NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type | subtype | subsubtype |
2137 | 1bfy | 4182 | cing | 1-original | 3 | DYANA/DIANA | distance | NOE | simple |
1 MET HA 1 MET HB2 3.40 # 19020.0 HA 1 MET HB3 3.00 # 40500.0 HA 1 MET HG2 2.90 <# 26930.0 HA 1 MET HG3 3.70 ># 6540.0 HA 2 LYS+ HN 3.50 # 18060.0 HA 2 LYS+ HG2 5.40 # 649.0 HA 2 LYS+ HG3 4.80 # 1216.0 HB2 1 MET HG2 3.20 # 14430.0 HB2 1 MET HG3 2.80 # 36590.0 HB2 2 LYS+ HN 4.20 ># 6111.0 HB2 2 LYS+ HA 6.00 # 319.0 HB2 15 PRO HB2 3.20 # 14180.0 HB2 15 PRO HB3 4.00 # 3772.0 HB2 16 GLU- HN 6.00 # 146.0 HB2 16 GLU- HG2 6.00 # .0 HB2 16 GLU- HG3 6.00 # .0 HB2 29 ASP- HA 4.80 ># 1318.0 HB2 30 PHE HN 6.00 ># 180.0 HB3 1 MET HG2 2.80 # 36260.0 HB3 1 MET HG3 3.40 # 9674.0 HB3 2 LYS+ HN 3.30 <# 22780.0 HB3 15 PRO HB2 3.50 # 8020.0 HB3 15 PRO HB3 3.60 # 7446.0 HB3 15 PRO HD3 5.00 # 953.0 HB3 29 ASP- HA 4.10 <# 3486.0 HB3 30 PHE HN 4.70 <# 1370.0 HG2 2 LYS+ HN 4.30 # 2467.0 HG3 2 LYS+ HN 4.90 # 1128.0 HG3 15 PRO HB2 5.40 # 608.0 HG3 15 PRO HG2 5.60 # 486.0 HG3 15 PRO HG3 5.00 # 999.0 2 LYS+ HN 2 LYS+ HA 3.40 # 19350.0 HN 2 LYS+ QB 3.80 # 31040.0 HN 2 LYS+ HG2 3.30 # 11420.0 HN 2 LYS+ HG3 3.30 # 12930.0 HN 2 LYS+ QD 5.10 # 3397.5 HN 2 LYS+ QE 6.30 # 734.5 HN 3 LYS+ HN 4.60 # 3495.0 HN 4 TYR QD 8.00 # 252.0 HN 4 TYR QE 7.00 # 972.5 HN 15 PRO HG3 4.60 # 1634.0 HA 2 LYS+ QB 4.20 # 29130.0 HA 2 LYS+ HG2 3.00 <# 20380.0 HA 2 LYS+ HG3 3.60 ># 7888.0 HA 2 LYS+ QD 4.50 # 8410.0 HA 2 LYS+ QE 6.00 # 970.0 HA 3 LYS+ HN 2.50 # 120800.0 QB 2 LYS+ HG2 3.50 # 67900.0 QB 2 LYS+ HG3 3.60 # 53000.0 QB 2 LYS+ QD 5.20 # 13672.5 QB 2 LYS+ QE 6.50 # 1827.5 QB 3 LYS+ HN 4.50 # 16975.0 QB 4 TYR QD 7.70 # 1461.5 QB 4 TYR QE 6.50 # 8882.5 QB 51 GLU- HA 5.70 # 1411.5 QB 52 VAL HN 4.80 # 5575.0 HG2 2 LYS+ QD 3.90 # 30185.0 HG2 2 LYS+ QE 4.50 # 8920.0 HG2 3 LYS+ HN 4.30 # 2515.0 HG2 4 TYR QE 7.50 # 533.0 HG2 53 GLU- HA 6.00 # 134.0 HG3 2 LYS+ QD 3.70 # 39335.0 HG3 2 LYS+ QE 4.40 # 10825.0 HG3 4 TYR QD 8.00 # 179.0 HG3 4 TYR QE 7.30 # 692.0 QD 2 LYS+ QE 5.20 # 15740.0 QD 3 LYS+ HN 4.60 # 7005.0 QD 4 TYR QE 8.50 # 531.8 QD 53 GLU- HA 7.00 # 200.5 QE 4 TYR QD 9.00 # 160.5 QE 4 TYR QE 8.70 # 440.5 QE 53 GLU- HA 7.00 # 318.5 3 LYS+ HN 3 LYS+ HA 3.40 # 22470.0 HN 3 LYS+ HB2 2.90 <# 49460.0 HN 3 LYS+ HB3 3.50 ># 16680.0 HN 3 LYS+ HG2 3.50 ># 7997.0 HN 3 LYS+ HG3 2.70 <# 39740.0 HN 3 LYS+ QD 4.60 # 6960.0 HN 3 LYS+ QE 6.20 # 807.0 HN 4 TYR HA 6.00 # 428.0 HN 4 TYR QD 7.70 # 456.5 HN 4 TYR QE 7.70 # 457.0 HN 15 PRO HD2 4.80 # 1318.0 HN 15 PRO HD3 4.40 # 2194.0 HN 52 VAL HN 4.00 # 3941.0 HN 52 VAL HB 3.70 # 5791.0 HA 3 LYS+ HB2 3.40 # 21840.0 HA 3 LYS+ HB3 3.10 # 33768.0 HA 3 LYS+ HG2 2.70 # 38960.0 HA 3 LYS+ HG3 3.10 # 16610.0 HA 3 LYS+ QD 4.70 # 6280.0 HA 3 LYS+ QE 5.80 # 1275.0 HA 4 TYR HN 3.00 # 45320.0 HA 4 TYR HB2 5.60 # 1025.0 HA 4 TYR QD 6.10 # 3535.0 HA 4 TYR QE 7.40 # 633.0 HA 12 ILE QG2 6.00 # 1720.0 HA 15 PRO HG2 5.00 ># 957.0 HA 15 PRO HG3 4.30 <# 2403.0 HA 15 PRO HD2 3.40 # 11180.0 HA 15 PRO HD3 3.10 # 16830.0 HA 52 VAL HB 5.00 # 934.0 HA 52 VAL QG2 6.70 # 823.0 HB2 3 LYS+ HG2 3.10 # 19820.0 HB2 3 LYS+ HG3 2.60 # 49290.0 HB2 3 LYS+ QD 3.60 # 47490.0 HB2 3 LYS+ QE 4.50 <# 8910.0 HB2 4 TYR HN 3.80 # 10060.0 HB2 12 ILE QG2 4.50 ># 9992.0 HB2 14 ASN HA 5.20 ># 803.0 HB2 15 PRO HD2 5.70 # 468.0 HB2 52 VAL HN 3.70 <# 5926.0 HB2 52 VAL HB 2.80 <# 33760.0 HB2 52 VAL QG1 4.00 # 17880.0 HB2 52 VAL QG2 4.20 # 14610.0 HB3 3 LYS+ HG2 2.60 # 49380.0 HB3 3 LYS+ HG3 3.10 # 18600.0 HB3 3 LYS+ QD 3.90 # 30310.0 HB3 3 LYS+ QE 6.60 ># 497.0 HB3 4 TYR HN 3.40 # 19000.0 HB3 12 ILE QG2 3.50 <# 41576.0 HB3 12 ILE QD1 6.20 # 1384.0 HB3 14 ASN HA 3.60 <# 7108.0 HB3 15 PRO HD2 4.80 # 1345.0 HB3 15 PRO HD3 4.80 # 1269.0 HB3 52 VAL HN 4.70 ># 1427.0 HB3 52 VAL HB 3.50 ># 8869.0 HB3 52 VAL QG1 6.30 # 1253.0 HB3 52 VAL QG2 4.40 # 11350.0 HG2 3 LYS+ QD 3.90 # 25165.0 HG2 3 LYS+ QE 4.30 # 11705.0 HG2 4 TYR HN 4.50 # 1854.0 HG2 12 ILE QG2 5.00 # 4712.0 HG2 14 ASN HA 2.50 <# 62170.0 HG2 14 ASN HB2 4.10 # 3474.0 HG2 14 ASN HD21 5.70 # 437.0 HG2 14 ASN HD22 5.80 # 423.0 HG2 15 PRO HG3 5.30 # 680.0 HG2 15 PRO HD2 2.80 # 33740.0 HG2 15 PRO HD3 3.00 # 22100.0 HG2 52 VAL HB 4.90 # 1091.0 HG3 3 LYS+ QD 3.80 # 35895.0 HG3 3 LYS+ QE 4.40 # 9940.0 HG3 4 TYR HN 4.80 # 1216.0 HG3 14 ASN HA 3.80 ># 5601.0 HG3 15 PRO HD2 3.30 # 12690.0 HG3 15 PRO HD3 4.00 # 3958.0 QD 3 LYS+ QE 5.10 # 18162.5 QD 4 TYR HN 5.80 # 1249.5 QD 12 ILE QG2 5.30 # 12200.0 QD 12 ILE QG1 7.70 # 454.0 QD 14 ASN HA 5.30 # 2526.0 QD 14 ASN HB2 5.20 # 2896.0 QD 14 ASN HD21 6.20 # 822.5 QD 14 ASN HD22 6.20 # 785.0 QD 15 PRO HD2 5.60 <# 1559.5 QD 15 PRO HD3 6.40 ># 