NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | in_recoord | stage | position | program | type | subtype | subsubtype |
8117 | 1lm0 | 5407 | cing | recoord | 1-original | 1 | DYANA/DIANA | distance | NOE | simple |
5 LEU HN 5 LEU HA 6.00 # w 2 0.0 - total-2D 623 HN 5 LEU HB2 5.10 # 2 6467.0 e total-2D1014 HN 5 LEU HB3 5.60 # 2 3822.0 e total-2D1015 HN 5 LEU HG 5.70 # 1 2871.0 e total-2D1151 HN 5 LEU QD1 7.00 # w 1M 740.0 e total-2D7422 HN 5 LEU QD2 7.00 # w 1M 656.0 e total-2D1153 HA 5 LEU HB2 6.00 # w 2 0.0 e total-2D6020 HA 5 LEU HB3 6.00 # w 2 0.0 e total-2D6018 HA 5 LEU HG 6.00 # w 1 0.0 e total-2D6019 HB2 5 LEU HG 2.40 # 1 557400.0 e ! total-2D7427 HB2 5 LEU QD1 4.70 # 1M 12080.0 e total-2D7428 HB2 5 LEU QD2 4.60 # 1M 15100.0 e total-2D7440 HB3 5 LEU HG 2.60 # 1 340900.0 e total-2D7425 HB3 5 LEU QD1 5.20 # 1M 6966.0 e total-2D7437 HB3 5 LEU QD2 4.50 # 1M 16710.0 e total-2D7436 HG 5 LEU QD1 4.90 # 1M 9464.0 e total-2D7430 HG 5 LEU QD2 5.00 # 1M 9248.0 e total-2D7431 6 ASN HN 6 ASN HA 4.60 # 2 11720.0 e total-2D2188 HN 6 ASN HB2 6.00 # w 2 0.0 - total-2D2190 HN 6 ASN HB3 6.00 # w 2 0.0 - total-2D2189 HN 6 ASN HD21 6.00 # w 1 0.0 - total-2D2290 HN 6 ASN HD22 6.00 # w 1 0.0 - total-2D2291 HA 6 ASN HB2 6.00 # w 2 1060.0 e total-2D4896 HA 6 ASN HB3 6.00 # w 2 746.0 e total-2D4897 HB2 6 ASN HD21 5.40 # 1 3947.0 e total-2D8014 HB2 6 ASN HD22 5.40 # 1 3667.0 e total-2D8544 HB3 6 ASN HD21 5.30 # 1 4056.0 e total-2D8289 HB3 6 ASN HD22 5.20 # 1 4805.0 e total-2D8543 7 SER HN 7 SER HA 6.00 # w 2 0.0 - total-2D 999 HN 7 SER HB2 6.00 # w 2 0.0 - total-2D1314 HN 7 SER HB3 6.00 # w 2 0.0 - total-2D1313 HN 8 ASN HN 4.90 # 2 8316.0 e total-2D7145 HA 7 SER HB2 3.80 # 2 35900.0 e total-2D3382 HA 7 SER HB3 4.00 # 2 29160.0 e total-2D3384 HA 8 ASN HN 5.20 # 2 5447.0 e total-2D8540 8 ASN HN 8 ASN HA 2.90 # 2 186900.0 e total-2D2592 HN 8 ASN HB2 4.50 # 2 14080.0 e total-2D2593 HN 8 ASN HB3 4.20 # 2 20560.0 e total-2D2594 HA 8 ASN HB2 5.10 # 2 6112.0 e total-2D6022 HA 8 ASN HB3 5.80 # 2 3014.0 e total-2D6021 9 LEU HN 9 LEU HA 4.20 # 2 20380.0 e total-2D 200 HN 9 LEU HB2 4.00 # 2 29880.0 e total-2D1017 HN 9 LEU HB3 4.50 # 2 14290.0 e total-2D1156 HN 9 LEU HG 4.70 # 1 8305.0 e total-2D1157 HN 9 LEU QD1 7.00 # w 1M 0.0 - total-2D1158 HN 9 LEU QD2 7.00 # w 1M 0.0 - total-2D1159 HN 10 ASN HN 4.90 # 2 7992.0 e total-2D7144 HA 9 LEU HB2 6.00 ># w 2 1411.0 e total-2D4804 HA 9 LEU HB3 4.40 <# 2 15700.0 e total-2D4764 HA 9 LEU HG 4.70 # 1 8998.0 e total-2D4808 HA 9 LEU QD1 4.10 <# 1M 29240.0 e total-2D4787 HA 9 LEU QD2 4.90 ># 1M 9780.0 e total-2D4760 HB2 9 LEU HG 5.80 ># 1 2467.0 e total-2D4771 HB2 9 