NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type | subtype | subsubtype |
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6313 |
1isk   |
cing | 1-original | 8 | DYANA/DIANA | distance | NOE | simple |
# HA(i)-HN(i+1) 34 ALA HA 35 THR HN 2.70 1.00e+00 # HA(i)-HN(i+1) 334 ALA HA 335 THR HN 2.70 1.00e+00 35 THR HA 36 VAL HN 2.70 1.00e+00 # HA(i)-HN(i+1) 335 THR HA 336 VAL HN 2.70 1.00e+00 36 VAL HA 37 GLU HN 2.70 1.00e+00 # HA(i)-HN(i+1) 336 VAL HA 337 GLU HN 2.70 1.00e+00 37 GLU HA 38 ASP HN 2.70 1.00e+00 # HA(i)-HN(i+1) 337 GLU HA 338 ASP HN 2.70 1.00e+00 38 ASP HA 39 PRO HA 2.70 1.00e+00 # HA-HA cis-pro 338 ASP HA 339 PRO HA 2.70 1.00e+00 43 GLU HA 44 PRO HD2 2.70 1.00e+00 # HA-HDpro 343 GLU HA 344 PRO HD2 2.70 1.00e+00 43 GLU HA 44 PRO HD3 2.70 1.00e+00 # HA-HDpro 343 GLU HA 344 PRO HD3 2.70 1.00e+00 44 PRO HA 45 ARG HN 2.70 1.00e+00 # HA(i)-HN(i+1) 344 PRO HA 345 ARG HN 2.70 1.00e+00 45 ARG HA 46 SER HN 2.70 1.00e+00 # HA(i)-HN(i+1) 345 ARG HA 346 SER HN 2.70 1.00e+00 46 SER HA 47 GLY HN 2.70 1.00e+00 # HA(i)-HN(i+1) 346 SER HA 347 GLY HN 2.70 1.00e+00 47 GLY HA1 48 THR HN 2.70 1.00e+00 # HA(i)-HN(i+1) 347 GLY HA1 348 THR HN 2.70 1.00e+00 # HA-HA XSHEET 33 ASP HA 47 GLY HA1 5.00 1.00e+00 # XSHEET STRAND1-2 333 ASP HA 347 GLY HA1 5.00 1.00e+00 35 THR HA 46 SER HA 2.70 1.00e+00 # XSHEET STRAND1-2 335 THR HA 346 SER HA 2.70 1.00e+00 37 GLU HA 44 PRO HA 2.70 1.00e+00 # XSHEET STRAND1-2 337 GLU HA 344 PRO HA 2.70 1.00e+00 # HN-HN XSHEET 36 VAL HN 45 ARG HN 3.30 1.00e+00 # XSHEET STRAND1-2 336 VAL HN 345 ARG HN 3.30 1.00e+00 # HA-HN XSHEET 33 ASP HA 48 THR HN 5.00 1.00e+00 # XSHEET STRAND1-2 333 ASP HA 348 THR HN 5.00 1.00e+00 35 THR HA 47 GLY HN 5.00 1.00e+00 # XSHEET STRAND1-2 335 THR HA 347 GLY HN 5.00 1.00e+00 36 VAL HN 46 SER HA 5.00 1.00e+00 # XSHEET STRAND1-2 336 VAL HN 346 SER HA 5.00 1.00e+00 37 GLU HA 45 ARG HN 5.00 1.00e+00 # XSHEET STRAND1-2 337 GLU HA 345 ARG HN 5.00 1.00e+00 38 ASP HN 44 PRO HA 5.00 1.00e+00 # XSHEET STRAND1-2 338 ASP HN 344 PRO HA 5.00 1.00e+00 # OTHER NOES INVOLVING SHEET1 # ALA-31 31 ALA HA 32 ASP HN 2.70 1.00e+00 # SEQUENTIAL 331 ALA HA 332 ASP HN 2.70 1.00e+00 31 ALA QB 32 ASP HN 3.20 1.00e+00 # SEQUENTIAL 331 ALA QB 332 ASP HN 3.20 1.00e+00 31 ALA HN 109 VAL QG2 5.50 1.00e+00 # 331 ALA HN 409 VAL QG2 5.50 1.00e+00 31 ALA HN 109 VAL HB 5.00 1.00e+00 # 331 ALA HN 409 VAL HB 5.00 1.00e+00 31 ALA HN 110 VAL HA 5.00 1.00e+00 # 331 ALA HN 410 VAL HA 5.00 1.00e+00 31 ALA