590.5 QD 52 VAL HB 4.90 # 4755.5 QE 12 ILE QG2 6.70 # 2273.5 QE 14 ASN HB2 5.00 # 3904.5 QE 14 ASN HD21 5.10 # 3499.0 4 TYR HN 4 TYR HA 3.30 # 26216.0 HN 4 TYR HB2 3.10 <# 36768.0 HN 4 TYR HB3 5.00 ># 1936.0 HN 4 TYR QD 5.80 # 5020.0 HN 4 TYR QE 6.20 # 741.0 HN 12 ILE QG2 5.70 # 2144.0 HN 13 TYR HN 3.20 # 15752.0 HN 13 TYR QB 4.60 # 7012.0 HN 13 TYR QD 7.00 # 976.0 HN 14 ASN HA 3.90 # 4456.0 HN 15 PRO HD2 6.00 # .0 HN 15 PRO HD3 3.90 # 4288.0 HN 30 PHE QD 8.00 # 228.0 HN 52 VAL HN 6.00 # .0 HN 52 VAL HB 3.30 # 12780.0 HN 52 VAL QG1 5.90 ># 1783.0 HN 52 VAL QG2 4.60 <# 7909.0 HA 4 TYR HB2 3.10 # 35936.0 HA 4 TYR HB3 2.90 # 50408.0 HA 4 TYR QD 4.60 # 7204.0 HA 4 TYR QE 6.00 # 648.0 HA 5 THR HN 2.60 # 96160.0 HA 50 GLU- HN 6.00 # .0 HA 51 GLU- HN 6.00 # 291.0 HA 51 GLU- HA 2.40 # 96960.0 HA 51 GLU- QB 6.50 # 531.0 HA 51 GLU- HG2 6.00 # 247.0 HA 51 GLU- HG3 6.00 # 246.0 HA 52 VAL HN 2.60 # 50576.0 HA 52 VAL HA 6.00 # 211.0 HA 52 VAL HB 4.90 # 1192.0 HA 52 VAL QG1 6.80 ># 803.0 HA 52 VAL QG2 3.70 <# 29248.0 HB2 4 TYR QD 4.90 # 27880.0 HB2 4 TYR QE 7.30 ># 688.5 HB2 13 TYR QB 3.80 <# 30684.0 HB2 13 TYR QD 6.40 # 2125.0 HB2 13 TYR QE 8.00 # 212.0 HB2 30 PHE QD 6.00 # 3652.0 HB2 30 PHE QE 7.40 # 631.0 HB2 49 PHE HB2 3.90 # 4736.0 HB2 49 PHE QD 8.00 ># 189.0 HB3 4 TYR QD 4.70 # 44880.0 HB3 4 TYR QE 6.10 <# 3433.5 HB3 5 THR HN 3.70 # 11440.0 HB3 13 TYR QB 4.60 ># 7336.0 HB3 13 TYR QD 6.40 # 2048.0 HB3 30 PHE QD 5.50 # 8828.0 HB3 49 PHE QD 6.90 <# 1060.5 QD 4 TYR QE 6.30 # 100460.0 QD 5 THR HN 8.00 # 232.0 QD 13 TYR QB 8.10 # 922.0 QD 13 TYR QD 7.20 # 15642.0 QD 13 TYR QE 8.20 # 2726.0 QD 15 PRO HD3 8.00 # 201.5 QD 30 PHE HN 6.90 # 1126.5 QD 30 PHE HB2 4.80 <# 33760.0 QD 30 PHE HB3 5.60 ># 6920.0 QD 30 PHE QD 8.50 # 1936.0 QD 30 PHE QE 7.40 # 10010.0 QD 30 PHE HZ 5.80 # 5164.0 QD 49 PHE HB2 5.40 # 9948.0 QD 50 GLU- HN 7.30 # 732.0 QD 50 GLU- HA 5.90 # 4384.0 QD 51 GLU- HN 6.30 # 2334.0 QD 51 GLU- HA 5.40 # 10444.0 QD 51 GLU- QB 7.70 # 1415.2 QD 51 GLU- HG2 7.80 ># 383.5 QD 51 GLU- HG3 6.70 <# 1450.0 QD 52 VAL HN 6.10 # 3272.0 QE 13 TYR QE 10.00 # 15.2 QE 30 PHE HN 6.20 # 2834.5 QE 30 PHE HA 7.60 # 517.5 QE 30 PHE HB2 5.80 ># 5355.0 QE 30 PHE HB3 5.10 <# 19944.0 QE 30 PHE QD 8.30 # 2431.0 QE 30 PHE QE 7.50 # 8132.5 QE 31 LYS+ HN 6.70 # 1391.5 QE 50 GLU- HA 5.90 # 4628.0 QE 51 GLU- HN 5.90 # 4440.5 QE 51 GLU- HA 6.00 # 3601.5 QE 51 GLU- QB 6.90 # 4312.5 QE 51 GLU- HG2 5.60 # 7705.0 QE 51 GLU- HG3 5.60 # 7335.0 QE 52 VAL HN 8.00 # 144.5 5 THR HN 5 THR QG2 4.70 # 5360.0 HN 12 ILE QD1 7.00 # .0 HN 13 TYR HN 5.00 # 992.0 HN 49 PHE QD 8.00 # .0 HN 50 GLU- HN 3.10 # 19824.0 HN 50 GLU- HB3 4.30 # 2520.0 HN 51 GLU- HA 4.10 # 3528.0 HN 52 VAL HN 5.60 # 498.0 HN 52 VAL QG2 4.20 # 14616.0 HB 5 THR QG2 3.70 # 20416.0 11 TYR QB 11 TYR QD 9.00 # 205.8 QB 41 LEU HG 7.00 # 60.0 QD 11 TYR QE 7.60 # 7870.0 QD 41 LEU HG 8.00 # 151.0 QD 41 LEU QD1 9.00 ># 552.0 QD 41 LEU QD2 7.60 <# 2528.0 12 ILE HB 12 ILE QG2 3.30 # 223360.0 HB 12 ILE QG1 3.30 # 353560.0 HB 12 ILE QD1 3.90 # 16024.0 QG2 12 ILE QG1 4.30 # 64640.0 QG2 12 ILE QD1 4.30 # 47552.0 QG2 13 TYR HN 4.30 # 13272.0 QG2 13 TYR HA 7.00 # 288.0 QG2 13 TYR QB 8.00 # 500.0 QG2 14 ASN HN 5.30 # 3296.0 QG2 14 ASN HA 5.80 # 2081.0 QG2 14 ASN HB2 4.40 <# 11064.0 QG2 14 ASN HB3 6.00 ># 1673.0 QG2 14 ASN HD21 6.50 # 969.0 QG2 14 ASN HD22 7.00 # 408.0 QG2 52 VAL QG2 4.50 # 45936.0 QG1 12 ILE QD1 5.10 # 11116.0 QD1 13 TYR HN 7.00 # 53.0 QD1 52 VAL QG2 5.20 # 15144.0 13 TYR HN 13 TYR HA 6.00 # 177.0 HN 13 TYR QB 4.10 # 16424.0 HA 13 TYR QB 4.00 # 40960.0 HA 13 TYR QD 5.60 # 1664.0 HA 13 TYR QE 6.60 # 25.5 HA 14 ASN HN 3.40 # 20610.0 HA 14 ASN HB3 6.00 # 482.0 QB 13 TYR QD 6.10 # 17758.0 QB 30 PHE QD 7.60 # 1616.0 QB 37 TRP HH2 6.30 # 674.5 QD 13 TYR QE 7.70 # 5746.0 QD 13 TYR HH 5.50 # 8300.0 QD 14 ASN HN 7.60 # 506.5 QD 19 ASP- QB 9.00 # 192.5 QD 30 PHE HN 8.00 # 293.0 QD 30 PHE HB2 5.40 <# 10120.0 QD 30 PHE HB3 7.70 ># 455.5 QD 30 PHE QD 8.20 # 2940.0 QD 30 PHE QE 8.30 # 2384.0 QD 30 PHE HZ 5.30 # 13355.0 QE 13 TYR HH 4.70 # 39310.0 QE 15 PRO HA 5.00 # 20490.0 QE 15 PRO HB2 6.80 ># 1226.5 QE 15 PRO HB3 5.30 <# 12950.0 QE 15 PRO HG3 5.70 # 6430.0 QE 18 GLY HN 8.00 # 85.5 QE 18 GLY HA1 5.10 <# 17845.0 QE 18 GLY HA2 6.10 ># 3286.5 QE 19 ASP- HN 7.80 # 384.0 QE 19 ASP- QB 7.40 # 2100.8 QE 24 VAL QG1 6.50 # 9100.0 QE 28 THR HB 6.60 # 1606.0 QE 30 PHE HN 5.90 # 4482.5 QE 30 PHE HA 6.50 # 1824.5 QE 30 PHE HB2 6.80 # 1276.0 QE 30 PHE QD 9.40 # 652.8 QE 33 ILE HG13 8.00 # 120.0 QE 33 ILE QD1 7.60 # 2574.5 HH 15 PRO HA 2.50 # 67570.0 HH 15 PRO HB2 4.70 ># 1464.0 HH 15 PRO HB3 3.40 <# 10970.0 HH 18 GLY HN 4.40 # 2222.0 HH 18 GLY HA1 3.20 <# 14180.0 HH 18 GLY HA2 4.40 ># 2296.0 HH 19 ASP- HN 6.00 # 330.0 HH 24 VAL QG1 4.00 # 18660.0 HH 26 PRO HA 5.50 # 537.0 HH 27 GLY HN 5.70 # 430.0 HH 28 THR HN 3.10 # 17720.0 HH 28 THR HA 4.50 # 1925.0 HH 28 THR HB 2.40 # 97570.0 HH 28 THR QG2 4.60 # 8572.0 HH 28 THR HG1 4.70 # 1355.0 HH 29 ASP- HN 4.80 # 1271.0 HH 29 ASP- HA 4.50 # 1912.0 HH 30 PHE HN 4.50 # 2008.0 HH 30 PHE HA 4.40 # 2153.0 HH 30 PHE HB2 6.00 # 233.0 HH 30 PHE QD 6.70 # 1481.0 HH 33 ILE QG2 6.70 # 836.0 HH 33 ILE HG12 4.80 ># 1333.0 HH 33 ILE HG13 3.90 <# 4518.0 HH 33 ILE QD1 4.80 # 5971.0 14 ASN HN 14 ASN HA 3.80 # 10870.0 HN 14 ASN HB2 3.20 # 32624.0 HN 14 ASN HB3 2.70 # 77560.0 HN 14 ASN HD21 5.60 # 486.0 HN 15 PRO HD2 5.10 # 848.0 HN 15 PRO HD3 4.50 # 1948.0 HN 17 ASP- HN 5.30 # 1206.0 HN 17 ASP- HB2 5.90 # 657.0 HN 18 GLY HN 5.10 # 1632.0 HA 14 ASN HB2 3.00 # 41290.0 HA 14 ASN HB3 3.30 # 26270.0 HA 14 ASN HD21 4.50 <# 1991.0 HA 14 ASN HD22 5.30 ># 679.0 HA 15 PRO HA 4.60 # 3321.0 HA 15 PRO HG2 4.50 # 1850.0 HA 15 PRO HG3 4.40 # 2017.0 HA 15 PRO HD2 2.30 # 107300.0 HA 15 PRO HD3 2.40 # 80510.0 HA 16 GLU- HN 4.20 # 5090.0 HA 17 ASP- HN 4.40 # 3814.0 HA 18 GLY HN 5.90 # 609.0 HB2 14 ASN HD21 2.70 # 38950.0 HB2 14 ASN HD22 3.70 # 6311.0 HB2 15 PRO HD2 4.60 # 1741.0 HB2 15 PRO HD3 5.60 # 481.0 HB2 16 GLU- HN 6.00 ># 377.0 HB2 17 ASP- HN 4.70 ># 2389.0 HB2 17 ASP- HB2 4.20 # 2916.0 HB3 14 ASN HD21 2.90 # 28330.0 HB3 14 ASN HD22 3.90 # 4835.0 HB3 15 PRO HD2 4.80 # 1246.0 HB3 15 PRO HD3 5.60 # 507.0 HB3 16 GLU- HN 4.80 <# 2271.0 HB3 17 ASP- HN 3.50 <# 14430.0 HB3 17 ASP- HB2 2.60 # 53510.0 HB3 17 ASP- HB3 6.00 # .0 HB3 18 GLY HN 5.80 # 727.0 HD21 16 GLU- HN 6.00 ># 254.0 HD21 16 GLU- HB2 4.40 # 2183.0 HD21 16 GLU- HB3 5.70 # 459.0 HD21 17 ASP- HB2 4.30 # 2396.0 HD21 17 ASP- HB3 5.30 # 671.0 HD22 15 PRO HD2 5.00 # 984.0 HD22 16 GLU- HN 4.30 <# 2618.0 HD22 16 GLU- HB2 3.30 # 12240.0 HD22 16 GLU- HB3 4.70 # 1418.0 HD22 16 GLU- HG3 5.50 # 534.0 15 PRO HA 15 PRO HB2 3.20 ># 28810.0 HA 15 PRO HB3 2.70 <# 83160.0 HA 15 PRO HG2 3.80 # 5155.0 HA 15 PRO HG3 3.70 # 6692.0 HA 16 GLU- HN 3.90 # 8614.0 HA 16 GLU- HA 6.00 # 678.0 HA 17 ASP- HN 3.80 # 8910.0 HA 18 GLY HN 3.40 # 18560.0 HA 18 GLY HA1 3.30 <# 20420.0 HA 18 GLY HA2 4.60 ># 2731.0 HA 27 GLY HN 4.10 # 3461.0 HA 27 GLY HA1 5.10 # 844.0 HA 28 THR HN 3.90 # 4174.0 HA 28 THR HB 4.60 # 1699.0 HB2 15 PRO HG2 2.40 # 88570.0 HB2 15 PRO HG3 3.00 # 21080.0 HB2 15 PRO HD2 3.90 # 4282.0 HB2 15 PRO HD3 4.20 # 3015.0 HB2 16 GLU- HN 3.40 <# 21940.0 HB2 16 GLU- HA 4.60 # 3402.0 HB2 27 GLY HN 4.50 # 1768.0 HB2 27 GLY HA1 4.10 # 3083.0 HB2 28 THR HN 4.50 # 1758.0 HB2 29 ASP- HN 6.00 ># 319.0 HB2 29 ASP- HA 3.90 ># 4450.0 HB2 30 PHE HN 4.90 ># 1142.0 HB3 15 PRO HG2 3.20 # 15280.0 HB3 15 PRO HG3 2.80 # 33040.0 HB3 15 PRO HD2 4.20 # 3017.0 HB3 15 PRO HD3 3.50 # 9249.0 HB3 16 GLU- HN 4.50 ># 3524.0 HB3 27 GLY HN 5.20 # 781.0 HB3 27 GLY HA1 6.00 # 279.0 HB3 28 THR HN 4.40 # 2015.0 HB3 29 ASP- HN 5.00 <# 984.0 HB3 29 ASP- HA 2.90 <# 27540.0 HB3 30 PHE HN 3.70 <# 6498.0 HG2 15 PRO HD2 2.70 # 41330.0 HG2 15 PRO HD3 3.00 # 22980.0 HG2 16 GLU- HN 3.20 <# 13730.0 HG2 16 GLU- HA 4.90 # 1160.0 HG3 15 PRO HD2 3.10 # 18430.0 HG3 15 PRO HD3 2.70 # 45860.0 HG3 16 GLU- HN 4.80 ># 1295.0 HG3 29 ASP- HA 4.40 # 2134.0 HG3 30 PHE HN 4.00 # 3878.0 HD2 16 GLU- HN 3.00 <# 22250.0 HD3 16 GLU- HN 4.00 ># 3961.0 16 GLU- HN 16 GLU- HA 3.00 # 47940.0 HN 16 GLU- HB2 2.80 <# 62360.0 HN 16 GLU- HB3 3.50 ># 17640.0 HN 16 GLU- HG2 3.40 # 9685.0 HN 16 GLU- HG3 3.20 # 13790.0 HN 17 ASP- HN 2.80 # 67660.0 HN 17 ASP- HA 6.00 # 250.0 HN 17 ASP- HB2 4.70 # 2787.0 HN 18 GLY HN 4.10 # 6036.0 HN 27 GLY HN 5.10 # 872.0 HA 16 GLU- HB2 3.00 # 41970.0 HA 16 GLU- HB3 2.90 # 60070.0 HA 16 GLU- HG2 2.90 <# 26050.0 HA 16 GLU- HG3 3.70 ># 6491.0 HA 17 ASP- HN 3.50 # 17180.0 HA 18 GLY HN 4.90 # 2010.0 HA 26 PRO HA 6.00 # .0 HA 27 GLY HN 3.00 # 22090.0 HA 27 GLY HA1 3.00 <# 21790.0 HA 27 GLY HA2 4.50 ># 1954.0 HB2 16 GLU- HG2 3.80 # 5247.0 HB2 16 GLU- HG3 3.20 # 14940.0 HB2 17 ASP- HN 3.30 # 26260.0 HB2 17 ASP- HA 4.90 # 2308.0 HB3 16 GLU- HG2 2.80 # 30980.0 HB3 16 GLU- HG3 3.70 # 6259.0 HB3 17 ASP- HN 3.80 # 10850.0 HB3 17 ASP- HA 5.40 # 1209.0 HG2 17 ASP- HN 4.90 # 1136.0 HG3 17 ASP- HN 5.20 # 798.0 17 ASP- HN 17 ASP- HA 3.10 # 33150.0 HN 17 ASP- HB2 2.80 <# 61830.0 HN 17 ASP- HB3 3.60 ># 15740.0 HN 18 GLY HN 2.50 # 122400.0 HN 18 GLY HA1 4.30 # 4812.0 HN 18 GLY HA2 4.90 # 2341.0 HN 26 PRO HA 5.00 # 963.0 HN 26 PRO HB3 4.80 # 1273.0 HA 17 ASP- HB2 3.00 # 46080.0 HA 17 ASP- HB3 2.70 # 86000.0 HA 18 GLY HN 4.80 # 2427.0 HA 26 PRO HA 5.00 # 