LEU QD1 5.80 # 1M 3607.0 e total-2D4768 HB2 9 LEU QD2 5.40 # 1M 5722.0 e total-2D4792 HB2 10 ASN HA 4.60 # 2 12310.0 e total-2D4904 HB3 9 LEU HG 4.20 <# 1 16250.0 e total-2D4773 HB3 9 LEU QD1 5.50 # 1M 4703.0 e total-2D4785 HB3 9 LEU QD2 5.40 # 1M 5423.0 e total-2D4789 HG 9 LEU QD1 6.10 # 1M 2613.0 e total-2D4779 HG 9 LEU QD2 5.50 # 1M 4997.0 e total-2D4791 QD2 10 ASN HA 6.80 # 5M 5832.0 e total-2D4903 10 ASN HN 10 ASN HA 4.30 # 2 17230.0 e total-2D 496 HN 10 ASN HB2 6.00 # w 2 0.0 - total-2D1018 HN 10 ASN HB3 4.60 # 2 12640.0 e total-2D1160 HN 11 LEU HN 4.30 # 2 18800.0 e total-2D7419 HA 10 ASN HB2 4.80 ># 2 9682.0 e total-2D4798 HA 10 ASN HB3 4.00 <# 2 27810.0 e total-2D4799 HA 10 ASN HD21 6.00 ># w 1 1385.0 e total-2D8285 HA 10 ASN HD22 5.40 <# 1 3643.0 e total-2D8286 HA 11 LEU HN 3.90 # 2 34640.0 e total-2D7418 HB2 10 ASN HD21 5.40 # 1 3851.0 e total-2D6595 HB2 10 ASN HD22 5.20 # 1 4992.0 e total-2D8284 HB3 10 ASN HD21 5.00 # 1 6159.0 e total-2D6028 HB3 10 ASN HD22 4.70 # 1 8945.0 e total-2D8283 HB3 11 LEU HN 5.20 # 2 6050.0 e total-2D5810 11 LEU HN 11 LEU HA 4.00 # 2 27870.0 e total-2D2582 HN 11 LEU HB2 4.00 <# 2 27510.0 e total-2D7896 HN 11 LEU HB3 4.80 ># 2 9429.0 e total-2D2581 HN 11 LEU HG 4.30 # 1 16120.0 e total-2D2580 HN 11 LEU QD1 5.70 # 1M 4024.0 e total-2D2578 HN 11 LEU QD2 5.30 # 1M 5954.0 e total-2D2577 HN 12 PHE HN 5.50 # 2 4311.0 e total-2D5991 HN 35 ILE HA 4.30 # 4 8909.0 e total-2D6973 HN 35 ILE QG2 7.00 # w 5M 1062.0 e total-2D8346 HN 36 ARG HN 3.50 # 4 33950.0 e total-2D7299 WWW HA 11 LEU HB2 4.50 # 2 14320.0 e total-2D7362 HA 11 LEU HB3 4.10 # 2 23650.0 e total-2D3388 HA 11 LEU QB 7.00 # m w 2 2112.0*2e total-2D4878 HA 11 LEU HG 4.80 # 1 7834.0 e total-2D4883 HA 11 LEU QD1 5.90 ># 1M 3308.0 e total-2D4887 HA 11 LEU QD2 4.80 <# 1M 10810.0 e total-2D4891 HA 12 PHE HN 3.10 # 2 133000.0 e total-2D2416 HB2 11 LEU QD1 4.80 # 1M 11380.0 e total-2D7897 HB2 11 LEU QD2 4.20 # 1M 24820.0 e total-2D7898 HB2 12 PHE HN 5.80 # 2 3072.0 e total-2D6284 HB3 11 LEU HG 4.10 # 1 21660.0 e total-2D4882 HB3 11 LEU QD1 4.70 # 1M 12670.0 e total-2D4885 HB3 11 LEU QD2 5.40 # 1M 5531.0 e total-2D4889 QB 11 LEU HG 6.20 # m 1 4810.0*2e total-2D4879 QB 11 LEU QD1 7.10 ># m 1M 2635.5*2e total-2D4877 QB 11 LEU QD2 5.00 <# m 1M 35200.0*2e total-2D8300 QB 12 PHE HN 6.20 # m 2 5890.0*2e total-2D2610 HG 11 LEU QD1 5.00 # 1M 8525.0 e total-2D4886 HG 11 LEU QD2 4.40 # 1M 20110.0 e total-2D4890 HG 12 PHE HN 6.00 # w 5 4497.0 e total-2D3031 HG 13 TYR HB3 6.00 # w 5 0.0 e total-2D4942 HG 13 TYR CG 8.00 # r w 5 329.5*2e total-2D8111 QD1 12 PHE HN 6.70 <# 5M 6296.0 e total-2D3029 QD1 13 TYR CG 9.00 # r w 5M 487.0*2e total-2D8303 QD2 12 PHE HN 7.00 ># w 5M 1826.0 e total-2D3028 QD2 13 TYR CG 9.00 # r w 5M 339.0*2e total-2D8299 QD2 35 ILE HB 5.00 # 5M 26860.0 e ! total-2D7546 QD2 35 ILE QG2 6.20 # m 5M 22430.0 e total-2D8452 12 PHE HN 12 PHE HA 3.60 # 2 53410.0 e total-2D 832 HN 12 PHE HB2 4.20 # 2 20150.0 e total-2D1020 HN 12 PHE HB3 4.40 # 2 16300.0 e total-2D2193 HN 12 PHE CG 6.60 # r 1 9645.0*2e total-2D2270 HN 12 PHE CZ 7.00 # m w 1 0.0*2e total-2D2271 HN 13 TYR HN 6.00 # w 2 0.0 e total-2D1341 HA 12 PHE HB2 4.30 # 2 18880.0 e total-2D3392 HA 12 PHE HB3 3.90 # 2 31720.0 e total-2D4759 HA 12 PHE CG 7.00 # m w 1 1711.0*2e total-2D4895 HA 13 TYR HN 3.20 # 2 105600.0 e total-2D2613 HA 36 ARG HN 3.40 # 4 39310.0 e total-2D7302 HA 36 ARG HB2 6.00 <# 5 13720.0 e total-2D7305 HA 36 ARG HB3 6.00 ># w 5 3468.0 e total-2D7304 HA 36 ARG HG2 6.00 # w 5 2266.0 e total-2D7364 HA 36 ARG HG3 6.00 # w 5 2977.0 e total-2D7363 HA 36 ARG QD 7.00 # m w 5 835.5*2e total-2D7365 HB2 12 PHE CG 6.50 # r 1 10770.0*2e total-2D4937 HB2 12 PHE CZ 8.00 # r w 1 1030.0*2e total-2D6361 HB2 13 TYR HN 5.90 # 2 2634.0 e total-2D2612 HB2 36 ARG HB3 6.00 # w 5 2979.0 e total-2D7370 HB2 36 ARG HG3 6.00 # w 5 2116.0 e total-2D7371 HB3 12 PHE CG 7.20 # r 1 5030.0*2e total-2D4938 HB3 12 PHE CZ 8.00 # r w 1 1490.0*2e total-2D6362 HB3 13 TYR HN 5.60 # 2 3621.0 e total-2D2611 HB3 36 ARG HB2 6.00 # w 5 2457.0 e total-2D7369 HB3 36 ARG HB3 6.00 # w 5 2550.0 e total-2D7368 CG 12 PHE CZ 7.30 # rr 1 78325.0*4e total-2D6356 CG 12 PHE HZ 5.30 # r 1 76350.0*2e total-2D6352 CG 36 ARG HB2 8.00 # r w 5 731.0*2e total-2D8455 CG 36 ARG QD 9.00 # rmw 5 190.8*4e total-2D8456 CZ 12 PHE HZ 6.00 # r 1 24785.0*2e total-2D6351 CZ 36 ARG QD 9.00 # rmw 5 367.5*4e total-2D8457 CZ 88 GLN HE21 7.40 # r 5 24040.0*2e total-2D8211 CZ 103 LEU QD1 9.00 # r w 5M 590.0*2e total-2D8454 CZ 103 LEU QD2 9.00 # r w 5M 1042.0*2e total-2D8453 HZ 36 ARG HG2 6.00 # w 5 3365.0 e total-2D7811 HZ 86 VAL QG1 7.00 <# w 5M 3930.0 e total-2D8123 HZ 86 VAL QG2 7.00 ># w 5M 1411.0 e total-2D6301 HZ 88 GLN HE21 6.00 # w 5 1114.0 e total-2D8173 13 TYR HN 13 TYR HA 3.90 # 2 33820.0 e total-2D 103 HN 13 TYR HB2 3.60 <# 2 49820.0 e total-2D1023 HN 13 TYR HB3 4.80 ># 2 8990.0 e total-2D1022 HN 13 TYR CG 7.90 # r 1 2289.0*2e total-2D1340 HN 13 TYR CZ 7.00 # m w 1 381.0*2e total-2D2273 HN 14 THR HN 6.00 # w 2 2198.0 e total-2D2420 HN 36 ARG HN 3.80 # 4 21260.0 e total-2D7298 HN 37 VAL HA 3.30 # 4 46350.0 e total-2D6124 HN 38 GLY HN 3.60 # 4 27440.0 e total-2D7297 HA 13 TYR HB2 5.70 ># 2 3393.0 e total-2D3394 HA 13 TYR HB3 4.40 <# 2 15340.0 e total-2D3398 HA 13 TYR CG 7.00 # m