA CB
 &rst iat=673,690,676,677, &end
#
#  chirality for residue 45 atoms:  N C HA CB
 &rst iat=692,700,695,696, &end
#
#  chirality for residue 46 atoms:  CA CG HB2 HB3
 &rst iat=704,709,707,708, &end
#
#  chirality for residue 46 atoms:  N C HA CB
 &rst iat=702,714,705,706, &end
#
#  chirality for residue 47 atoms:  CA CG HB2 HB3
 &rst iat=718,723,721,722, &end
#
#  chirality for residue 47 atoms:  N C HA CB
 &rst iat=716,731,719,720, &end
#
#  chirality for residue 48 atoms:  CA CG HB2 HB3
 &rst iat=735,740,738,739, &end
#
#  chirality for residue 48 atoms:  CB CD HG2 HG3
 &rst iat=737,743,741,742, &end
#
#  chirality for residue 48 atoms:  N C HA CB
 &rst iat=733,746,736,737, &end
#
#  chirality for residue 49 atoms:  CA CG HB2 HB3
 &rst iat=750,755,753,754, &end
#
#  chirality for residue 49 atoms:  N C HA CB
 &rst iat=748,767,751,752, &end
#
#  chirality for residue 50 atoms:  CA CG HB2 HB3
 &rst iat=771,776,774,775, &end
#
#  chirality for residue 50 atoms:  N C HA CB
 &rst iat=769,787,772,773, &end
#
#  chirality for residue 51 atoms:  N C HA CB
 &rst iat=789,797,792,793, &end
#
#  chirality for residue 52 atoms:  CA CG HB2 HB3
 &rst iat=801,806,804,805, &end
#
#  chirality for residue 52 atoms:  CB CD1 CD2 HG
 &rst iat=803,808,812,807, &end
#
#  chirality for residue 52 atoms:  N C HA CB
 &rst iat=799,816,802,803, &end
#
#  chirality for residue 53 atoms:  CA CG HB2 HB3
 &rst iat=820,825,823,824, &end
#
#  chirality for residue 53 atoms:  CB CD HG2 HG3
 &rst iat=822,828,826,827, &end
#
#  chirality for residue 53 atoms:  N C HA CB
 &rst iat=818,833,821,822, &end
#
#  chirality for residue 54 atoms:  CA CG HB2 HB3
 &rst iat=837,842,840,841, &end
#
#  chirality for residue 54 atoms:  N C HA CB
 &rst iat=835,850,838,839, &end
#
#  chirality for residue 55 atoms:  N C HA CB
 &rst iat=852,860,855,856, &end
#
#  chirality for residue 56 atoms:  CA CG HB2 HB3
 &rst iat=864,869,867,868, &end
#
#  chirality for residue 56 atoms:  N C HA CB
 &rst iat=862,872,865,866, &end
#
#  chirality for residue 57 atoms:  CA OG HB2 HB3
 &rst iat=876,881,879,880, &end
#
#  chirality for residue 57 atoms:  N C HA CB
 &rst iat=874,883,877,878, &end
#
#  chirality for residue 58 atoms:  CA OG HB2 HB3
 &rst iat=887,892,890,891, &end
#
#  chirality for residue 58 atoms:  N C HA CB
 &rst iat=885,894,888,889, &end
#
#  chirality for residue 59 atoms:  CA CG HB2 HB3
 &rst iat=898,903,901,902, &end
#
#  chirality for residue 59 atoms:  N C HA CB
 &rst iat=896,908,899,900, &end
#
#  chirality for residue 60 atoms:  CA CG HB2 HB3
 &rst iat=912,917,915,916, &end
#
#  chirality for residue 60 atoms:  N C HA CB
 &rst iat=910,928,913,914, &end
#
#  chirality for residue 61 atoms:  CA CG HB2 HB3
 &rst iat=932,937,935,936, &end
#
#  chirality for residue 61 atoms:  N C HA CB
 &rst iat=930,949,933,934, &end
#
#  chirality for residue 62 atoms:  CA CG2 CG1 HB
 &rst iat=953,957,961,956, &end
#
#  chirality for residue 62 atoms:  CB CD1 HG12 HG13
 &rst iat=955,964,962,963, &end