1040.0 HA 26 PRO HB3 3.20 # 14670.0 HA 26 PRO HG3 4.80 # 1209.0 HB2 18 GLY HN 3.20 <# 27170.0 HB3 18 GLY HN 4.00 ># 8277.0 HB3 26 PRO HA 6.00 # 159.0 18 GLY HN 18 GLY HA1 2.70 # 92760.0 HN 18 GLY HA2 2.90 # 57950.0 HN 19 ASP- HN 4.70 # 2990.0 HN 20 PRO HD3 5.20 # 819.0 HN 24 VAL QG1 6.80 # 770.0 HN 26 PRO HA 3.20 # 15280.0 HN 27 GLY HN 3.70 # 5706.0 HN 28 THR HN 4.40 # 2255.0 HA1 19 ASP- HN 3.10 ># 33860.0 HA1 19 ASP- QB 5.50 <# 3745.5 HA1 20 PRO HD3 4.70 # 1484.0 HA1 24 VAL HB 4.60 # 1588.0 HA1 24 VAL QG1 3.90 # 21500.0 HA1 26 PRO HA 3.40 ># 10460.0 HA1 27 GLY HN 4.20 # 2706.0 HA1 28 THR HN 4.30 # 2498.0 HA1 28 THR HB 4.00 # 3874.0 HA2 19 ASP- HN 2.40 <# 159700.0 HA2 19 ASP- HA 4.50 # 3783.0 HA2 19 ASP- QB 7.00 ># 134.5 HA2 20 PRO HA 5.80 # 689.0 HA2 20 PRO QG 5.80 # 1214.0 HA2 20 PRO HD2 4.80 # 1247.0 HA2 20 PRO HD3 3.20 # 13850.0 HA2 24 VAL HB 4.60 # 1726.0 HA2 24 VAL QG1 3.90 # 23880.0 HA2 26 PRO HA 2.60 <# 56730.0 HA2 26 PRO HB3 4.10 # 3218.0 HA2 26 PRO HG3 5.20 # 782.0 HA2 27 GLY HN 4.00 # 4006.0 HA2 28 THR HN 4.20 # 2918.0 HA2 28 THR HB 4.60 # 1680.0 19 ASP- HN 19 ASP- HA 3.20 # 27410.0 HN 19 ASP- QB 4.40 # 11135.0 HN 20 PRO HA 4.30 # 5082.0 HN 20 PRO HB3 6.00 # 406.0 HN 20 PRO QG 5.30 # 2398.0 HN 20 PRO HD2 4.00 ># 4071.0 HN 20 PRO HD3 2.80 <# 36110.0 HN 24 VAL HN 3.70 # 6442.0 HN 24 VAL HA 4.30 # 2571.0 HN 24 VAL HB 2.50 # 66960.0 HN 24 VAL QG1 3.80 <# 26160.0 HN 24 VAL QG2 5.30 ># 3332.0 HN 25 ASN HN 4.70 # 1382.0 HN 25 ASN HA 4.30 # 2359.0 HN 26 PRO HA 4.80 # 1307.0 HN 26 PRO QD 7.00 # 250.5 HA 19 ASP- QB 3.90 # 25595.0 HA 20 PRO HA 5.40 # 1220.0 HA 20 PRO QG 6.90 # 368.0 HA 20 PRO HD2 3.00 # 22270.0 HA 20 PRO HD3 3.10 # 16640.0 HA 21 ASP- HN 4.20 # 5366.0 HA 22 ASN HN 6.00 # 423.0 HA 24 VAL HB 4.20 # 2972.0 QB 20 PRO HA 7.00 # 143.0 QB 20 PRO HD2 6.60 # 498.5 QB 20 PRO HD3 6.30 # 671.0 QB 21 ASP- HN 7.00 # 241.5 QB 22 ASN HN 6.60 # 870.5 QB 22 ASN HB2 5.60 # 1711.5 QB 22 ASN HD21 7.00 # 158.5 QB 24 VAL HN 5.00 # 4004.0 QB 24 VAL HA 6.10 # 867.5 QB 24 VAL HB 3.60 # 48265.0 QB 24 VAL QG1 5.90 # 5745.0 QB 24 VAL QG2 5.40 # 10775.0 QB 37 TRP HD1 6.20 # 739.0 QB 37 TRP HE1 3.90 # 27508.0 20 PRO HA 20 PRO HB2 3.10 ># 36020.0 HA 20 PRO HB3 2.70 <# 91790.0 HA 20 PRO QG 4.40 # 4957.5 HA 20 PRO HD2 4.20 # 2708.0 HA 20 PRO HD3 3.80 # 5077.0 HA 21 ASP- HN 3.90 # 8522.0 HA 22 ASN HN 4.10 # 5875.0 HA 23 GLY HN 3.60 # 12900.0 HA 24 VAL HN 2.90 # 43320.0 HA 24 VAL HB 5.60 # 913.0 HA 25 ASN HN 4.40 # 2114.0 HA 25 ASN HA 3.50 # 8114.0 HA 26 PRO QD 6.00 # 1040.5 HB2 20 PRO QG 3.70 # 41470.0 HB2 20 PRO HD2 3.90 # 4717.0 HB2 20 PRO HD3 4.30 # 2622.0 HB2 21 ASP- HN 3.70 <# 13320.0 HB2 21 ASP- HA 4.20 # 5588.0 HB2 23 GLY HN 5.90 # 611.0 HB2 26 PRO QD 5.00 # 3633.5 HB3 20 PRO QG 3.60 # 49080.0 HB3 20 PRO HD2 4.30 # 2427.0 HB3 20 PRO HD3 3.50 # 9450.0 HB3 21 ASP- HN 4.50 ># 3740.0 HB3 24 VAL HN 5.00 # 1820.0 HB3 25 ASN HA 3.30 # 13130.0 HB3 26 PRO HG3 6.00 # .0 HB3 26 PRO QD 5.10 # 3189.5 QG 20 PRO HD2 3.80 # 31680.0 QG 20 PRO HD3 3.50 # 63200.0 QG 21 ASP- HN 5.00 # 4104.5 QG 26 PRO QD 6.90 # 1145.5 HD2 21 ASP- HN 3.00 <# 20320.0 HD3 21 ASP- HN 4.20 ># 2981.0 HD3 24 VAL HB 4.90 # 1078.0 HD3 25 ASN HA 6.00 # .0 HD3 26 PRO QD 4.40 # 10655.0 21 ASP- HN 21 ASP- HA 3.10 # 32980.0 HN 21 ASP- HB2 2.80 <# 66540.0 HN 21 ASP- HB3 3.40 ># 20080.0 HN 22 ASN HN 2.90 # 50940.0 HN 22 ASN HA 5.40 # 1188.0 HN 22 ASN HB2 5.60 # 1034.0 HN 22 ASN HD21 3.40 <# 10290.0 HN 22 ASN HD22 4.90 ># 1144.0 HN 23 GLY HN 4.40 # 3754.0 HN 24 VAL HN 5.40 # 1101.0 HA 21 ASP- HB2 3.20 # 31370.0 HA 21 ASP- HB3 2.90 # 59480.0 HA 22 ASN HN 3.90 # 9019.0 HA 22 ASN HA 5.50 # 1127.0 HA 23 GLY HN 4.70 # 2371.0 HB2 22 ASN HN 3.40 <# 20840.0 HB2 22 ASN HA 5.10 # 1686.0 HB2 22 ASN HD21 3.60 # 6823.0 HB2 22 ASN HD22 4.20 # 2731.0 HB3 22 ASN HN 4.00 ># 7120.0 HB3 22 ASN HA 5.10 # 1736.0 HB3 22 ASN HD21 4.60 # 1650.0 HB3 22 ASN HD22 5.50 # 548.0 22 ASN HN 22 ASN HA 3.40 # 21820.0 HN 22 ASN HB2 3.00 <# 45390.0 HN 22 ASN HB3 3.70 ># 11980.0 HN 22 ASN HD21 4.00 <# 3778.0 HN 22 ASN HD22 5.80 ># 401.0 HN 23 GLY HN 2.80 # 68880.0 HN 23 GLY HA1 4.70 <# 3033.0 HN 23 GLY HA2 5.60 ># 980.0 HN 24 VAL HN 3.60 # 12370.0 HN 24 VAL HB 6.00 # 439.0 HN 24 VAL QG2 6.90 # 720.0 HN 37 TRP HE1 4.70 # 1448.0 HA 22 ASN HB2 3.10 ># 33460.0 HA 22 ASN HB3 2.70 <# 85360.0 HA 22 ASN HD21 4.60 <# 1555.0 HA 22 ASN HD22 6.00 ># 220.0 HA 23 GLY HN 3.40 # 20400.0 HA 23 GLY HA1 4.80 # 2481.0 HA 23 GLY HA2 4.60 # 3207.0 HA 24 VAL HN 5.20 # 1418.0 HB2 22 ASN HD21 2.80 # 32510.0 HB2 22 ASN HD22 3.60 # 7462.0 HB2 23 GLY HN 4.80 # 2489.0 HB2 24 VAL HN 4.70 <# 2413.0 HB2 37 TRP HD1 4.00 # 3714.0 HB2 37 TRP HE1 