w 1 1167.5*2e total-2D6123 HA 14 THR HN 3.40 # 2 82660.0 e total-2D2419 HB2 13 TYR CG 6.20 # r 1 16320.0*2e total-2D5673 HB2 13 TYR CZ 8.00 # r w 1 1618.5*2e total-2D6131 HB2 14 THR HN 6.00 ># w 2 1509.0 e total-2D2617 HB2 18 ILE QD1 7.00 # w 5M 2266.0 e total-2D7841 HB3 13 TYR CG 6.60 # r 1 10070.0*2e total-2D4939 HB3 13 TYR CZ 8.00 # r 1 1981.0*2e total-2D6132 HB3 14 THR HN 4.70 <# 2 11320.0 e total-2D2616 HB3 18 ILE QD1 7.00 # w 5M 2557.0 e total-2D7840 CG 13 TYR CZ 7.70 # rr 1 40225.0*4e total-2D6127 CG 14 THR HN 8.00 # r w 5 258.0*2e total-2D8304 CG 17 GLU HB2 8.00 # r w 5 3141.5*2e total-2D7917 CG 35 ILE HB 8.00 # r w 5 1377.5*2e total-2D7545 CG 35 ILE QG2 9.00 # r w 5M 991.0*2e total-2D7920 CG 35 ILE QD1 9.00 # r w 5M 1511.5*2e total-2D7849 14 THR HN 14 THR HA 4.60 # 2 12430.0 e total-2D 390 HN 14 THR HB 4.60 # 2 11500.0 e total-2D1024 HN 14 THR QG2 4.30 # 1M 22230.0 e total-2D1315 HN 17 GLU HN 6.00 # w 3 2566.0 e total-2D3178 HN 17 GLU HB3 5.30 # 3 10170.0 e total-2D7508 HA 14 THR HB 3.30 # 2 96220.0 e total-2D3404 HA 14 THR QG2 3.60 # 1M 65570.0 e total-2D3406 HA 15 PRO HG2 6.00 # w 5 924.0 e total-2D6984 HA 15 PRO HG3 6.00 # w 5 1239.0 e total-2D6985 HA 15 PRO HD2 5.60 ># 5 20390.0 e total-2D4910 HA 15 PRO HD3 4.70 <# 5 59840.0 e total-2D4909 HA 37 VAL QG1 7.00 # w 5M 1755.0 e total-2D8128 HA 38 GLY HN 3.50 # 4 33680.0 e total-2D7300 HB 14 THR QG2 3.40 # s 1M 104700.0 e total-2D3407 HB 15 PRO HD2 5.20 <# 5 30890.0 e total-2D4924 HB 15 PRO HD3 6.00 ># w 5 9279.0 e total-2D4921 HB 16 SER HN 6.00 # w 3 2232.0 e total-2D3034 HB 61 ASP HB3 6.00 # w 5 3023.0 e total-2D7834 QG2 15 PRO HG2 7.00 # w 5M 1314.0 e total-2D5312 QG2 15 PRO HD2 7.00 ># w 5M 1120.0 e total-2D4914 QG2 15 PRO HD3 6.50 <# 5M 7322.0 e total-2D4913 QG2 17 GLU HN 6.10 # 5M 10440.0 e total-2D2642 QG2 17 GLU HB2 7.00 # w 5M 3098.0 e total-2D7375 15 PRO HA 15 PRO QB 6.00 # m 2 7110.0*2e total-2D3418 HA 15 PRO HG2 6.00 ># w 1 703.0 e total-2D6580 HA 15 PRO HG3 6.00 <# w 1 1762.0 e total-2D3417 HA 15 PRO HD2 4.00 # 1 23720.0 e total-2D7938 HA 15 PRO HD3 4.60 # 1 10570.0 e total-2D7937 HA 16 SER HN 4.50 # 2 14100.0 e total-2D1320 HA 17 GLU HN 6.00 # 3 4862.0 e total-2D3648 HA 18 ILE HN 5.40 # 3 9998.0 e total-2D3649 HA 18 ILE QG2 7.00 # w 5M 2602.0 e total-2D8460 HA 18 ILE HG12 6.00 # w 5 2150.0 e total-2D7100 HA 18 ILE HG13 6.00 # w 5 2602.0 e total-2D8306 HA 18 ILE QD1 5.40 # 5M 18320.0 e total-2D4917 HA 37 VAL QG1 7.00 # w 5M 3353.0 e total-2D7319 HA 37 VAL QG2 7.00 # w 5M 1686.0 e total-2D5836 HA 67 ILE QG2 6.30 # 5M 8909.0 e total-2D5835 QB 15 PRO HG2 4.90 <# m 1 27480.0*2e total-2D3420 QB 15 PRO HG3 5.60 ># m 