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
492414 2k9o 15992 cing 1-original 3 AMBER stereochemistry chirality


#
#  chirality for residue 1 atoms:  N C HA CB
 &rst iat=1,11,6,7, 
   r1=10., r2=60., r3=80., r4=130., rk2 = 10., rk3=10.,  &end
#
#  chirality for residue 2 atoms:  N C HA CB
 &rst iat=13,21,16,17, &end
#
#  chirality for residue 3 atoms:  N C HA CB
 &rst iat=23,31,26,27, &end
#
#  chirality for residue 4 atoms:  CA CG2 CG1 HB
 &rst iat=35,39,43,38, &end
#
#  chirality for residue 4 atoms:  CB CD1 HG12 HG13
 &rst iat=37,46,44,45, &end
#
#  chirality for residue 4 atoms:  N C HA CB
 &rst iat=33,50,36,37, &end
#
#  chirality for residue 5 atoms:  CA OG HB2 HB3
 &rst iat=54,59,57,58, &end
#
#  chirality for residue 5 atoms:  N C HA CB
 &rst iat=52,61,55,56, &end
#
#  chirality for residue 6 atoms:  CA SG HB2 HB3
 &rst iat=65,70,68,69, &end
#
#  chirality for residue 6 atoms:  N C HA CB
 &rst iat=63,71,66,67, &end
#
#  chirality for residue 7 atoms:  CA CG1 CG2 HB
 &rst iat=75,79,83,78, &end
#
#  chirality for residue 7 atoms:  N C HA CB
 &rst iat=73,87,76,77, &end
#
#  chirality for residue 8 atoms:  N C HA2 HA3
 &rst iat=89,94,92,93, &end
#
#  chirality for residue 9 atoms:  CA OG HB2 HB3
 &rst iat=98,103,101,102, &end
#
#  chirality for residue 9 atoms:  N C HA CB
 &rst iat=96,105,99,100, &end
#
#  chirality for residue 10 atoms:  CA CG HB2 HB3
 &rst iat=117,111,115,116, &end
#
#  chirality for residue 10 atoms:  CB CD HG2 HG3
 &rst iat=114,108,112,113, &end
#
#  chirality for residue 10 atoms:  CG N HD2 HD3
 &rst iat=111,107,109,110, &end
#
#  chirality for residue 10 atoms:  N C HA CB
 &rst iat=107,119,118,114, &end
#
#  chirality for residue 11 atoms:  CA CG HB2 HB3
 &rst iat=123,128,126,127, &end
#
#  chirality for residue 11 atoms:  CB CD HG2 HG3
 &rst iat=125,131,129,130, &end
#
#  chirality for residue 11 atoms:  N C HA CB
 &rst iat=121,134,124,125, &end
#
#  chirality for residue 12 atoms:  CA SG HB2 HB3
 &rst iat=138,143,141,142, &end
#
#  chirality for residue 12 atoms:  N C HA CB
 &rst iat=136,144,139,140, &end
#
#  chirality for residue 13 atoms:  CA CG HB2 HB3
 &rst iat=156,150,154,155, &end
#
#  chirality for residue 13 atoms:  CB CD HG2 HG3
 &rst iat=153,147,151,152, &end
#
#  chirality for residue 13 atoms:  CG N HD2 HD3
 &rst iat=150,146,148,149, &end
#
#  chirality for residue 13 atoms:  N C HA CB
 &rst iat=146,158,157,153, &end
#
#  chirality for residue 14 atoms:  CA CG HB2 HB3
 &rst iat=170,164,168,169, &end
#
#  chirality for residue 14 atoms:  CB CD HG2 HG3
 &rst iat=167,161,165,166, &end
#
#  chirality for residue 14 atoms:  CG N HD2 HD3
 &rst iat=164,160,162,163, &end
#
#  chirality for residue 14 atoms:  N C HA CB
 &rst iat=160,172,171,167, &end
#
#  chirality for residue 15 atoms:  CA CG HB2 HB3
 &rst iat=176,181,179,180, &end
#
#  chirality for residue 15 atoms:  CB CD HG2 HG3
 &rst iat=178,184,182,183, &end
#
#  chirality for residue 15 atoms:  CD NZ HE2 HE3
 &rst iat=184,190,188,189, &end
#
#  chirality for residue 15 atoms:  CG CE HD2 HD3
 &rst iat=181,187,185,186, &end
#
#  chirality for residue 15 atoms:  N C HA CB
 &rst iat=174,194,177,178, &end
#
#  chirality for residue 16 atoms:  CA SG HB2 HB3
 &rst iat=198,203,201,202, &end
#
#  chirality for residue 16 atoms:  N C HA CB
 &rst iat=196,204,199,200, &end
#
#  chirality for residue 17 atoms:  CA CG HB2 HB3
 &rst iat=208,213,211,212, &end
#
#  chirality for residue 17 atoms:  CB CD HG2 HG3
 &rst iat=210,216,214,215, &end
#
#  chirality for residue 17 atoms:  CG NE HD2 HD3
 &rst iat=213,219,217,218, &end
#
#  chirality for residue 17 atoms:  N C HA CB
 &rst iat=206,228,209,210, &end
#
#  chirality for residue 18 atoms:  N C HA CB
 &rst iat=230,238,233,234, &end
#
#  chirality for residue 19 atoms:  CA CG HB2 HB3
 &rst iat=242,247,245,246, &end
#
#  chirality for residue 19 atoms:  CB CD HG2 HG3
 &rst iat=244,250,248,249, &end
#
#  chirality for residue 19 atoms:  N C HA CB
 &rst iat=240,255,243,244, &end
#
#  chirality for residue 20 atoms:  N C HA2 HA3
 &rst iat=257,262,260,261, &end