2.90 <# 25504.0 HB3 22 ASN HD21 3.50 # 9040.0 HB3 22 ASN HD22 4.10 # 3318.0 HB3 23 GLY HN 4.90 # 2242.0 HB3 24 VAL HN 6.00 ># 252.0 HB3 37 TRP HD1 3.60 # 7121.0 HB3 37 TRP HE1 4.10 ># 3474.0 HD21 24 VAL QG1 7.00 # 469.0 HD21 37 TRP HE1 5.80 # 400.0 HD22 40 PRO HB2 4.00 # 3688.0 HD22 40 PRO HB3 4.40 # 2264.0 HD22 40 PRO HG2 4.40 # 2176.0 23 GLY HN 23 GLY HA1 2.50 <# 130800.0 HN 23 GLY HA2 3.00 ># 40540.0 HN 24 VAL HN 3.10 # 38100.0 HN 24 VAL HB 5.40 # 1243.0 HN 24 VAL QG1 7.00 ># 263.0 HN 24 VAL QG2 5.50 <# 2828.0 HA1 24 VAL HN 3.30 # 24780.0 HA1 24 VAL HA 4.70 # 3068.0 HA1 24 VAL QG2 6.50 # 978.0 HA2 24 VAL HN 3.50 # 15890.0 HA2 24 VAL HA 4.80 # 2534.0 HA2 24 VAL QG2 5.00 # 5085.0 24 VAL HN 24 VAL HA 3.20 # 27640.0 HN 24 VAL HB 2.80 # 62040.0 HN 24 VAL QG1 4.80 ># 4463.0 HN 24 VAL QG2 3.70 <# 22030.0 HN 25 ASN HN 4.50 # 3980.0 HN 37 TRP HE1 5.40 # 600.0 HA 24 VAL HB 3.70 # 12240.0 HA 24 VAL QG1 3.30 # 60730.0 HA 24 VAL QG2 3.30 # 58430.0 HA 25 ASN HN 2.40 # 190400.0 HA 25 ASN HA 4.70 # 2844.0 HA 25 ASN HB2 4.50 # 3533.0 HA 28 THR HB 4.70 # 2570.0 HA 28 THR QG2 5.10 # 4507.0 HA 28 THR HG1 4.40 # 2187.0 HB 24 VAL QG1 3.30 # 74060.0 HB 24 VAL QG2 3.30 # 69360.0 HB 25 ASN HN 4.40 # 4607.0 HB 33 ILE QG2 6.40 # 1096.0 HB 33 ILE QD1 6.00 # 1727.0 HB 37 TRP HD1 5.30 # 676.0 HB 37 TRP HE1 4.00 # 3568.0 QG1 25 ASN HN 4.20 <# 14760.0 QG1 25 ASN HB2 6.10 # 1460.0 QG1 27 GLY HN 7.00 # 664.0 QG1 28 THR HN 4.70 # 7101.0 QG1 28 THR HB 3.30 # 112100.0 QG1 28 THR QG2 4.60 <# 36470.0 QG1 28 THR HG1 4.30 # 12890.0 QG1 30 PHE QD 9.00 # 204.5 QG1 33 ILE HA 4.80 # 6521.0 QG1 33 ILE QG2 5.20 ># 14520.0 QG1 33 ILE HG12 3.50 # 39710.0 QG1 33 ILE HG13 4.60 # 7817.0 QG1 33 ILE QD1 5.00 # 20090.0 QG1 34 PRO HD2 5.60 # 2541.0 QG1 34 PRO HD3 5.90 # 1896.0 QG1 37 TRP HD1 6.60 ># 898.0 QG2 25 ASN HN 5.70 ># 2325.0 QG2 28 THR QG2 5.60 ># 7884.0 QG2 33 ILE HA 4.80 # 6561.0 QG2 33 ILE QG2 4.50 <# 44030.0 QG2 33 ILE HG12 4.10 # 17500.0 QG2 33 ILE HG13 6.00 # 1592.0 QG2 33 ILE QD1 5.30 # 12160.0 QG2 34 PRO HG2 6.90 # 677.0 QG2 34 PRO HG3 7.00 # 652.0 QG2 34 PRO HD2 3.80 # 25350.0 QG2 34 PRO HD3 4.40 # 10080.0 QG2 37 TRP HB2 6.00 # 1595.0 QG2 37 TRP HB3 6.90 # 727.0 QG2 37 TRP HD1 3.90 <# 20930.0 QG2 37 TRP HE1 4.20 # 13416.0 25 ASN HN 25 ASN HA 3.20 # 29910.0 HN 25 ASN HB2 2.70 <# 76630.0 HN 25 ASN HB3 3.50 ># 18370.0 HN 25 ASN HD21 3.80 # 5233.0 HN 25 ASN HD22 3.80 # 5036.0 HN 26 PRO QD 5.70 # 1427.0 HN 28 THR HB 4.40 # 3898.0 HN 28 THR QG2 5.50 # 2845.0 HN 28 THR HG1 3.60 # 7868.0 HA 25 ASN HB2 3.60 ># 14170.0 HA 25 ASN HB3 2.80 <# 68990.0 HA 25 ASN HD21 3.30 # 12900.0 HA 25 ASN HD22 6.00 # .0 HA 26 PRO QD 4.20 # 15455.0 HB2 25 ASN HD21 2.70 # 40000.0 HB2 25 ASN HD22 3.70 # 6464.0 HB2 26 PRO QD 4.50 ># 8035.0 HB2 28 THR QG2 7.00 # 98.0 HB2 28 THR HG1 3.40 <# 10670.0 HB3 25 ASN HD21 3.60 # 7754.0 HB3 25 ASN HD22 4.20 # 2824.0 HB3 26 PRO QD 3.70 <# 40085.0 HB3 28 THR HG1 4.10 ># 3126.0 HD21 26 PRO QD 7.00 # 204.5 26 PRO HA 26 PRO HB2 3.00 ># 44860.0 HA 26 PRO HB3 2.60 <# 114500.0 HA 26 PRO HG2 4.10 # 3084.0 HA 26 PRO HG3 3.90 # 4773.0 HA 27 GLY HN 2.40 # 186400.0 HA 27 GLY HA1 4.60 # 3093.0 HA 27 GLY HA2 4.60 # 3423.0 HA 28 THR HN 3.50 # 14520.0 HB2 26 PRO HG2 2.60 # 47740.0 HB2 26 PRO HG3 2.70 # 38670.0 HB2 26 PRO QD 4.10 # 17815.0 HB2 27 GLY HN 3.90 # 8722.0 HB2 27 GLY HA1 6.00 # 118.0 HB2 27 GLY HA2 6.00 # 451.0 HB3 26 PRO HG2 3.10 # 19750.0 HB3 26 PRO HG3 2.70 # 43960.0 HB3 26 PRO QD 4.40 # 10105.0 HB3 27 GLY HN 3.50 # 16510.0 HB3 27 GLY HA1 6.00 # 293.0 HG2 26 PRO QD 4.10 # 19545.0 HG2 27 GLY HN 5.50 # 540.0 HG3 26 PRO QD 4.40 # 9800.0 27 GLY HN 27 GLY HA1 2.50 <# 122000.0 HN 27 GLY HA2 3.10 ># 34470.0 HN 28 THR HN 2.90 # 51020.0 HN 28 THR HG1 5.40 # 654.0 HA1 28 THR HN 3.30 # 24280.0 HA1 28 THR HA 4.60 # 3323.0 HA2 28 THR HN 3.70 # 13020.0 HA2 28 THR HA 4.50 # 3613.0 28 THR HN 28 THR HA 3.40 # 21970.0 HN 28 THR HB 2.80 # 70050.0 HN 28 THR QG2 4.30 # 9238.0 HN 28 THR HG1 3.00 # 20940.0 HN 29 ASP- HN 4.60 # 3445.0 HA 28 THR HB 3.60 # 14950.0 HA 28 THR QG2 3.30 # 54030.0 HA 28 THR HG1 3.80 # 5400.0 HA 29 ASP- HN 2.40 # 167700.0 HA 29 ASP- HA 5.80 # 821.0 HA 29 ASP- HB2 4.30 <# 4967.0 HA 29 ASP- HB3 5.20 ># 1592.0 HA 32 ASP- HB2 5.00 # 1647.0 HB 28 THR QG2 3.30 # 126800.0 HB 28 THR HG1 2.50 # 61620.0 HB 29 ASP- HN 4.30 # 5074.0 HB 33 ILE HG12 3.80 # 4935.0 QG2 28 THR HG1 4.10 # 12100.0 QG2 29 ASP- HN 3.60 # 33680.0 QG2 29 ASP- HA 5.80 # 2108.0 QG2 29 ASP- HB2 5.70 # 2138.0 QG2 29 ASP- HB3 5.50 # 2761.0 QG2 30 PHE HA 5.40 # 3096.0 QG2 32 ASP- HN 4.90 # 5952.0 QG2 32 ASP- HB2 3.30 # 61930.0 QG2 32 ASP- HB3 3.70 # 33140.0 QG2 33 ILE HN 3.70 # 32810.0 