HN 34 ALA QB 3.80 1.00e+00 # 331 ALA HN 334 ALA QB 3.80 1.00e+00 31 ALA QB 33 ASP HN 3.20 1.00e+00 331 ALA QB 333 ASP HN 3.20 1.00e+00 31 ALA QB 34 ALA QB 3.70 1.00e+00 # 331 ALA QB 334 ALA QB 3.70 1.00e+00 31 ALA QB 34 ALA HN 3.80 1.00e+00 # 331 ALA QB 334 ALA HN 3.80 1.00e+00 31 ALA QB 110 VAL HA 5.50 1.00e+00 # 331 ALA QB 410 VAL HA 5.50 1.00e+00 31 ALA QB 110 VAL QG2 4.30 1.00e+00 # 331 ALA QB 410 VAL QG2 4.30 1.00e+00 31 ALA QB 110 VAL QG1 6.00 1.00e+00 # 331 ALA QB 410 VAL QG1 6.00 1.00e+00 # Asp-32 32 ASP HN 33 ASP HN 2.70 1.00e+00 332 ASP HN 333 ASP HN 2.70 1.00e+00 32 ASP HA 48 THR QG2 3.80 1.00e+00 # 332 ASP HA 348 THR QG2 3.80 1.00e+00 32 ASP HA 48 THR HN 5.00 1.00e+00 # 332 ASP HA 348 THR HN 5.00 1.00e+00 # ASP-33 33 ASP HN 34 ALA HN 2.70 1.00e+00 # SEQUENTIAL 333 ASP HN 334 ALA HN 2.70 1.00e+00 33 ASP HA 47 GLY HN 5.00 1.00e+00 # 333 ASP HA 347 GLY HN 5.00 1.00e+00 33 ASP HN 110 VAL QG1 5.50 1.00e+00 # 333 ASP HN 410 VAL QG1 5.50 1.00e+00 33 ASP HN 110 VAL QG2 5.50 1.00e+00 # 333 ASP HN 410 VAL QG2 5.50 1.00e+00 # ALA-34 34 ALA QB 51 ILE QD1 4.30 1.00e+00 # 334 ALA QB 351 ILE QD1 4.30 1.00e+00 34 ALA QB 112 MET QE 6.00 1.00e+00 # 334 ALA QB 412 MET QE 6.00 1.00e+00 34 ALA HA 110 VAL QG1 4.20 1.00e+00 # XSHEET 334 ALA HA 410 VAL QG1 4.20 1.00e+00 34 ALA QB 110 VAL HA 3.80 1.00e+00 # XSHEET 334 ALA QB 410 VAL HA 3.80 1.00e+00 34 ALA QB 109 VAL QG1 6.00 1.00e+00 # XSHEET 334 ALA QB 409 VAL QG1 6.00 1.00e+00 34 ALA HN 51 ILE QD1 5.50 1.00e+00 # 334 ALA HN 351 ILE QD1 5.50 1.00e+00 # THR-35 35 THR HA 51 ILE QD1 5.50 1.00e+00 # 335 THR HA 351 ILE QD1 5.50 1.00e+00 35 THR HB 44 PRO HB3 5.00 1.00e+00 # 335 THR HB 344 PRO HB3 5.00 1.00e+00 35 THR HB 44 PRO HB2 5.00 1.00e+00 # 335 THR HB 344 PRO HB2 5.00 1.00e+00 35 THR QG2 46 SER HB3 3.20 1.00e+00 # 335 THR QG2 346 SER HB3 3.20 1.00e+00 35 THR QG2 46 SER HB2 3.20 1.00e+00 # 335 THR QG2 346 SER HB2 3.20 1.00e+00 35 THR QG2 47 GLY HN 5.50 1.00e+00 # 335 THR QG2 347 GLY HN 5.50 1.00e+00 # VAL-36 36 VAL QG1 38 ASP QB 6.30 1.00e+00 # 336 VAL QG1 338 ASP QB 6.30 1.00e+00 36 VAL QG1 54 PHE QR 7.80 1.00e+00 # 336 VAL QG1 354 PHE QR 7.80 1.00e+00 36 VAL QG1 55 TYR HE2 5.50 1.00e+00 # 336 VAL QG1 355 TYR HE2 5.50 1.00e+00 36 VAL QG1 37 GLU HN 3.20 1.00e+00 # 336 VAL QG1 337 GLU HN 3.20 1.00e+00 36 VAL QG2 36 VAL HN 3.20 1.00e+00 # 336 VAL QG2 336 VAL HN 3.20 1.00e+00 36 VAL QG2 55 TYR HE2 5.50 1.00e+00 # 336 VAL QG2 355 TYR HE2 5.50 1.00e+00 36 VAL QG2 51 ILE HA 3.80 