#
#  chirality for residue 62 atoms:  N C HA CB
 &rst iat=951,968,954,955, &end
#
#  chirality for residue 63 atoms:  CA CG2 OG1 HB
 &rst iat=972,976,980,975, &end
#
#  chirality for residue 63 atoms:  N C HA CB
 &rst iat=970,982,973,974, &end
#
#  chirality for residue 64 atoms:  CA CG HB2 HB3
 &rst iat=986,991,989,990, &end
#
#  chirality for residue 64 atoms:  CB CD HG2 HG3
 &rst iat=988,994,992,993, &end
#
#  chirality for residue 64 atoms:  N C HA CB
 &rst iat=984,997,987,988, &end
#
#  chirality for residue 65 atoms:  CA CG HB2 HB3
 &rst iat=1001,1006,1004,1005, &end
#
#  chirality for residue 65 atoms:  CB CD HG2 HG3
 &rst iat=1003,1009,1007,1008, &end
#
#  chirality for residue 65 atoms:  CD NZ HE2 HE3
 &rst iat=1009,1015,1013,1014, &end
#
#  chirality for residue 65 atoms:  CG CE HD2 HD3
 &rst iat=1006,1012,1010,1011, &end
#
#  chirality for residue 65 atoms:  N C HA CB
 &rst iat=999,1019,1002,1003, &end
#
#  chirality for residue 66 atoms:  CA CG HB2 HB3
 &rst iat=1023,1028,1026,1027, &end
#
#  chirality for residue 66 atoms:  N C HA CB
 &rst iat=1021,1033,1024,1025, &end
#
#  chirality for residue 67 atoms:  CA CG HB2 HB3
 &rst iat=1037,1042,1040,1041, &end
#
#  chirality for residue 67 atoms:  CB CD HG2 HG3
 &rst iat=1039,1045,1043,1044, &end
#
#  chirality for residue 67 atoms:  CG NE HD2 HD3
 &rst iat=1042,1048,1046,1047, &end
#
#  chirality for residue 67 atoms:  N C HA CB
 &rst iat=1035,1057,1038,1039, &end
#
#  chirality for residue 68 atoms:  CA CG HB2 HB3
 &rst iat=1061,1066,1064,1065, &end
#
#  chirality for residue 68 atoms:  N C HA CB
 &rst iat=1059,1071,1062,1063, &end
#
#  chirality for residue 69 atoms:  CA CG HB2 HB3
 &rst iat=1075,1080,1078,1079, &end
#
#  chirality for residue 69 atoms:  CB CD HG2 HG3
 &rst iat=1077,1083,1081,1082, &end
#
#  chirality for residue 69 atoms:  N C HA CB
 &rst iat=1073,1086,1076,1077, &end
#
#  chirality for residue 70 atoms:  CA CG2 CG1 HB
 &rst iat=1090,1094,1098,1093, &end
#
#  chirality for residue 70 atoms:  CB CD1 HG12 HG13
 &rst iat=1092,1101,1099,1100, &end
#
#  chirality for residue 70 atoms:  N C HA CB
 &rst iat=1088,1105,1091,1092, &end
#
#  chirality for residue 71 atoms:  CA CG HB2 HB3
 &rst iat=1109,1114,1112,1113, &end
#
#  chirality for residue 71 atoms:  CB CD HG2 HG3
 &rst iat=1111,1117,1115,1116, &end
#
#  chirality for residue 71 atoms:  CD NZ HE2 HE3
 &rst iat=1117,1123,1121,1122, &end
#
#  chirality for residue 71 atoms:  CG CE HD2 HD3
 &rst iat=1114,1120,1118,1119, &end
#
#  chirality for residue 71 atoms:  N C HA CB
 &rst iat=1107,1127,1110,1111, &end
#
#  chirality for residue 72 atoms:  CA CG HB2 HB3
 &rst iat=1131,1136,1134,1135, &end
#
#  chirality for residue 72 atoms:  N C HA CB
 &rst iat=1129,1141,1132,1133, &end
#
#  chirality for residue 73 atoms:  N C HA2 HA3
 &rst iat=1143,1148,1146,1147, &end
#
#  chirality for residue 74 atoms:  CA CG2 OG1 HB
 &rst iat=1152,1156,1160,1155, &end
#
#  chirality for residue 74 atoms:  N C HA CB
 &rst iat=1150,1162,1153,1154, &end