QG2 33 ILE HA 3.30 # 64280.0 QG2 34 PRO HD2 5.20 # 3957.0 QG2 34 PRO HD3 4.70 # 7663.0 HG1 29 ASP- HN 6.00 # 345.0 29 ASP- HN 29 ASP- HA 3.10 # 33350.0 HN 29 ASP- HB2 2.70 # 90390.0 HN 29 ASP- HB3 2.80 # 64960.0 HN 30 PHE HN 4.70 # 2857.0 HN 31 LYS+ HN 6.00 # 424.0 HN 31 LYS+ HG2 6.00 # 247.0 HN 32 ASP- HN 4.50 # 3085.0 HN 32 ASP- HB2 3.50 <# 15140.0 HN 32 ASP- HB3 4.80 ># 2116.0 HA 29 ASP- HB2 2.80 # 61060.0 HA 29 ASP- HB3 3.00 # 43320.0 HA 30 PHE HN 2.60 # 110300.0 HA 30 PHE HA 4.40 # 4227.0 HA 31 LYS+ HN 4.10 # 6037.0 HB2 30 PHE HN 4.40 # 4454.0 HB2 31 LYS+ HN 4.10 ># 5383.0 HB2 31 LYS+ HG2 3.90 # 4197.0 HB2 31 LYS+ HG3 6.00 # 225.0 HB2 32 ASP- HN 4.90 ># 1969.0 HB3 30 PHE HN 4.10 # 6195.0 HB3 31 LYS+ HN 3.50 <# 15020.0 HB3 31 LYS+ QB 7.00 # 315.0 HB3 31 LYS+ HG2 3.20 # 13900.0 HB3 31 LYS+ HG3 4.50 # 1898.0 HB3 31 LYS+ QE 5.40 # 2134.5 HB3 32 ASP- HN 3.40 <# 17140.0 30 PHE HN 30 PHE HA 3.00 # 41420.0 HN 30 PHE HB2 2.60 # 105520.0 HN 30 PHE HB3 2.90 # 55270.0 HN 30 PHE QD 6.00 # 3702.0 HN 31 LYS+ HN 3.30 # 24730.0 HN 31 LYS+ QB 7.00 # 121.5 HN 31 LYS+ HG2 5.80 # 387.0 HN 32 ASP- HN 4.80 # 2221.0 HN 33 ILE HG13 4.30 # 2456.0 HN 33 ILE QD1 5.80 # 1936.0 HA 30 PHE HB2 2.60 <# 110960.0 HA 30 PHE HB3 3.10 ># 34850.0 HA 30 PHE QD 3.90 # 28868.0 HA 30 PHE QE 6.40 # 426.0 HA 31 LYS+ HN 3.90 # 9649.0 HA 31 LYS+ HA 5.80 # 834.0 HA 32 ASP- HN 4.60 # 2980.0 HA 33 ILE HN 3.50 # 15720.0 HA 33 ILE HB 3.40 # 18980.0 HA 33 ILE QG2 4.70 # 7453.0 HA 33 ILE HG12 3.40 ># 10200.0 HA 33 ILE HG13 2.40 <# 85670.0 HA 33 ILE QD1 3.30 # 76200.0 HA 46 LYS+ HE3 4.30 # 2584.0 HB2 30 PHE QD 4.70 # 37872.0 HB2 30 PHE QE 8.00 ># 127.5 HB2 31 LYS+ HN 3.90 ># 9157.0 HB2 33 ILE QD1 5.20 <# 3827.0 HB3 30 PHE QD 4.70 # 43635.0 HB3 30 PHE QE 6.60 <# 1575.5 HB3 31 LYS+ HN 3.10 <# 33560.0 HB3 31 LYS+ HA 4.50 # 3618.0 HB3 32 ASP- HN 5.70 # 760.0 HB3 33 ILE QD1 6.20 ># 1284.0 QD 30 PHE QE 6.80 # 33240.0 QD 30 PHE HZ 7.50 # 540.0 QD 31 LYS+ HN 6.00 # 3784.0 QD 31 LYS+ HA 5.80 # 5435.0 QD 31 LYS+ QB 9.00 # 103.2 QD 31 LYS+ HG2 7.50 <# 530.0 QD 31 LYS+ HG3 8.00 ># 129.0 QD 32 ASP- HN 8.00 # 262.5 QD 33 ILE HB 7.20 # 791.0 QD 33 ILE QG2 9.00 # 446.0 QD 33 ILE HG12 7.40 # 653.5 QD 33 ILE HG13 6.60 # 1551.0 QD 33 ILE QD1 6.00 # 19975.0 QD 37 TRP HH2 5.90 # 4207.0 QD 46 LYS+ QB 9.00 # 72.5 QD 46 LYS+ HE2 4.80 <# 35452.0 QD 46 LYS+ HE3 6.90 ># 1180.0 QD 46 LYS+ QZ 6.90 # 4528.0 QE 30 PHE HZ 4.70 # 38656.0 QE 33 ILE QD1 8.20 # 1336.0 QE 37 TRP HZ3 7.20 # 811.0 QE 37 TRP HH2 8.00 # 159.5 QE 46 LYS+ QB 7.30 # 2354.0 QE 46 LYS+ QG 8.30 # 720.0 QE 46 LYS+ HE2 6.30 <# 2344.0 QE 46 LYS+ HE3 8.00 ># 238.5 QE 49 PHE HB3 6.00 # 3920.0 HZ 46 LYS+ HA 3.50 # 8144.0 HZ 46 LYS+ QB 4.40 # 11208.0 HZ 46 LYS+ QG 5.70 # 1508.0 HZ 46 LYS+ HE2 4.50 # 1856.0 HZ 49 PHE HB3 2.90 # 28896.0 31 LYS+ HN 31 LYS+ HA 3.00 # 41560.0 HN 31 LYS+ QB 4.00 # 21675.0 HN 31 LYS+ HG2 2.80 <# 31840.0 HN 31 LYS+ HG3 3.40 ># 10560.0 HN 31 LYS+ QD 4.20 # 14680.0 HN 31 LYS+ QE 6.80 # 418.5 HN 32 ASP- HN 3.10 # 37040.0 HN 32 ASP- HB2 6.00 # 691.0 HN 33 ILE HN 4.50 # 3380.0 HN 33 ILE HG13 4.70 # 1382.0 HA 31 LYS+ QB 4.10 # 34515.0 HA 31 LYS+ HG2 3.60 # 7632.0 HA 31 LYS+ HG3 4.00 # 3584.0 HA 31 LYS+ QD 4.60 # 7750.0 HA 31 LYS+ QE 7.00 # 178.5 HA 32 ASP- HN 3.70 # 12000.0 HA 32 ASP- HA 5.80 # 836.0 HA 33 ILE HN 4.00 # 6397.0 HA 46 LYS+ HE2 4.60 # 1568.0 HA 46 LYS+ HE3 5.00 # 1032.0 HA 46 LYS+ QZ 4.60 # 7024.0 QB 31 LYS+ HG2 3.90 # 29005.0 QB 31 LYS+ HG3 3.70 # 41210.0 QB 31 LYS+ QD 5.10 # 19655.0 QB 31 LYS+ QE 6.80 # 1286.2 QB 32 ASP- HN 5.80 # 2443.5 HG2 31 LYS+ QD 3.90 # 29220.0 HG2 31 LYS+ QE 4.70 # 6445.0 HG2 32 ASP- HN 3.60 # 6959.0 HG2 32 ASP- HB2 6.00 # 256.0 HG2 32 ASP- HB3 6.00 # 102.0 HG3 31 LYS+ QD 4.20 # 14640.0 HG3 31 LYS+ QE 4.90 # 4347.0 HG3 32 ASP- HN 3.90 # 4533.0 HG3 33 ILE HN 4.90 # 1077.0 QD 31 LYS+ QE 5.20 # 16105.0 QE 32 ASP- HN 7.00 # 209.5 32 ASP- HN 32 ASP- HA 3.30 # 23940.0 HN 32 ASP- HB2 2.80 <# 68610.0 HN 32 ASP- HB3 3.60 ># 15440.0 HN 33 ILE HN 2.70 # 76180.0 HN 33 ILE HA 5.10 # 1726.0 HN 33 ILE HB 4.90 # 2255.0 HN 33 ILE QG2 7.00 # 328.0 HN 33 ILE HG12 5.30 ># 703.0 HN 33 ILE HG13 4.00 <# 4054.0 HN 33 ILE QD1 6.70 # 817.0 HA 32 ASP- HB2 3.30 ># 26120.0 HA 32 ASP- HB3 2.70 <# 81290.0 HA 33 ILE HN 3.60 # 14380.0 HB2 33 ILE HN 3.90 # 9239.0 HB2 33 ILE HA 5.20 # 1654.0 HB3 33 ILE HN 4.40 # 4546.0 HB3 33 ILE HA 5.20 # 1632.0 33 ILE HN 33 ILE HA 3.00 # 44550.0 HN 33 ILE HB 2.70 # 92800.0 HN 33 ILE QG2 4.20 # 10720.0 HN 33 ILE HG12 3.00 ># 22990.0 HN 33 ILE HG13 2.40 <# 87840.0 HN 33 ILE QD1 4.30 # 9267.0 HN 34 PRO HD2 5.10 # 857.0 HN 34 PRO HD3 4.70 # 1527.0 HN 46 LYS+ HE3 4.40 # 2114.0 