NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype |
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588693 |
2ruu   |
11475 | cing | 1-original | 1 | AMBER | stereochemistry | chirality |
# # 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 OG HB2 HB3 &rst iat=12,17,15,16, &end # # chirality for residue 2 atoms: N C HA CB &rst iat=10,19,13,14, &end # # chirality for residue 3 atoms: CA OG HB2 HB3 &rst iat=23,28,26,27, &end # # chirality for residue 3 atoms: N C HA CB &rst iat=21,30,24,25, &end # # chirality for residue 4 atoms: N C HA2 HA3 &rst iat=32,37,35,36, &end # # chirality for residue 5 atoms: CA OG HB2 HB3 &rst iat=41,46,44,45, &end # # chirality for residue 5 atoms: N C HA CB &rst iat=39,48,42,43, &end # # chirality for residue 6 atoms: CA OG HB2 HB3 &rst iat=52,57,55,56, &end # # chirality for residue 6 atoms: N C HA CB &rst iat=50,59,53,54, &end # # chirality for residue 7 atoms: N C HA2 HA3 &rst iat=61,66,64,65, &end # # chirality for residue 8 atoms: CA CG HB2 HB3 &rst iat=70,75,73,74, &end # # chirality for residue 8 atoms: CB CD HG2 HG3 &rst iat=72,78,76,77, &end # # chirality for residue 8 atoms: CD NZ HE2 HE3 &rst iat=78,84,82,83, &end # # chirality for residue 8 atoms: CG CE HD2 HD3 &rst iat=75,81,79,80, &end # # chirality for residue 8 atoms: N C HA CB &rst iat=68,88,71,72, &end # # chirality for residue 9 atoms: CA CG HB2 HB3 &rst iat=100,94,98,99, &end # # chirality for residue 9 atoms: CB CD HG2 HG3 &rst iat=97,91,95,96, &end # # chirality for residue 9 atoms: CG N HD2 HD3 &rst iat=94,90,92,93, &end # # chirality for residue 9 atoms: N C HA CB &rst iat=90,102,101,97, &end # # chirality for residue 10 atoms: CA CG HB2 HB3 &rst iat=106,111,109,110, &end # # chirality for residue 10 atoms: N C HA CB &rst iat=104,123,107,108, &end # # chirality for residue 11 atoms: CA CG HB2 HB3 &rst iat=127,132,130,131, &end # # chirality for residue 11 atoms: CB CD HG2 HG3 &rst iat=129,135,133,134, &end # # chirality for residue 11 atoms: CD NZ HE2 HE3 &rst iat=135,141,139,140, &end # # chirality for residue 11 atoms: CG CE HD2 HD3 &rst iat=132,138,136,137, &end # # chirality for residue 11 atoms: N C HA CB &rst iat=125,145,128,129, &end # # chirality for residue 13 atoms: CA CG HB2 HB3 &rst iat=167,161,165,166, &end # # chirality for residue 13 atoms: CB CD HG2 HG3 &rst iat=164,158,162,163, &end # # chirality for residue 13 atoms: CG N HD2 HD3 &rst iat=161,157,159,160, &end # # chirality for residue 13 atoms: N C HA CB &rst iat=157,169,168,164, &end # # chirality for residue 14 atoms: CA CG HB2 HB3 &rst iat=173,178,176,177, &end # # chirality for residue 14 atoms: CB CD HG2 HG3 &rst iat=175,181,179,180, &end # # chirality for residue 14 atoms: N C HA CB &rst iat=171,186,174,175, &end # # chirality for residue 16 atoms: CA OG HB2 HB3 &rst iat=200,205,203,204, &end # # chirality for residue 16 atoms: N C HA CB &rst iat=198,207,201,202, &end # # chirality for residue 17 atoms: CA CG HB2 HB3 &rst iat=211,216,214,215, &end # # chirality for residue 17 atoms: N C HA CB &rst iat=209,228,212,213, &end # # chirality for residue 18 atoms: N C HA CB &rst iat=230,238,233,234, &end # # chirality for residue 19 atoms: CA OG HB2 HB3 &rst iat=242,247,245,246, &end # # chirality for residue 19 atoms: N C HA CB &rst iat=240,249,243,244, &end # # chirality for residue 20 atoms: N C HA CB &rst iat=251,259,254,255, &end # # chirality for residue 21 atoms: CA CG2 CG1 HB &rst iat=263,267,271,266, &end # # chirality for residue 21 atoms: CB CD1 HG12 