#
#  chirality for residue 75 atoms:  CA CG2 CG1 HB
 &rst iat=1166,1170,1174,1169, &end
#
#  chirality for residue 75 atoms:  CB CD1 HG12 HG13
 &rst iat=1168,1177,1175,1176, &end
#
#  chirality for residue 75 atoms:  N C HA CB
 &rst iat=1164,1181,1167,1168, &end
#
#  chirality for residue 76 atoms:  CA CG HB2 HB3
 &rst iat=1185,1190,1188,1189, &end
#
#  chirality for residue 76 atoms:  CB CD1 CD2 HG
 &rst iat=1187,1192,1196,1191, &end
#
#  chirality for residue 76 atoms:  N C HA CB
 &rst iat=1183,1200,1186,1187, &end
#
#  chirality for residue 77 atoms:  CA CG HB2 HB3
 &rst iat=1204,1209,1207,1208, &end
#
#  chirality for residue 77 atoms:  CB CD HG2 HG3
 &rst iat=1206,1212,1210,1211, &end
#
#  chirality for residue 77 atoms:  CG NE HD2 HD3
 &rst iat=1209,1215,1213,1214, &end
#
#  chirality for residue 77 atoms:  N C HA CB
 &rst iat=1202,1224,1205,1206, &end
#
#  chirality for residue 78 atoms:  CA CG HB2 HB3
 &rst iat=1228,1233,1231,1232, &end
#
#  chirality for residue 78 atoms:  CB CD1 CD2 HG
 &rst iat=1230,1235,1239,1234, &end
#
#  chirality for residue 78 atoms:  N C HA CB
 &rst iat=1226,1243,1229,1230, &end
#
#  chirality for residue 79 atoms:  CA CG2 OG1 HB
 &rst iat=1247,1251,1255,1250, &end
#
#  chirality for residue 79 atoms:  N C HA CB
 &rst iat=1245,1257,1248,1249, &end
#
#  chirality for residue 80 atoms:  CA CG2 OG1 HB
 &rst iat=1261,1265,1269,1264, &end
#
#  chirality for residue 80 atoms:  N C HA CB
 &rst iat=1259,1271,1262,1263, &end
#
#  chirality for residue 81 atoms:  CA OG HB2 HB3
 &rst iat=1275,1280,1278,1279, &end
#
#  chirality for residue 81 atoms:  N C HA CB
 &rst iat=1273,1282,1276,1277, &end
#
#  chirality for residue 82 atoms:  CA CG HB2 HB3
 &rst iat=1294,1288,1292,1293, &end
#
#  chirality for residue 82 atoms:  CB CD HG2 HG3
 &rst iat=1291,1285,1289,1290, &end
#
#  chirality for residue 82 atoms:  CG N HD2 HD3
 &rst iat=1288,1284,1286,1287, &end
#
#  chirality for residue 82 atoms:  N C HA CB
 &rst iat=1284,1296,1295,1291, &end
#
#  chirality for residue 83 atoms:  N C HA CB
 &rst iat=1298,1306,1301,1302, &end
#
#  chirality for residue 84 atoms:  CA CG HB2 HB3
 &rst iat=1310,1315,1313,1314, &end
#
#  chirality for residue 84 atoms:  CB CD HG2 HG3
 &rst iat=1312,1318,1316,1317, &end
#
#  chirality for residue 84 atoms:  N C HA CB
 &rst iat=1308,1323,1311,1312, &end
#
#  chirality for residue 85 atoms:  CA CG HB2 HB3
 &rst iat=1327,1332,1330,1331, &end
#
#  chirality for residue 85 atoms:  N C HA CB
 &rst iat=1325,1337,1328,1329, &end
#
#  chirality for residue 86 atoms:  N C HA CB
 &rst iat=1339,1347,1342,1343, &end
#
#  chirality for residue 87 atoms:  CA CG HB2 HB3
 &rst iat=1351,1356,1354,1355, &end
#
#  chirality for residue 87 atoms:  CB CD HG2 HG3
 &rst iat=1353,1359,1357,1358, &end
#
#  chirality for residue 87 atoms:  N C HA CB
 &rst iat=1349,1364,1352,1353, &end
#
#  chirality for residue 88 atoms:  CA CG HB2 HB3
 &rst iat=1368,1373,1371,1372, &end