HN 46 LYS+ QZ 3.70 # 40840.0 HA 33 ILE HB 3.00 # 44890.0 HA 33 ILE QG2 3.30 # 52610.0 HA 33 ILE HG12 2.40 <# 77550.0 HA 33 ILE HG13 4.10 ># 3258.0 HA 33 ILE QD1 4.40 # 7482.0 HA 34 PRO HA 5.80 # 802.0 HA 34 PRO HG2 4.70 # 1402.0 HA 34 PRO HG3 4.30 # 2432.0 HA 34 PRO HD2 2.60 ># 59270.0 HA 34 PRO HD3 2.30 <# 223500.0 HA 46 LYS+ QZ 5.70 # 1401.5 HB 33 ILE QG2 3.30 # 52470.0 HB 33 ILE HG12 3.00 # 24190.0 HB 33 ILE HG13 2.60 # 59440.0 HB 33 ILE QD1 3.30 # 41600.0 HB 34 PRO HD2 4.10 # 3377.0 HB 34 PRO HD3 4.60 # 1673.0 HB 37 TRP HB2 5.90 # 351.0 HB 37 TRP HB3 5.20 # 781.0 HB 46 LYS+ QG 5.20 # 2900.0 HB 46 LYS+ HD2 3.30 <# 12864.0 HB 46 LYS+ HD3 4.50 ># 1984.0 HB 46 LYS+ HE2 4.30 ># 2613.0 HB 46 LYS+ HE3 2.70 <# 41072.0 HB 46 LYS+ QZ 4.50 # 8952.0 QG2 33 ILE HG12 3.30 # 41480.0 QG2 33 ILE HG13 3.70 # 23192.0 QG2 33 ILE QD1 4.30 # 55860.0 QG2 34 PRO HA 6.20 # 1406.0 QG2 34 PRO HB2 5.40 <# 3028.0 QG2 34 PRO HB3 7.00 ># 670.0 QG2 34 PRO HG2 6.30 # 1202.0 QG2 34 PRO HG3 6.10 # 1558.0 QG2 34 PRO HD2 3.30 <# 73910.0 QG2 34 PRO HD3 4.00 ># 19650.0 QG2 35 ASP- HN 7.00 # 487.0 QG2 36 ASP- HN 6.90 # 714.0 QG2 37 TRP HN 4.90 # 5605.0 QG2 37 TRP HA 6.60 # 883.0 QG2 37 TRP HB2 3.50 # 44460.0 QG2 37 TRP HB3 3.50 # 41250.0 QG2 37 TRP HD1 5.40 # 3086.0 QG2 37 TRP HE3 4.40 # 10120.0 QG2 37 TRP HE1 7.00 # 258.0 QG2 46 LYS+ QG 6.20 # 3692.0 QG2 46 LYS+ HD2 3.90 <# 21688.0 QG2 46 LYS+ HD3 4.80 ># 6448.0 QG2 46 LYS+ HE2 7.00 ># 512.0 QG2 46 LYS+ HE3 5.30 <# 3426.0 QG2 46 LYS+ QZ 8.00 # .0 HG12 33 ILE QD1 3.30 # 60120.0 HG12 34 PRO HD2 3.90 # 4166.0 HG12 34 PRO HD3 3.90 # 4539.0 HG12 46 LYS+ HE3 5.30 # 696.0 HG13 33 ILE QD1 3.30 # 78180.0 HG13 46 LYS+ QZ 5.10 # 3524.0 QD1 34 PRO HD2 5.70 # 2227.0 QD1 37 TRP HB2 6.50 # 970.0 QD1 37 TRP HB3 6.40 # 1061.0 QD1 37 TRP HE3 7.00 # 502.0 QD1 46 LYS+ HD2 6.70 # 876.0 QD1 46 LYS+ HE2 6.20 ># 1363.0 QD1 46 LYS+ HE3 5.00 <# 5208.0 34 PRO HA 34 PRO HB2 3.20 ># 28510.0 HA 34 PRO HB3 2.60 <# 100400.0 HA 34 PRO HG2 3.80 ># 5400.0 HA 34 PRO HG3 3.20 <# 14950.0 HA 34 PRO HD2 3.70 # 6252.0 HA 34 PRO HD3 3.60 # 7249.0 HA 35 ASP- HN 2.50 # 130200.0 HA 35 ASP- HB2 4.70 <# 2886.0 HA 35 ASP- HB3 6.00 ># 338.0 HA 36 ASP- HN 4.20 # 4727.0 HB2 34 PRO HG2 2.50 # 74720.0 HB2 34 PRO HG3 2.60 # 59420.0 HB2 34 PRO HD2 3.80 # 5250.0 HB2 34 PRO HD3 3.80 # 5668.0 HB2 35 ASP- HN 3.70 # 12740.0 HB2 36 ASP- HN 3.20 # 24590.0 HB2 37 TRP HN 3.80 <# 8934.0 HB2 37 TRP HA 6.00 # 207.0 HB2 37 TRP HB2 4.00 # 3891.0 HB2 37 TRP HB3 4.60 # 1718.0 HB3 34 PRO HG2 2.60 # 51270.0 HB3 34 PRO HG3 2.70 # 37990.0 HB3 34 PRO HD2 4.10 # 3230.0 HB3 34 PRO HD3 3.60 # 7211.0 HB3 35 ASP- HN 3.70 # 12880.0 HB3 36 ASP- HN 3.70 # 10250.0 HB3 37 TRP HN 4.80 ># 2118.0 HG2 34 PRO HD2 2.50 # 65630.0 HG2 34 PRO HD3 2.80 # 33740.0 HG2 35 ASP- HN 5.60 # 500.0 HG2 36 ASP- HN 5.40 # 630.0 HG3 34 PRO HD2 2.60 # 47520.0 HG3 34 PRO HD3 2.60 # 56860.0 HG3 35 ASP- HN 5.70 # 467.0 HG3 36 ASP- HN 6.00 # 262.0 HD2 36 ASP- HN 5.70 # 447.0 HD2 37 TRP HN 5.00 # 1016.0 HD2 37 TRP HB2 3.00 # 20040.0 HD2 37 TRP HB3 3.50 # 8305.0 HD2 37 TRP HD1 4.90 <# 1109.0 HD3 37 TRP HN 5.70 # 456.0 HD3 37 TRP HB2 4.90 # 1087.0 HD3 37 TRP HD1 6.00 ># 293.0 35 ASP- HN 35 ASP- HA 3.20 # 28680.0 HN 35 ASP- HB2 2.80 # 71710.0 HN 35 ASP- HB3 3.20 # 29030.0 HN 36 ASP- HN 3.40 # 19850.0 HN 37 TRP HN 4.60 # 2864.0 HN 46 LYS+ HD2 6.00 # 182.0 HN 46 LYS+ HD3 6.00 # 248.0 HA 35 ASP- HB2 3.20 # 31720.0 HA 35 ASP- HB3 2.90 # 52100.0 HA 36 ASP- HN 3.70 # 12570.0 HA 37 TRP HN 5.10 # 1581.0 HA 37 TRP HB2 6.00 ># 331.0 HA 37 TRP HB3 5.20 <# 1332.0 HA 46 LYS+ QB 7.00 # 110.5 HA 46 LYS+ QG 6.90 # 360.0 HA 46 LYS+ HD2 3.40 ># 9807.0 HA 46 LYS+ HD3 2.70 <# 39256.0 HA 46 LYS+ HE2 4.70 # 1408.0 HA 46 LYS+ HE3 5.10 # 928.0 HA 46 LYS+ QZ 5.50 # 1960.0 HB2 36 ASP- HN 3.90 # 9467.0 HB3 36 ASP- HN 4.00 # 8091.0 HB3 46 LYS+ HD2 5.90 # 350.0 HB3 46 LYS+ HD3 6.00 # .0 36 ASP- HN 36 ASP- HA 3.30 # 26600.0 HN 36 ASP- HB2 3.50 # 18820.0 HN 36 ASP- HB3 3.20 # 28160.0 HN 37 TRP HN 2.90 # 52130.0 HN 37 TRP HA 6.00 # 613.0 HN 37 TRP HB2 4.70 # 2956.0 HN 37 TRP HB3 5.00 # 2079.0 HA 36 ASP- HB2 2.70 # 85230.0 HA 36 ASP- HB3 2.70 # 85750.0 HA 37 TRP HN 3.40 # 21200.0 HB2 37 TRP HN 4.80 <# 2489.0 HB3 37 TRP HN 5.80 ># 789.0 37 TRP HN 37 TRP HA 3.50 # 16352.0 HN 37 TRP HB2 2.70 # 94080.0 HN 37 TRP HB3 2.60 # 103840.0 HN 37 TRP HE3 4.30 # 2376.0 HN 46 LYS+ HD2 5.00 # 997.0 HA 37 TRP HB2 3.10 # 39910.0 HA 37 TRP HB3 3.50 # 18700.0 HA 37 TRP HD1 4.30 # 2617.0 HA 38 VAL HN 2.90 # 56120.0 HB2 37 TRP HD1 2.80 <# 31488.0 HB2 37 TRP HE3 4.00 ># 3688.0 HB2 37 TRP HE1 6.00 # 251.0 HB2 38 VAL HN 6.00 # 444.0 HB2 46 LYS+ HD2 5.10 # 904.0 HB3 