1 9645.0*2e total-2D7829 QB 15 PRO HD2 6.20 # m 1 4891.0*2e total-2D6590 QB 16 SER HN 5.40 # m 2 14940.0*2e total-2D1321 QB 18 ILE HG12 7.00 ># m w 5 1761.0*2e total-2D8467 QB 18 ILE HG13 7.00 <# m w 5 5255.0*2e total-2D8308 QB 18 ILE QD1 8.00 # m w 5M 825.0*2e total-2D8462 QB 37 VAL QG1 8.00 # m w 5M 1721.0*2e total-2D8463 QB 37 VAL QG2 8.00 # m w 5M 3597.0*2e total-2D7981 QB 59 VAL QG2 8.00 # m w 5M 1295.0*2e total-2D8307 QB 60 HIS HA 7.00 # m w 5 342.5*2e total-2D8249 QB 66 GLU HA 7.00 # m w 5 1445.5*2e total-2D8459 QB 67 ILE HN 7.00 # m w 5 1510.0*2e total-2D8305 QB 67 ILE QG2 7.30 # m 5M 8675.0*2e total-2D7980 HG2 15 PRO HD2 5.40 # 1 3705.0 e total-2D6588 HG2 15 PRO HD3 4.10 # 1 20200.0 e total-2D3426 HG2 16 SER HN 6.00 # w 5 2434.0 e total-2D1322 HG2 37 VAL QG2 6.80 # 5M 5985.0 e total-2D7940 HG2 59 VAL QG1 6.00 # 5M 10860.0 e total-2D8466 HG2 59 VAL QG2 5.90 # 5M 11840.0 e total-2D8464 HG2 60 HIS HA 6.00 # w 5 5178.0 e total-2D5729 HG3 15 PRO HD2 5.10 # 1 5266.0 e total-2D3431 HG3 15 PRO HD3 4.00 # 1 21820.0 e total-2D3430 HG3 16 SER HN 6.00 # w 5 5142.0 e total-2D1323 HG3 37 VAL QG1 6.60 # 5M 6741.0 e total-2D8465 HG3 37 VAL QG2 6.60 # 5M 6733.0 e total-2D7941 HG3 59 VAL QG2 5.60 # 5M 15350.0 e total-2D8139 HD2 16 SER HN 6.00 <# w 5 8438.0 e total-2D1324 HD2 17 GLU HB2 6.00 # w 5 12150.0 e total-2D7376 HD2 37 VAL QG2 7.00 # w 5M 1331.0 e total-2D7838 HD2 39 GLY HA2 6.00 # w 5 1460.0 e total-2D8461 HD3 16 SER HN 6.00 ># w 5 585.0 e total-2D1326 HD3 37 VAL QG2 6.50 # 5M 7205.0 e total-2D7837 16 SER HN 16 SER HA 4.10 # 2 25580.0 e total-2D 573 HN 16 SER HB2 4.60 # 2 12930.0 e total-2D1025 HN 16 SER HB3 4.10 # 2 23110.0 e total-2D1026 HN 17 GLU HN 3.70 # 2 43780.0 e total-2D1377 HN 18 ILE HN 6.00 # w 3 1507.0 e total-2D7178 HN 65 GLY HN 5.80 # 4 1546.0 e total-2D8298 HN 65 GLY HA2 5.90 # 4 1435.0 e total-2D8053 HA 16 SER HB2 3.00 # 2 149600.0 e total-2D4927 HA 16 SER HB3 3.20 # 2 117600.0 e total-2D4928 HA 17 GLU HN 4.40 # 2 15690.0 e total-2D2424 HA 18 ILE HN 4.90 # 3 17110.0 e total-2D3646 HA 19 VAL HN 5.70 # 3 6833.0 e total-2D7808 HA 19 VAL HB 4.90 # 3 17330.0 e total-2D8181 HA 19 VAL QG1 5.90 <# 5M 11600.0 e total-2D7984 HA 19 VAL QG2 7.00 ># w 5M 3845.0 e total-2D5922 HA 20 ASN HD21 6.00 # w 5 1528.0 e total-2D5878 HA 20 ASN HD22 6.00 # w 5 814.0 e total-2D8469 HA 63 LEU QD1 6.70 # 5M 6094.0 e ! total-2D5923 HA 65 GLY HN 5.60 # 4 1883.0 e total-2D8468 HA 65 GLY HA1 3.80 <# 4 19000.0 e total-2D8397 HA 65 GLY HA2 4.60 ># 4 6114.0 e total-2D7832 HB2 17 GLU HN 4.20 # 2 21150.0 e total-2D2620 HB2 18 ILE HN 5.00 # 3 15790.0 e ! total-2D2628 HB2 19 VAL QG1 7.00 # w 5M 2172.0 