#
#  chirality for residue 88 atoms:  CB CD HG2 HG3
 &rst iat=1370,1376,1374,1375, &end
#
#  chirality for residue 88 atoms:  N C HA CB
 &rst iat=1366,1381,1369,1370, &end
#
#  chirality for residue 89 atoms:  CA CG HB2 HB3
 &rst iat=1385,1390,1388,1389, &end
#
#  chirality for residue 89 atoms:  CB CD1 CD2 HG
 &rst iat=1387,1392,1396,1391, &end
#
#  chirality for residue 89 atoms:  N C HA CB
 &rst iat=1383,1400,1386,1387, &end
#
#  chirality for residue 90 atoms:  CA CG HB2 HB3
 &rst iat=1404,1409,1407,1408, &end
#
#  chirality for residue 90 atoms:  N C HA CB
 &rst iat=1402,1417,1405,1406, &end
#
#  chirality for residue 91 atoms:  CA CG HB2 HB3
 &rst iat=1421,1426,1424,1425, &end
#
#  chirality for residue 91 atoms:  CB CD HG2 HG3
 &rst iat=1423,1429,1427,1428, &end
#
#  chirality for residue 91 atoms:  N C HA CB
 &rst iat=1419,1432,1422,1423, &end
#
#  chirality for residue 92 atoms:  CA CG HB2 HB3
 &rst iat=1436,1441,1439,1440, &end
#
#  chirality for residue 92 atoms:  CB CD HG2 HG3
 &rst iat=1438,1444,1442,1443, &end
#
#  chirality for residue 92 atoms:  CG NE HD2 HD3
 &rst iat=1441,1447,1445,1446, &end
#
#  chirality for residue 92 atoms:  N C HA CB
 &rst iat=1434,1456,1437,1438, &end
#
#  chirality for residue 93 atoms:  CA CG2 CG1 HB
 &rst iat=1460,1464,1468,1463, &end
#
#  chirality for residue 93 atoms:  CB CD1 HG12 HG13
 &rst iat=1462,1471,1469,1470, &end
#
#  chirality for residue 93 atoms:  N C HA CB
 &rst iat=1458,1475,1461,1462, &end
#
#  chirality for residue 94 atoms:  CA CG HB2 HB3
 &rst iat=1479,1484,1482,1483, &end
#
#  chirality for residue 94 atoms:  CB CD HG2 HG3
 &rst iat=1481,1487,1485,1486, &end
#
#  chirality for residue 94 atoms:  N C HA CB
 &rst iat=1477,1492,1480,1481, &end
#
#  chirality for residue 95 atoms:  CA OG HB2 HB3
 &rst iat=1496,1501,1499,1500, &end
#
#  chirality for residue 95 atoms:  N C HA CB
 &rst iat=1494,1503,1497,1498, &end
#
#  chirality for residue 96 atoms:  CA OG HB2 HB3
 &rst iat=1507,1512,1510,1511, &end
#
#  chirality for residue 96 atoms:  N C HA CB
 &rst iat=1505,1514,1508,1509, &end
#
#  chirality for residue 97 atoms:  CA OG HB2 HB3
 &rst iat=1518,1523,1521,1522, &end
#
#  chirality for residue 97 atoms:  N C HA CB
 &rst iat=1516,1525,1519,1520, &end
#
#  chirality for residue 98 atoms:  CA CG HB2 HB3
 &rst iat=1529,1534,1532,1533, &end
#
#  chirality for residue 98 atoms:  CB SD HG2 HG3
 &rst iat=1531,1537,1535,1536, &end
#
#  chirality for residue 98 atoms:  N C HA CB
 &rst iat=1527,1542,1530,1531, &end
#
#  chirality for residue 99 atoms:  CA CG HB2 HB3
 &rst iat=1546,1551,1549,1550, &end
#
#  chirality for residue 99 atoms:  N C HA CB
 &rst iat=1544,1554,1547,1548, &end
#
#  chirality for residue 100 atoms:  N C HA CB
 &rst iat=1556,1564,1559,1560, &end
#
#  chirality for residue 101 atoms:  CA CG HB2 HB3
 &rst iat=1568,1573,1571,1572, &end
#
#  chirality for residue 101 atoms:  CB CD HG2 HG3
 &rst iat=1570,1576,1574,1575, &end
#
#  chirality for residue 101 atoms:  CD NZ HE2 HE3
 &rst iat=1576,1582,1580,1581, &end
