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 subsubtype
491288 2hlt cing 1-original 3 AMBER distance hydrogen bond simple



#
# 4 TYR HN 46 ALA O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat=  57, 770, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50, 
      rk2=40.0, rk3=40.0, ir6=1, ialtd=0,
 &end
#
# 5 ARG+ HN 75 THR O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat=  78,1192, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 6 ILE HN 44 ILE O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 102, 741, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 7 ILE HN 73 SER O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 121,1162, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 8 VAL HN 42 VAL O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 140, 707, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 11 ARG+ HN 68 LYS+ O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 175,1090, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 43 GLU- HN 35 LYS+ O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 709, 598, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 21 VAL HN 17 PHE O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 347, 280, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 22 GLN HN 18 ARG+ O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 363, 304, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 23 MET HN 19 TYR O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 380, 325, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 24 GLU- HN 20 PHE O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 397, 345, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 25 ALA HN 21 VAL O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 412, 361, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 26 ASP- HN 22 GLN O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 422, 378, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 27 LYS+ HN 23 MET O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 434, 395, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 33 TRP HN 45 LEU O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 538, 760, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 35 LYS+ HN 43 GLU- O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 578, 722, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 34 VAL HN 87 SER O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 562,1383, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 37 ARG+ HN 41 ARG+ O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 614, 691, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 42 VAL HN 8 VAL O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 693, 154, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 43 GLU- HN 35 LYS+ O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 709, 598, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 44 ILE HN 6 ILE O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 724, 119, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 45 LEU HN 33 TRP O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 743, 560, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 46 ALA HN 4 TYR O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 762,  76, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 47 GLU- HN 31 ALA O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 772, 529, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 48 GLY HN 2 LEU O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 787,  38, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 53 LEU HN 49 PRO O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 847, 806, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 54 GLN HN 50 GLU- O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 866, 821, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 55 SER HN 51 ASN O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 883, 835, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 56 PHE HN 52 ALA O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 894, 845, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 57 VAL HN 53 LEU O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 914, 864, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 58 GLU- HN 54 GLN O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 930, 881, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 59 ALA HN 55 SER O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 945, 892, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 60 VAL HN 56 PHE O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 955, 912, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 61 LYS+ HN 57 VAL O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat= 971, 928, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 68 LYS+ HN 11 ARG+ O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat=1070, 197, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 70 THR HN 9 ASP- O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat=1108, 166, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 73 SER HN 7 ILE O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat=1153, 138, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 75 THR HN 5 ARG+ O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat=1180, 100, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 87 SER HN 32 GLY O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat=1374, 536, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 89 VAL HN 34 VAL O 1.8 2.0
 &rst
  ixpk= 0, nxpk= 0, iat=1404, 576, r1= 1.30, r2= 1.80, r3= 2.00, r4= 2.50,  &end