e total-2D8470 HB2 20 ASN HD21 6.00 # w 5 1251.0 e total-2D5882 HB2 65 GLY HA2 6.00 # w 5 1911.0 e total-2D8471 HB3 17 GLU HN 4.90 # 2 8645.0 e total-2D2621 HB3 20 ASN HD21 6.00 # w 5 1566.0 e total-2D5881 HB3 61 ASP HB2 6.00 # w 5 1614.0 e total-2D8309 HB3 63 LEU QD1 6.50 # 5M 7084.0 e total-2D8141 HB3 65 GLY HA2 6.00 # w 5 1097.0 e total-2D8509 17 GLU HN 17 GLU HA 4.20 # 2 19870.0 e total-2D 256 HN 17 GLU HB2 4.70 ># 2 10220.0 e total-2D1027 HN 17 GLU HB3 4.00 <# 2 28310.0 e total-2D1028 HN 17 GLU HG2 4.30 # 1 14610.0 e ! total-2D1165 HN 17 GLU HG3 5.00 # 1 6253.0 e total-2D1164 HN 18 ILE HN 3.10 # 2 128500.0 e total-2D2427 HN 18 ILE HG12 6.00 # w 5 1455.0 e total-2D6924 HA 17 GLU HB2 4.80 <# 2 9952.0 e total-2D5766 HA 17 GLU HB3 5.80 ># 2 3072.0 e total-2D3446 HA 17 GLU HG2 5.90 ># 1 2214.0 e total-2D5768 HA 17 GLU HG3 4.90 <# 1 6691.0 e total-2D6197 HA 18 ILE HN 5.80 # 2 2907.0 e total-2D2426 HA 19 VAL HN 6.00 # w 3 1141.0 e total-2D7809 HA 20 ASN HN 5.40 # 3 9691.0 e total-2D7810 HB2 17 GLU HG2 3.90 # 1 27150.0 e total-2D3443 HB2 17 GLU HG3 3.70 # 1 34690.0 e total-2D3448 HB2 18 ILE HN 5.90 # 2 2772.0 e total-2D2623 HB2 18 ILE QD1 7.00 # w 5M 4094.0 e total-2D7383 HB3 17 GLU HG2 2.80 # 1 184800.0 e total-2D3451 HB3 17 GLU HG3 5.60 # 1 2944.0 e total-2D3440 HB3 18 ILE HN 5.50 # 2 4262.0 e total-2D2626 HG2 18 ILE HN 6.00 # w 5 2403.0 e total-2D2625 HG3 22 LYS HA 6.00 # w 5 899.0 e ! total-2D8160 18 ILE HN 18 ILE HA 3.80 # 2 41510.0 e total-2D 692 HN 18 ILE HB 3.90 # 2 33110.0 e total-2D1029 HN 18 ILE QG2 4.80 # 1M 10720.0 e total-2D1169 HN 18 ILE HG12 4.20 # 1 16530.0 e total-2D1166 HN 18 ILE HG13 4.00 # 1 25210.0 e total-2D1167 HN 18 ILE QD1 5.30 # 1M 6383.0 e total-2D1168 HN 19 VAL HN 3.70 # 2 48800.0 e total-2D3175 HN 19 VAL QG1 7.00 # w 5M 1045.0 e total-2D8567 HN 20 ASN HN 6.00 # w 3 1100.0 e total-2D7510 HA 18 ILE HB 4.30 # 2 19230.0 e total-2D4819 HA 18 ILE QG2 4.20 # 1M 26590.0 e total-2D3486 HA 18 ILE HG12 4.20 # 1 18480.0 e total-2D6782 HA 18 ILE HG13 3.60 # 1 42980.0 e ! total-2D3476 HA 18 ILE QD1 5.40 # 1M 5621.0 e total-2D4815 HA 19 VAL HN 4.90 # 2 7785.0 e total-2D2428 HA 20 ASN HN 6.00 # w 3 531.0 e total-2D7181 HA 22 LYS QG 7.00 # m w 5 3638.5*2e total-2D8473 HA 23 THR HB 6.00 # w 5 842.0 e total-2D8310 HA 29 PRO HD2 6.00 # w 5 3828.0 e total-2D8134 HB 18 ILE QG2 4.10 # 1M 30430.0 e total-2D3471 HB 18 ILE HG12 2.90 # 1 160700.0 e total-2D3468 HB 18 ILE HG13 3.20 # 1 93580.0 e total-2D3470 HB 18 ILE QD1 4.40 # 1M 19690.0 e total-2D3469 HB 19 VAL HN 4.60 # 2 12270.0 e total-2D5702 HB 23 THR HB 6.00 # w 5 3665.0 e total-2D8472 HB 67 ILE QG1 7.00 # m w 5 3386.5*2e