#
#  chirality for residue 101 atoms:  CG CE HD2 HD3
 &rst iat=1573,1579,1577,1578, &end
#
#  chirality for residue 101 atoms:  N C HA CB
 &rst iat=1566,1586,1569,1570, &end
#
#  chirality for residue 102 atoms:  CA CG HB2 HB3
 &rst iat=1590,1595,1593,1594, &end
#
#  chirality for residue 102 atoms:  CB CD1 CD2 HG
 &rst iat=1592,1597,1601,1596, &end
#
#  chirality for residue 102 atoms:  N C HA CB
 &rst iat=1588,1605,1591,1592, &end
#
#  chirality for residue 103 atoms:  CA CG HB2 HB3
 &rst iat=1609,1614,1612,1613, &end
#
#  chirality for residue 103 atoms:  CB CD HG2 HG3
 &rst iat=1611,1617,1615,1616, &end
#
#  chirality for residue 103 atoms:  N C HA CB
 &rst iat=1607,1620,1610,1611, &end
#
#  chirality for residue 104 atoms:  N C HA CB
 &rst iat=1622,1630,1625,1626, &end
#
#  chirality for residue 105 atoms:  CA CG HB2 HB3
 &rst iat=1634,1639,1637,1638, &end
#
#  chirality for residue 105 atoms:  CB CD1 CD2 HG
 &rst iat=1636,1641,1645,1640, &end
#
#  chirality for residue 105 atoms:  N C HA CB
 &rst iat=1632,1649,1635,1636, &end
#
#  chirality for residue 106 atoms:  CA CG HB2 HB3
 &rst iat=1653,1658,1656,1657, &end
#
#  chirality for residue 106 atoms:  CB CD HG2 HG3
 &rst iat=1655,1661,1659,1660, &end
#
#  chirality for residue 106 atoms:  CD NZ HE2 HE3
 &rst iat=1661,1667,1665,1666, &end
#
#  chirality for residue 106 atoms:  CG CE HD2 HD3
 &rst iat=1658,1664,1662,1663, &end
#
#  chirality for residue 106 atoms:  N C HA CB
 &rst iat=1651,1671,1654,1655, &end
#
#  chirality for residue 107 atoms:  CA CG HB2 HB3
 &rst iat=1675,1680,1678,1679, &end
#
#  chirality for residue 107 atoms:  N C HA CB
 &rst iat=1673,1683,1676,1677, &end
#
#  chirality for residue 108 atoms:  CA CG HB2 HB3
 &rst iat=1687,1692,1690,1691, &end
#
#  chirality for residue 108 atoms:  CB CD1 CD2 HG
 &rst iat=1689,1694,1698,1693, &end
#
#  chirality for residue 108 atoms:  N C HA CB
 &rst iat=1685,1702,1688,1689, &end
#
#  chirality for residue 109 atoms:  N C HA CB
 &rst iat=1704,1712,1707,1708, &end
#
#  chirality for residue 110 atoms:  CA OG HB2 HB3
 &rst iat=1716,1721,1719,1720, &end
#
#  chirality for residue 110 atoms:  N C HA CB
 &rst iat=1714,1723,1717,1718, &end
#
#  chirality for residue 111 atoms:  CA CG HB2 HB3
 &rst iat=1727,1732,1730,1731, &end
#
#  chirality for residue 111 atoms:  CB CD1 CD2 HG
 &rst iat=1729,1734,1738,1733, &end
#
#  chirality for residue 111 atoms:  N C HA CB
 &rst iat=1725,1742,1728,1729, &end
#
#  chirality for residue 112 atoms:  CA OG HB2 HB3
 &rst iat=1746,1751,1749,1750, &end
#
#  chirality for residue 112 atoms:  N C HA CB
 &rst iat=1744,1753,1747,1748, &end
#
#  chirality for residue 113 atoms:  CA CG HB2 HB3
 &rst iat=1757,1762,1760,1761, &end
#
#  chirality for residue 113 atoms:  CB CD HG2 HG3
 &rst iat=1759,1765,1763,1764, &end
#
#  chirality for residue 113 atoms:  CG NE HD2 HD3
 &rst iat=1762,1768,1766,1767, &end
#
#  chirality for residue 113 atoms:  N C HA CB
 &rst iat=1755,1777,1758,1759, &end