1.00e+00 # 336 VAL QG2 351 ILE HA 3.80 1.00e+00 36 VAL QG2 51 ILE QD1 3.70 1.00e+00 # 336 VAL QG2 351 ILE QD1 3.70 1.00e+00 36 VAL QG2 112 MET QG 4.60 1.00e+00 # 336 VAL QG2 412 MET QG 4.60 1.00e+00 # GLU-37 #-----LOOP (Asp38-Pro44)------ #ASP-38 38 ASP HA 114 ALA QB 3.80 1.00e+00 # XSHEET 338 ASP HA 414 ALA QB 3.80 1.00e+00 38 ASP HB3 54 PHE QR 7.30 1.00e+00 # 338 ASP HB3 354 PHE QR 7.30 1.00e+00 #PRO-39 39 PRO HB2 40 VAL HN 3.30 1.00e+00 # SEQUENTIAL 339 PRO HB2 340 VAL HN 3.30 1.00e+00 39 PRO HG2 40 VAL HN 3.30 1.00e+00 # SEQUENTIAL 339 PRO HG2 340 VAL HN 3.30 1.00e+00 39 PRO HA 114 ALA QB 3.80 1.00e+00 # XSHEET 339 PRO HA 414 ALA QB 3.80 1.00e+00 39 PRO HA 116 PHE QR 7.30 1.00e+00 # 339 PRO HA 416 PHE QR 7.30 1.00e+00 39 PRO HB3 116 PHE QR 7.30 1.00e+00 # 339 PRO HB3 416 PHE QR 7.30 1.00e+00 #VAL-40 40 VAL HA 41 GLY HN 2.70 1.00e+00 # SEQUENTIAL 340 VAL HA 341 GLY HN 2.70 1.00e+00 40 VAL HN 40 VAL QG2 3.20 1.00e+00 # INTRARESIDUE 340 VAL HN 340 VAL QG2 3.20 1.00e+00 40 VAL QG2 115 LEU HA 5.50 1.00e+00 # XSHEET 340 VAL QG2 415 LEU HA 5.50 1.00e+00 40 VAL QG2 115 LEU HG 3.80 1.00e+00 # XSHEET 340 VAL QG2 415 LEU HG 3.80 1.00e+00 40 VAL QG2 115 LEU QD2 6.00 1.00e+00 # XSHEET 340 VAL QG2 415 LEU QD2 6.00 1.00e+00 40 VAL QG2 116 PHE HN 5.50 1.00e+00 # XSHEET (M-W) 340 VAL QG2 416 PHE HN 5.50 1.00e+00 40 VAL QG2 114 ALA HN 5.50 1.00e+00 # 340 VAL QG2 414 ALA HN 5.50 1.00e+00 40 VAL QG1 41 GLY HN 3.20 1.00e+00 # 340 VAL QG1 341 GLY HN 3.20 1.00e+00 #GLY-41 41 GLY HN 42 SER HN 2.70 1.00e+00 # SEQUENTIAL 341 GLY HN 342 SER HN 2.70 1.00e+00 #SER-42 42 SER HA 43 GLU HN 2.70 1.00e+00 # SEQUENTIAL 342 SER HA 343 GLU HN 2.70 1.00e+00 #GLU-43 43 GLU HN 44 PRO HD3 2.70 1.00e+00 # SEQUENTIAL 343 GLU HN 344 PRO HD3 2.70 1.00e+00 # PRO-44 44 PRO HB2 45 ARG HN 3.30 1.00e+00 # SEQUENTIAL 344 PRO HB2 345 ARG HN 3.30 1.00e+00 #-------Second Strand------- # ARG-45 45 ARG QB 50 ALA QB 4.60 1.00e+00 # 345 ARG QB 350 ALA QB 4.60 1.00e+00 45 ARG HA 50 ALA QB 5.50 1.00e+00 # 345 ARG HA 350 ALA QB 5.50 1.00e+00 # SER-46 46 SER HA 51 ILE QD1 5.50 1.00e+00 # 346 SER HA 351 ILE QD1 5.50 1.00e+00 46 SER HA 51 ILE QG1 5.80 1.00e+00 # 346 SER HA 351 ILE QG1 5.80 1.00e+00 46 SER HN 50 ALA QB 3.80 1.00e+00 # 346 SER HN 350 ALA QB 3.80 1.00e+00 # GLY-47 47 GLY HN 51 ILE QD1 3.80 1.00e+00 # 347 GLY HN 351 ILE QD1 3.80 1.00e+00 47 GLY HN 51 ILE QG1 4.10 1.00e+00 # 347 GLY HN 351 ILE QG1 4.10 1.00e+00
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