#
#  chirality for residue 21 atoms:  CA SG HB2 HB3
 &rst iat=266,271,269,270, &end
#
#  chirality for residue 21 atoms:  N C HA CB
 &rst iat=264,272,267,268, &end
#
#  chirality for residue 22 atoms:  CA CG HB2 HB3
 &rst iat=276,281,279,280, &end
#
#  chirality for residue 22 atoms:  CB CD HG2 HG3
 &rst iat=278,284,282,283, &end
#
#  chirality for residue 22 atoms:  CD NZ HE2 HE3
 &rst iat=284,290,288,289, &end
#
#  chirality for residue 22 atoms:  CG CE HD2 HD3
 &rst iat=281,287,285,286, &end
#
#  chirality for residue 22 atoms:  N C HA CB
 &rst iat=274,294,277,278, &end
#
#  chirality for residue 23 atoms:  CA CG HB2 HB3
 &rst iat=298,303,301,302, &end
#
#  chirality for residue 23 atoms:  N C HA CB
 &rst iat=296,308,299,300, &end
#
#  chirality for residue 24 atoms:  N C HA2 HA3
 &rst iat=310,315,313,314, &end
#
#  chirality for residue 25 atoms:  CA CG HB2 HB3
 &rst iat=319,324,322,323, &end
#
#  chirality for residue 25 atoms:  CB CD HG2 HG3
 &rst iat=321,327,325,326, &end
#
#  chirality for residue 25 atoms:  CD NZ HE2 HE3
 &rst iat=327,333,331,332, &end
#
#  chirality for residue 25 atoms:  CG CE HD2 HD3
 &rst iat=324,330,328,329, &end
#
#  chirality for residue 25 atoms:  N C HA CB
 &rst iat=317,337,320,321, &end
#
#  chirality for residue 26 atoms:  CA SG HB2 HB3
 &rst iat=341,346,344,345, &end
#
#  chirality for residue 26 atoms:  N C HA CB
 &rst iat=339,347,342,343, &end
#
#  chirality for residue 27 atoms:  CA CG HB2 HB3
 &rst iat=351,356,354,355, &end
#
#  chirality for residue 27 atoms:  CB SD HG2 HG3
 &rst iat=353,359,357,358, &end
#
#  chirality for residue 27 atoms:  N C HA CB
 &rst iat=349,364,352,353, &end
#
#  chirality for residue 28 atoms:  CA CG HB2 HB3
 &rst iat=368,373,371,372, &end
#
#  chirality for residue 28 atoms:  N C HA CB
 &rst iat=366,378,369,370, &end
#
#  chirality for residue 29 atoms:  CA CG HB2 HB3
 &rst iat=382,387,385,386, &end
#
#  chirality for residue 29 atoms:  CB CD HG2 HG3
 &rst iat=384,390,388,389, &end
#
#  chirality for residue 29 atoms:  CG NE HD2 HD3
 &rst iat=387,393,391,392, &end
#
#  chirality for residue 29 atoms:  N C HA CB
 &rst iat=380,402,383,384, &end
#
#  chirality for residue 30 atoms:  CA CG HB2 HB3
 &rst iat=406,411,409,410, &end
#
#  chirality for residue 30 atoms:  CB CD HG2 HG3
 &rst iat=408,414,412,413, &end
#
#  chirality for residue 30 atoms:  CD NZ HE2 HE3
 &rst iat=414,420,418,419, &end
#
#  chirality for residue 30 atoms:  CG CE HD2 HD3
 &rst iat=411,417,415,416, &end
#
#  chirality for residue 30 atoms:  N C HA CB
 &rst iat=404,424,407,408, &end
#
#  chirality for residue 31 atoms:  CA SG HB2 HB3
 &rst iat=428,433,431,432, &end
#
#  chirality for residue 31 atoms:  N C HA CB
 &rst iat=426,434,429,430, &end
#
#  chirality for residue 32 atoms:  CA CG HB2 HB3
 &rst iat=438,443,441,442, &end
#
#  chirality for residue 32 atoms:  CB CD HG2 HG3
 &rst iat=440,446,444,445, &end
#
#  chirality for residue 32 atoms:  CD NZ HE2 HE3
 &rst iat=446,452,450,451, &end
#
#  chirality for residue 32 atoms:  CG CE HD2 HD3
 &rst iat=443,449,447,448, &end
#
#  chirality for residue 32 atoms:  N C HA CB
 &rst iat=436,456,439,440, &end
#
#  chirality for residue 33 atoms:  CA SG HB2 HB3
 &rst iat=460,465,463,464, &end
#
#  chirality for residue 33 atoms:  N C HA CB
 &rst iat=458,466,461,462, &end
#
#  chirality for residue 34 atoms:  CA CG HB2 HB3
 &rst iat=470,475,473,474, &end
#
#  chirality for residue 34 atoms:  N C HA CB
 &rst iat=468,487,471,472, &end
#
#  chirality for residue 35 atoms:  CA CG HB2 HB3
 &rst iat=491,496,494,495, &end
#
#  chirality for residue 35 atoms:  N C HA CB
 &rst iat=489,508,492,493, &end
#
#  chirality for residue 36 atoms:  CA SG HB2 HB3
 &rst iat=512,517,515,516, &end
#
#  chirality for residue 36 atoms:  N C HA CB
 &rst iat=510,518,513,514, &end


Please acknowledge these references in publications where the data from this site have been utilized.

Contact the webmaster for help, if required. Wednesday, May 1, 2024 7:50:17 PM GMT (wattos1)