#
#  chirality for residue 114 atoms:  CA CG HB2 HB3
 &rst iat=1781,1786,1784,1785, &end
#
#  chirality for residue 114 atoms:  N C HA CB
 &rst iat=1779,1789,1782,1783, &end
#
#  trans-omega constraint for residue 2
 &rst iat=12,10,8,5, 
   r1=150., r2=170., r3=190., r4=210., rk2 = 50., rk3=50.,  &end
#
#  trans-omega constraint for residue 3
 &rst iat=37,27,25,12, &end
#
#  trans-omega constraint for residue 4
 &rst iat=51,41,39,37, &end
#
#  trans-omega constraint for residue 5
 &rst iat=65,55,53,51, &end
#
#  trans-omega constraint for residue 6
 &rst iat=71,69,67,65, &end
#
#  trans-omega constraint for residue 7
 &rst iat=81,79,77,71, &end
#
#  trans-omega constraint for residue 8
 &rst iat=93,91,89,81, &end
#
#  trans-omega constraint for residue 9
 &rst iat=112,110,108,93, &end
#
#  trans-omega constraint for residue 10
 &rst iat=128,126,124,112, &end
#
#  trans-omega constraint for residue 11
 &rst iat=150,148,146,128, &end
#
#  trans-omega constraint for residue 12
 &rst iat=166,164,162,150, &end
#
#  trans-omega constraint for residue 13
 &rst iat=176,174,172,166, &end
#
#  trans-omega constraint for residue 14
 &rst iat=195,193,191,176, &end
#
#  trans-omega constraint for residue 15
 &rst iat=210,208,206,195, &end
#
#  trans-omega constraint for residue 16
 &rst iat=242,232,230,210, &end
#
#  trans-omega constraint for residue 17
 &rst iat=248,246,244,242, &end
#
#  trans-omega constraint for residue 18
 &rst iat=255,253,251,248, &end
#
#  trans-omega constraint for residue 19
 &rst iat=265,263,261,255, &end
#
#  trans-omega constraint for residue 20
 &rst iat=294,284,282,265, &end
#
#  trans-omega constraint for residue 21
 &rst iat=300,298,296,294, &end
#
#  trans-omega constraint for residue 22
 &rst iat=322,320,318,300, &end
#
#  trans-omega constraint for residue 23
 &rst iat=341,339,337,322, &end
#
#  trans-omega constraint for residue 24
 &rst iat=358,356,354,341, &end
#
#  trans-omega constraint for residue 25
 &rst iat=373,371,369,358, &end
#
#  trans-omega constraint for residue 26
 &rst iat=392,390,388,373, &end
#
#  trans-omega constraint for residue 27
 &rst iat=404,402,400,392, &end
#
#  trans-omega constraint for residue 28
 &rst iat=421,419,417,404, &end
#
#  trans-omega constraint for residue 29
 &rst iat=443,441,439,421, &end
#
#  trans-omega constraint for residue 30
 &rst iat=473,463,461,443, &end
#
#  trans-omega constraint for residue 31
 &rst iat=479,477,475,473, &end
#
#  trans-omega constraint for residue 32
 &rst iat=498,496,494,479, &end
#
#  trans-omega constraint for residue 33
 &rst iat=509,507,505,498, &end
#
#  trans-omega constraint for residue 34
 &rst iat=519,517,515,509, &end
#
#  trans-omega constraint for residue 35
 &rst iat=538,536,534,519, &end
#
#  trans-omega constraint for residue 36
 &rst iat=557,555,553,538, &end
#
#  trans-omega constraint for residue 37
 &rst iat=579,577,575,557, &end
#
#  trans-omega constraint for residue 38
 &rst iat=594,592,590,579, &end