HG13 &rst iat=265,274,272,273, &end # # chirality for residue 21 atoms: N C HA CB &rst iat=261,278,264,265, &end # # chirality for residue 22 atoms: CA CG HB2 HB3 &rst iat=282,287,285,286, &end # # chirality for residue 22 atoms: CB CD HG2 HG3 &rst iat=284,290,288,289, &end # # chirality for residue 22 atoms: CD NZ HE2 HE3 &rst iat=290,296,294,295, &end # # chirality for residue 22 atoms: CG CE HD2 HD3 &rst iat=287,293,291,292, &end # # chirality for residue 22 atoms: N C HA CB &rst iat=280,300,283,284, &end # # chirality for residue 23 atoms: N C HA CB &rst iat=302,310,305,306, &end # # chirality for residue 24 atoms: CA CG HB2 HB3 &rst iat=314,319,317,318, &end # # chirality for residue 24 atoms: N C HA CB &rst iat=312,324,315,316, &end # # chirality for residue 25 atoms: CA CG HB2 HB3 &rst iat=328,333,331,332, &end # # chirality for residue 25 atoms: CB CD1 CD2 HG &rst iat=330,335,339,334, &end # # chirality for residue 25 atoms: N C HA CB &rst iat=326,343,329,330, &end # # chirality for residue 26 atoms: CA CG HB2 HB3 &rst iat=347,352,350,351, &end # # chirality for residue 26 atoms: N C HA CB &rst iat=345,357,348,349, &end # # chirality for residue 27 atoms: CA CG1 CG2 HB &rst iat=361,365,369,364, &end # # chirality for residue 27 atoms: N C HA CB &rst iat=359,373,362,363, &end # # chirality for residue 28 atoms: CA CG HB2 HB3 &rst iat=377,382,380,381, &end # # chirality for residue 28 atoms: N C HA CB &rst iat=375,390,378,379, &end # # chirality for residue 29 atoms: CA CG HB2 HB3 &rst iat=394,399,397,398, &end # # chirality for residue 29 atoms: CB CD1 CD2 HG &rst iat=396,401,405,400, &end # # chirality for residue 29 atoms: N C HA CB &rst iat=392,409,395,396, &end # # chirality for residue 30 atoms: CA CG HB2 HB3 &rst iat=413,418,416,417, &end # # chirality for residue 30 atoms: CB CD HG2 HG3 &rst iat=415,421,419,420, &end # # chirality for residue 30 atoms: CG NE HD2 HD3 &rst iat=418,424,422,423, &end # # chirality for residue 30 atoms: N C HA CB &rst iat=411,433,414,415, &end # # chirality for residue 31 atoms: CA CG HB2 HB3 &rst iat=437,442,440,441, &end # # chirality for residue 31 atoms: CB CD HG2 HG3 &rst iat=439,445,443,444, &end # # chirality for residue 31 atoms: CD NZ HE2 HE3 &rst iat=445,451,449,450, &end # # chirality for residue 31 atoms: CG CE HD2 HD3 &rst iat=442,448,446,447, &end # # chirality for residue 31 atoms: N C HA CB &rst iat=435,455,438,439, &end # # chirality for residue 32 atoms: CA CG HB2 HB3 &rst iat=459,464,462,463, &end # # chirality for residue 32 atoms: N C HA CB &rst iat=457,472,460,461, &end # # chirality for residue 33 atoms: CA CG2 OG1 HB &rst iat=476,480,484,479, &end # # chirality for residue 33 atoms: N C HA CB &rst iat=474,486,477,478, &end # # chirality for residue 34 atoms: N C HA2 HA3 &rst iat=488,493,491,492, &end # # chirality for residue 35 atoms: CA CG HB2 HB3 &rst iat=497,502,500,501, &end # # chirality for residue 35 atoms: CB CD HG2 HG3 &rst iat=499,505,503,504, &end # # chirality for residue 35 atoms: N C HA CB &rst iat=495,508,498,499, &end # # chirality for residue 36 atoms: CA CG HB2 HB3 &rst iat=512,517,515,516, &end # # chirality for residue 36 atoms: CB CD HG2 HG3 &rst iat=514,520,518,519, &end # # chirality for residue 36 atoms: CD NZ HE2 HE3 &rst iat=520,526,524,525, &end # # chirality for residue 36 atoms: CG CE HD2 HD3 &rst iat=517,523,521,522, &end # # chirality for residue 36 atoms: N C HA CB &rst iat=510,530,513,514, &end
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