total-2D8054 QG2 18 ILE HG12 4.40 ># 1M 19680.0 e total-2D6957 QG2 18 ILE HG13 3.40 <# s 1M 855600.0 e total-2D6437 QG2 18 ILE QD1 4.50 # m 1M 72620.0 e total-2D6436 QG2 19 VAL HN 6.90 # 5M 5588.0 e total-2D2633 QG2 22 LYS HB3 7.00 # w 5M 3669.0 e total-2D8312 QG2 22 LYS HD2 7.00 # w 5M 2124.0 e total-2D8317 QG2 29 PRO HD2 7.00 ># w 5M 1466.0 e total-2D8137 QG2 29 PRO HD3 6.80 <# 5M 5888.0 e total-2D8252 HG12 18 ILE QD1 3.40 <# s 1M 126900.0 e total-2D3472 HG12 19 VAL HN 6.00 ># w 5 662.0 e total-2D3041 HG12 37 VAL QG1 6.80 # 5M 5833.0 e total-2D8314 HG12 37 VAL QG2 6.00 # 5M 11330.0 e total-2D8474 HG13 18 ILE QD1 4.30 ># 1M 21460.0 e total-2D5416 HG13 19 VAL HN 6.00 <# w 5 3874.0 e total-2D2632 QD1 19 VAL HN 7.00 # w 5M 1339.0 e total-2D3040 QD1 35 ILE QD1 5.00 # m 5M 81240.0 e total-2D8315 QD1 37 VAL HB 6.20 # 5M 9612.0 e total-2D8313 QD1 37 VAL QG1 5.40 # m 5M 55470.0 e total-2D8316 19 VAL HN 19 VAL HA 3.90 # 2 30800.0 e total-2D 686 HN 19 VAL HB 3.80 # 2 41010.0 e total-2D5703 HN 19 VAL QG1 4.50 <# 1M 17540.0 e total-2D1171 HN 19 VAL QG2 5.20 ># 1M 6580.0 e total-2D1172 HN 20 ASN HN 3.40 # 2 81150.0 e total-2D1396 HN 20 ASN HD22 5.10 # 5 35770.0 e total-2D8319 HN 21 GLY HN 6.00 # w 3 1025.0 e total-2D8318 HA 19 VAL HB 4.20 # 2 21560.0 e total-2D3487 HA 19 VAL QG1 3.60 # 1M 60590.0 e total-2D3488 HA 19 VAL QG2 3.90 # 1M 40950.0 e total-2D3493 HA 20 ASN HN 5.00 # 2 7191.0 e total-2D3636 HA 67 ILE QD1 7.00 # w 5M 3833.0 e total-2D8321 HB 19 VAL QG1 4.20 # 1M 25470.0 e total-2D3491 HB 19 VAL QG2 4.00 # 1M 31540.0 e total-2D3492 HB 20 ASN HN 4.70 # 2 10060.0 e total-2D2643 HB 20 ASN HD22 5.50 # 5 21680.0 e total-2D2791 HB 67 ILE HB 6.00 # w 5 8510.0 e total-2D8475 HB 67 ILE QD1 6.40 # 5M 7685.0 e ! total-2D7385 QG1 20 ASN HN 5.30 # 5M 20940.0 e total-2D2644 QG1 20 ASN HD21 7.00 # w 5M 1385.0 e total-2D6545 QG1 20 ASN HD22 6.30 # 5M 8691.0 e total-2D6593 QG1 22 LYS HN 7.00 # w 5M 2121.0 e ! total-2D7953 QG1 66 GLU HN 7.00 # w 5M 2346.0 e total-2D8568 QG2 20 ASN HN 6.10 # 5M 10220.0 e total-2D2645 QG2 20 ASN HD21 7.00 # w 5M 4008.0 e total-2D3448 QG2 20 ASN HD22 6.50 # 5M 7384.0 e total-2D2790 QG2 66 GLU HN 7.00 # w 5M 1299.0 e total-2D7936 QG2 67 ILE QD1 5.90 # m 5M 31090.0 e ! total-2D8476 20 ASN HN 20 ASN HA 3.70 # 2 48980.0 e total-2D 398 HN 20 ASN HB2 4.30 # 2 17860.0 e total-2D1031 HN 20 ASN HB3 4.20 # 2 20550.0 e total-2D1032 HN 20 ASN HD21 4.40 <# 1 13360.0 e total-2D5874 HN 20 ASN HD22 6.00 ># w 1 1102.0 e total-2D2289 HN 21 GLY HN 4.20 # 2 21280.0 e total-2D1410 HN 22 LYS HN 6.00 # w 3 2879.0 e total-2D8480 HN 22 LYS HB2 6.00 # w 3 4408.0 e total-2D8477 HN 24 ASP QB 7.00 # m