#
#  trans-omega constraint for residue 39
 &rst iat=610,608,606,594, &end
#
#  trans-omega constraint for residue 40
 &rst iat=621,619,617,610, &end
#
#  trans-omega constraint for residue 41
 &rst iat=633,631,629,621, &end
#
#  trans-omega constraint for residue 42
 &rst iat=640,638,636,633, &end
#
#  trans-omega constraint for residue 43
 &rst iat=664,662,660,640, &end
#
#  trans-omega constraint for residue 44
 &rst iat=675,673,671,664, &end
#
#  trans-omega constraint for residue 45
 &rst iat=694,692,690,675, &end
#
#  trans-omega constraint for residue 46
 &rst iat=704,702,700,694, &end
#
#  trans-omega constraint for residue 47
 &rst iat=718,716,714,704, &end
#
#  trans-omega constraint for residue 48
 &rst iat=735,733,731,718, &end
#
#  trans-omega constraint for residue 49
 &rst iat=750,748,746,735, &end
#
#  trans-omega constraint for residue 50
 &rst iat=771,769,767,750, &end
#
#  trans-omega constraint for residue 51
 &rst iat=791,789,787,771, &end
#
#  trans-omega constraint for residue 52
 &rst iat=801,799,797,791, &end
#
#  trans-omega constraint for residue 53
 &rst iat=820,818,816,801, &end
#
#  trans-omega constraint for residue 54
 &rst iat=837,835,833,820, &end
#
#  trans-omega constraint for residue 55
 &rst iat=854,852,850,837, &end
#
#  trans-omega constraint for residue 56
 &rst iat=864,862,860,854, &end
#
#  trans-omega constraint for residue 57
 &rst iat=876,874,872,864, &end
#
#  trans-omega constraint for residue 58
 &rst iat=887,885,883,876, &end
#
#  trans-omega constraint for residue 59
 &rst iat=898,896,894,887, &end
#
#  trans-omega constraint for residue 60
 &rst iat=912,910,908,898, &end
#
#  trans-omega constraint for residue 61
 &rst iat=932,930,928,912, &end
#
#  trans-omega constraint for residue 62
 &rst iat=953,951,949,932, &end
#
#  trans-omega constraint for residue 63
 &rst iat=972,970,968,953, &end
#
#  trans-omega constraint for residue 64
 &rst iat=986,984,982,972, &end
#
#  trans-omega constraint for residue 65
 &rst iat=1001,999,997,986, &end
#
#  trans-omega constraint for residue 66
 &rst iat=1023,1021,1019,1001, &end
#
#  trans-omega constraint for residue 67
 &rst iat=1037,1035,1033,1023, &end
#
#  trans-omega constraint for residue 68
 &rst iat=1061,1059,1057,1037, &end
#
#  trans-omega constraint for residue 69
 &rst iat=1075,1073,1071,1061, &end
#
#  trans-omega constraint for residue 70
 &rst iat=1090,1088,1086,1075, &end
#
#  trans-omega constraint for residue 71
 &rst iat=1109,1107,1105,1090, &end
#
#  trans-omega constraint for residue 72
 &rst iat=1131,1129,1127,1109, &end
#
#  trans-omega constraint for residue 73
 &rst iat=1145,1143,1141,1131, &end
#
#  trans-omega constraint for residue 74
 &rst iat=1152,1150,1148,1145, &end
#
#  trans-omega constraint for residue 75
 &rst iat=1166,1164,1162,1152, &end
#
#  trans-omega constraint for residue 76
 &rst iat=1185,1183,1181,1166, &end
#
#  trans-omega constraint for residue 77
 &rst iat=1204,1202,1200,1185, &end