#
# 4 TYR N 46 ALA O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat=  56, 770, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 5 ARG+ N 75 THR O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat=  77,1192, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 6 ILE N 44 ILE O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 101, 741, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 7 ILE N 73 SER O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 120,1162, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 8 VAL N 42 VAL O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 139, 707, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 11 ARG+ N 68 LYS+ O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 174,1090, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 43 GLU- N 35 LYS+ O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 708, 598, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 21 VAL N 17 PHE O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 346, 280, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 22 GLN N 18 ARG+ O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 362, 304, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 23 MET N 19 TYR O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 379, 325, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 24 GLU- N 20 PHE O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 396, 345, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 25 ALA N 21 VAL O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 411, 361, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 26 ASP- N 22 GLN O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 421, 378, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 27 LYS+ N 23 MET O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 433, 395, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 33 TRP N 45 LEU O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 537, 760, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 35 LYS+ N 43 GLU- O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 577, 722, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 34 VAL N 87 SER O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 561,1383, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 37 ARG+ N 41 ARG+ O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 613, 691, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 42 VAL N 8 VAL O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 692, 154, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 43 GLU- N 35 LYS+ O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 708, 598, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 44 ILE N 6 ILE O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 723, 119, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 45 LEU N 33 TRP O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 742, 560, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 46 ALA N 4 TYR O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 761,  76, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 47 GLU- N 31 ALA O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 771, 529, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 48 GLY N 2 LEU O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 786,  38, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 53 LEU N 49 PRO O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 846, 806, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 54 GLN N 50 GLU- O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 865, 821, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 55 SER N 51 ASN O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 882, 835, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 56 PHE N 52 ALA O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 893, 845, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 57 VAL N 53 LEU O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 913, 864, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 58 GLU- N 54 GLN O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 929, 881, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 59 ALA N 55 SER O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 944, 892, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 60 VAL N 56 PHE O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 954, 912, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 61 LYS+ N 57 VAL O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat= 970, 928, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 68 LYS+ N 11 ARG+ O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat=1069, 197, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 70 THR N 9 ASP- O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat=1107, 166, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 73 SER N 7 ILE O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat=1152, 138, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 75 THR N 5 ARG+ O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat=1179, 100, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 87 SER N 32 GLY O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat=1373, 536, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 89 VAL N 34 VAL O 1.8 3.0
 &rst
  ixpk= 0, nxpk= 0, iat=1403, 576, r1= 1.30, r2= 1.80, r3= 3.00, r4= 3.50,  &end
#
# 14 GLY HN 92 PBS O3 1.8 2.3
 &rst
  ixpk= 0, nxpk= 0, iat=232, 1454, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80,  
  rk2=40.0, rk3=40.0, ir6=1, ialtd=0,
  &end
#
# 14 GLY N 92 PBS O3 1.8 3.3
 &rst
  ixpk= 0, nxpk= 0, iat=231, 1454, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 15 VAL HN 92 PBS QO 2.3
 &rst
  ixpk= 0, nxpk= 0, iat= 239,  -1, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,
 igr2=1452,1456,1454,1455,
 &end
#
# 15 VAL  N 92 PBS QO 3.3
 &rst
  ixpk= 0, nxpk= 0, iat= 238,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2=1452,1456,1454,1455,
 &end
#
# 16 GLY HN 92 PBS QO 2.3
 &rst
  ixpk= 0, nxpk= 0, iat= 255, -1, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,
 igr2=1452,1456,1454,1455,
 &end
#
# 16 GLY  N 92 PBS QO 3.3
 &rst
  ixpk= 0, nxpk= 0, iat= 254,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2=1452,1456,1454,1455,
 &end
#
# 17 PHE HN 92 PBS O1 2.3
 &rst
  ixpk= 0, nxpk= 0, iat= 262,1452, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80,  &end
#
# 17 PHE  N 92 PBS O1 3.3 
 &rst
  ixpk= 0, nxpk= 0, iat= 261,1452, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 18 ARG HN 92 PBS O2 2.3
 &rst
  ixpk= 0, nxpk= 0, iat= 282,1456, r1= 1.30, r2= 1.80, r3= 2.30, r4= 2.80,  &end
#
# 18 ARG  N 92 PBS O2 3.3
 &rst
  ixpk= 0, nxpk= 0, iat= 281,1456, r1= 1.30, r2= 1.80, r3= 3.30, r4= 3.80,  &end
#
# 18 ARG HE 92 PBS QO 2.3
 &rst
  ixpk= 0, nxpk= 0, iat= 295,  -1, r1= 1.30, r2= 1.80, r3= 2.90, r4= 3.40,
 igr2=1452,1456,1454,1455,
 &end
#
# 18 ARG NE 92 PBS QO 3.3
 &rst
  ixpk= 0, nxpk= 0, iat= 294,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2=1452,1456,1454,1455,
 &end
#
# 36 ASN QD2 92 PBS QO 2.3
 &rst
  ixpk= 0, nxpk= 0, iat=  -1,  -1, r1= 1.30, r2= 1.80, r3= 3.25, r4= 3.75,
 igr1= 609, 610,
 igr2=1452,1456,1454,1455,
 &end
#
# 36 ASN ND2 92 PBS QO 3.3
 &rst
  ixpk= 0, nxpk= 0, iat= 608,  -1, r1= 1.30, r2= 1.80, r3= 4.16, r4= 4.66,
 igr2=1452,1456,1454,1455,
 &end



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