37 TRP HD1 4.00 ># 4120.0 HB3 37 TRP HE3 2.70 <# 42328.0 HB3 38 VAL HN 5.60 # 960.0 HB3 46 LYS+ QG 7.00 # 204.0 HB3 46 LYS+ HD2 3.90 # 4640.0 HB3 46 LYS+ HD3 5.60 # 496.0 HB3 46 LYS+ HE3 5.80 # 419.0 HD1 37 TRP HE1 2.60 # 58704.0 HD1 38 VAL HN 3.40 # 10376.0 HE3 37 TRP HZ3 2.90 # 30040.0 HE3 38 VAL HN 4.10 # 3503.0 HE3 46 LYS+ HA 5.80 # 396.0 HE3 46 LYS+ QB 4.40 # 10004.0 HE3 46 LYS+ QG 4.60 # 7068.0 HE3 46 LYS+ HD2 5.80 # 408.0 HE1 37 TRP HZ2 3.20 # 14264.0 HE1 37 TRP HH2 6.00 # .0 HZ3 37 TRP HZ2 4.00 # 3856.0 HZ3 37 TRP HH2 2.50 # 64430.0 HZ3 46 LYS+ QG 5.50 # 1964.0 HZ2 37 TRP HH2 2.50 # 70984.0 38 VAL HN 38 VAL HB 3.60 # 14672.0 40 PRO HB2 40 PRO HG2 3.10 # 19232.0 HB3 40 PRO HG2 2.50 # 61128.0 HG2 40 PRO QD 4.30 # 13104.0 41 LEU HG 41 LEU QD1 3.80 # 17512.0 HG 41 LEU QD2 3.30 # 40896.0 45 GLY HN 45 GLY HA2 3.50 # 18368.0 HA1 46 LYS+ HN 3.20 # 28272.0 HA2 46 LYS+ HN 3.20 # 27296.0 46 LYS+ HN 46 LYS+ HA 4.30 # 5272.0 HN 46 LYS+ QB 3.60 # 48960.0 HN 46 LYS+ QG 5.90 # 1196.0 HA 46 LYS+ QB 4.70 # 11468.0 HA 46 LYS+ QG 5.30 # 1420.0 HA 46 LYS+ HD3 6.00 # 66.0 QB 46 LYS+ QG 4.50 # 74740.0 QB 46 LYS+ HD2 4.20 # 13908.0 QB 46 LYS+ HD3 4.40 # 10576.0 QB 46 LYS+ HE2 3.80 # 33908.0 QB 46 LYS+ HE3 3.90 # 27148.0 QB 46 LYS+ QZ 8.00 # .0 QB 47 ASP- HN 4.40 # 22360.0 QG 46 LYS+ HD2 4.00 # 21868.0 QG 46 LYS+ HD3 3.70 # 44560.0 QG 46 LYS+ HE2 5.60 ># 1747.5 QG 46 LYS+ HE3 4.40 <# 10796.0 HD2 46 LYS+ HE2 3.10 # 18384.0 HD2 46 LYS+ HE3 2.50 # 69024.0 HD2 46 LYS+ QZ 4.60 # 7448.0 HD3 46 LYS+ HE2 3.00 # 22816.0 HD3 46 LYS+ HE3 3.00 # 21432.0 HD3 46 LYS+ QZ 4.60 # 7616.0 HE2 46 LYS+ QZ 4.00 # 21704.0 HE3 46 LYS+ QZ 4.20 # 16096.0 47 ASP- HN 47 ASP- HA 3.60 # 14360.0 HN 47 ASP- QB 3.80 # 28416.0 HN 48 GLN HN 4.10 # 6400.0 HA 47 ASP- QB 4.50 # 9645.0 48 GLN HN 48 GLN HA 5.10 # 1840.0 49 PHE HA 50 GLU- HN 4.20 # 5392.0 HB2 50 GLU- HN 4.10 # 6536.0 QD 49 PHE QE 7.40 # 10830.0 50 GLU- HN 50 GLU- HA 3.70 # 13216.0 HN 50 GLU- HB2 3.90 # 9496.0 HN 50 GLU- HB3 4.30 # 5240.0 HN 50 GLU- HG2 4.10 # 3104.0 HA 50 GLU- HB2 3.50 ># 17456.0 HA 50 GLU- HB3 2.80 <# 63408.0 HA 50 GLU- HG2 4.00 # 3720.0 HA 50 GLU- HG3 4.30 # 2360.0 HA 51 GLU- HN 2.80 # 67220.0 HA 51 GLU- HA 5.10 # 1827.0 HA 51 GLU- QB 6.80 # 826.0 HB2 50 GLU- HG2 3.40 # 10168.0 HB2 50 GLU- HG3 2.90 # 30016.0 HB2 51 GLU- HN 4.10 # 6656.0 HB3 50 GLU- HG2 2.60 # 57672.0 HB3 50 GLU- HG3 3.20 # 13968.0 HB3 51 GLU- HN 3.60 # 14472.0 51 GLU- HN 51 GLU- HA 3.30 # 23310.0 HN 51 GLU- QB 3.70 # 33290.0 HN 51 GLU- HG2 4.00 # 4103.0 HN 51 GLU- HG3 4.50 # 2015.0 HN 52 VAL HN 4.80 # 2608.0 HA 51 GLU- QB 4.30 # 25135.0 HA 51 GLU- HG2 3.60 # 7311.0 HA 51 GLU- HG3 3.40 # 9765.0 HA 52 VAL HN 2.40 # 171100.0 HA 52 VAL HA 4.60 # 3117.0 HA 52 VAL HB 4.50 # 3665.0 HA 52 VAL QG2 5.60 # 2435.0 QB 51 GLU- HG2 3.60 # 49880.0 QB 51 GLU- HG3 3.90 # 28415.0 QB 52 VAL HN 5.60 # 3357.0 QB 52 VAL HA 7.00 # 54.0 QB 53 GLU- HN 5.70 # 2475.5 HG2 52 VAL HN 3.30 # 13120.0 HG2 52 VAL HA 4.20 <# 2895.0 HG2 53 GLU- HA 5.60 ># 489.0 HG3 52 VAL HN 3.30 # 11830.0 HG3 52 VAL HA 5.70 ># 426.0 HG3 53 GLU- HA 4.60 <# 1661.0 52 VAL HN 52 VAL HA 3.70 # 12520.0 HN 52 VAL HB 3.00 # 43260.0 HN 52 VAL QG1 4.20 # 10280.0 HN 52 VAL QG2 3.90 # 15330.0 HN 53 GLU- HN 4.30 # 4864.0 HN 54 GLU- HN 5.30 # 1260.0 HA 52 VAL HB 3.50 # 18220.0 HA 52 VAL QG1 3.30 # 46940.0 HA 52 VAL QG2 3.60 # 23790.0 HA 53 GLU- HN 2.50 # 126600.0 HA 53 GLU- HA 6.00 # 167.0 HA 53 GLU- HB2 6.00 # 265.0 HA 53 GLU- HG3 5.90 # 371.0 HA 54 GLU- HG2 6.00 # 244.0 HB 52 VAL QG1 3.30 # 57590.0 HB 52 VAL QG2 3.30 # 45930.0 HB 53 GLU- HN 4.60 # 3446.0 QG1 53 GLU- HN 4.10 <# 17210.0 QG1 53 GLU- HA 6.70 # 829.0 QG1 54 GLU- HN 4.80 <# 5963.0 QG2 53 GLU- HN 5.60 ># 2485.0 QG2 54 GLU- HN 7.00 ># 261.0 53 GLU- HN 53 GLU- HA 3.50 # 18440.0 HN 53 GLU- HB2 3.40 ># 19130.0 HN 53 GLU- HB3 2.90 <# 55530.0 HN 53 GLU- HG2 3.80 # 4933.0 HN 53 GLU- HG3 3.60 # 6996.0 HN 54 GLU- HN 4.00 # 8171.0 HA 53 GLU- HB2 3.30 <# 26460.0 HA 53 GLU- HB3 3.90 ># 8486.0 HA 53 GLU- HG2 3.80 # 4888.0 HA 53 GLU- HG3 4.40 # 2021.0 HA 54 GLU- HN 2.70 # 80730.0 HB2 53 GLU- HG2 3.20 # 14980.0 HB2 53 GLU- HG3 3.20 # 14120.0 HB2 54 GLU- HN 4.20 # 5851.0 HB3 53 GLU- HG2 2.60 # 54500.0 HB3 53 GLU- HG3 3.70 # 6428.0 HB3 54 GLU- HN 4.50 # 3786.0 HG2 54 GLU- HN 4.80 # 1271.0 HG3 54 GLU- HN 4.70 # 1465.0 54 GLU- HN 54 GLU- HA 3.40 # 20150.0 HN 54 GLU- QB 4.70 # 6315.0 HN 54 GLU- HG2 3.50 <# 8644.0 HN 54 GLU- HG3 4.10 ># 3260.0 HA 54 GLU- QB 6.40 # 1297.5 HA 54 GLU- HG2 3.90 # 4373.0 HA 54 GLU- HG3 3.80 # 5311.0 QB 54 GLU- HG2 5.20 ># 2694.5 QB 54 GLU- HG3 3.70 <# 43575.0
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