#
#  trans-omega constraint for residue 78
 &rst iat=1228,1226,1224,1204, &end
#
#  trans-omega constraint for residue 79
 &rst iat=1247,1245,1243,1228, &end
#
#  trans-omega constraint for residue 80
 &rst iat=1261,1259,1257,1247, &end
#
#  trans-omega constraint for residue 81
 &rst iat=1275,1273,1271,1261, &end
#
#  trans-omega constraint for residue 82
 &rst iat=1294,1284,1282,1275, &end
#
#  trans-omega constraint for residue 83
 &rst iat=1300,1298,1296,1294, &end
#
#  trans-omega constraint for residue 84
 &rst iat=1310,1308,1306,1300, &end
#
#  trans-omega constraint for residue 85
 &rst iat=1327,1325,1323,1310, &end
#
#  trans-omega constraint for residue 86
 &rst iat=1341,1339,1337,1327, &end
#
#  trans-omega constraint for residue 87
 &rst iat=1351,1349,1347,1341, &end
#
#  trans-omega constraint for residue 88
 &rst iat=1368,1366,1364,1351, &end
#
#  trans-omega constraint for residue 89
 &rst iat=1385,1383,1381,1368, &end
#
#  trans-omega constraint for residue 90
 &rst iat=1404,1402,1400,1385, &end
#
#  trans-omega constraint for residue 91
 &rst iat=1421,1419,1417,1404, &end
#
#  trans-omega constraint for residue 92
 &rst iat=1436,1434,1432,1421, &end
#
#  trans-omega constraint for residue 93
 &rst iat=1460,1458,1456,1436, &end
#
#  trans-omega constraint for residue 94
 &rst iat=1479,1477,1475,1460, &end
#
#  trans-omega constraint for residue 95
 &rst iat=1496,1494,1492,1479, &end
#
#  trans-omega constraint for residue 96
 &rst iat=1507,1505,1503,1496, &end
#
#  trans-omega constraint for residue 97
 &rst iat=1518,1516,1514,1507, &end
#
#  trans-omega constraint for residue 98
 &rst iat=1529,1527,1525,1518, &end
#
#  trans-omega constraint for residue 99
 &rst iat=1546,1544,1542,1529, &end
#
#  trans-omega constraint for residue 100
 &rst iat=1558,1556,1554,1546, &end
#
#  trans-omega constraint for residue 101
 &rst iat=1568,1566,1564,1558, &end
#
#  trans-omega constraint for residue 102
 &rst iat=1590,1588,1586,1568, &end
#
#  trans-omega constraint for residue 103
 &rst iat=1609,1607,1605,1590, &end
#
#  trans-omega constraint for residue 104
 &rst iat=1624,1622,1620,1609, &end
#
#  trans-omega constraint for residue 105
 &rst iat=1634,1632,1630,1624, &end
#
#  trans-omega constraint for residue 106
 &rst iat=1653,1651,1649,1634, &end
#
#  trans-omega constraint for residue 107
 &rst iat=1675,1673,1671,1653, &end
#
#  trans-omega constraint for residue 108
 &rst iat=1687,1685,1683,1675, &end
#
#  trans-omega constraint for residue 109
 &rst iat=1706,1704,1702,1687, &end
#
#  trans-omega constraint for residue 110
 &rst iat=1716,1714,1712,1706, &end
#
#  trans-omega constraint for residue 111
 &rst iat=1727,1725,1723,1716, &end
#
#  trans-omega constraint for residue 112
 &rst iat=1746,1744,1742,1727, &end
#
#  trans-omega constraint for residue 113
 &rst iat=1757,1755,1753,1746, &end
#
#  trans-omega constraint for residue 114
 &rst iat=1781,1779,1777,1757, &end
#

Contact the webmaster for help, if required. Friday, May 3, 2024 3:52:17 PM GMT (wattos1)