w 3 3479.0*2e total-2D8478 HA 20 ASN HB2 4.90 ># 2 8408.0 e total-2D3499 HA 20 ASN HB3 4.00 <# 2 26910.0 e total-2D3501 HA 21 GLY HN 5.40 # 2 4793.0 e total-2D2430 HB2 20 ASN HD21 3.80 # 1 29500.0 e total-2D2742 HB2 20 ASN HD22 4.30 # 1 14840.0 e total-2D3043 HB2 21 GLY HN 4.40 # 2 16360.0 e total-2D2648 HB3 20 ASN HD21 3.50 # 1 48510.0 e total-2D5656 HB3 20 ASN HD22 4.50 # 1 11400.0 e total-2D3042 HB3 21 GLY HN 4.50 # 2 13040.0 e total-2D2647 HD21 21 GLY HN 6.00 # w 5 665.0 e total-2D8323 21 GLY HN 21 GLY HA1 3.50 # 2 59320.0 e total-2D1000 HN 21 GLY HA2 3.60 # 2 56800.0 e total-2D1001 HN 22 LYS HN 5.10 # 2 6530.0 e total-2D1420 HN 25 THR HN 6.00 # w 3 3671.0 e total-2D8479 HA1 22 LYS HN 3.60 # 2 53720.0 e total-2D2432 HA1 25 THR HN 6.00 # w 3 2005.0 e total-2D8330 HA1 25 THR HB 6.00 # 3 5040.0 e total-2D8223 HA1 28 LYS HG3 6.00 # w 5 1235.0 e ! total-2D8158 HA2 22 LYS HN 3.50 # 2 67960.0 e total-2D2431 HA2 27 VAL QG2 7.00 # w 5M 3106.0 e total-2D8178 HA2 28 LYS HG3 6.00 # w 5 492.0 e ! total-2D8159 22 LYS HN 22 LYS HA 4.90 # 2 7764.0 e total-2D 888 HN 22 LYS HB2 4.00 # 2 27320.0 e total-2D1033 HN 22 LYS HB3 3.80 # 2 37430.0 e total-2D1034 HN 22 LYS QG 5.80 # m 1 7715.0*2e total-2D1173 HN 22 LYS HD2 6.00 ># w 1 1696.0 e total-2D1178 HN 22 LYS HD3 5.20 <# 1 4664.0 e total-2D1179 HN 22 LYS HE2 6.00 # w 1 0.0 e total-2D1181 HN 22 LYS HE3 6.00 # w 1 0.0 e total-2D1180 HN 23 THR HN 4.10 # 2 22820.0 e total-2D6034 HN 25 THR HN 6.00 # w 3 1376.0 e total-2D8325 HN 26 GLY HN 6.00 # w 3 416.0 e total-2D8324 HN 27 VAL HN 3.90 # 4 16490.0 e ! total-2D7797 HN 27 VAL QG1 7.00 # w 5M 1148.0 e total-2D7951 HN 27 VAL QG2 7.00 # w 5M 1470.0 e total-2D7952 HA 22 LYS HB2 4.80 # 2 9197.0 e total-2D5281 HA 22 LYS HB3 4.90 # 2 8575.0 e total-2D3511 HA 22 LYS QG 4.90 # i 1 15445.0*2e total-2D3545 HA 22 LYS HD2 5.20 # 1 4936.0 e total-2D3514 HA 22 LYS HD3 4.50 # 1 10690.0 e total-2D3513 HA 22 LYS HE3 6.00 # w 1 952.0 e total-2D6783 HA 23 THR HN 4.20 # 2 19910.0 e total-2D2655 HA 24 ASP HN 6.00 # w 3 2116.0 e total-2D7185 HA 25 THR HN 6.00 # w 3 1581.0 e total-2D7186 HB2 22 LYS QG 5.40 # m 1 13005.0*2e total-2D5775 HB2 22 LYS HD2 6.00 # w 1 1169.0 e total-2D3519 HB2 22 LYS HD3 5.30 # 1 4286.0 e total-2D3518 HB2 22 LYS HE2 4.90 # 1 7092.0 e total-2D3554 HB2 22 LYS HE3 4.50 # 1 11450.0 e total-2D3555 HB2 23 THR HN 5.40 # 2 4486.0 e total-2D2654 HB2 24 ASP HN 5.50 # 3 8904.0 e total-2D2657 HB2 25 THR HN 6.00 # w 3 4070.0 e total-2D2660 HB2 26 GLY HN 6.00 # w 3 4617.0 e total-2D3053 HB2 27 VAL HN 6.00 # w 5 2510.0 e total-2D7807 HB2 29 PRO HG3 6.00 # w 5 515.0 e total-2D8482 HB3 22 LYS QG 5.60 # m 1 10415.0*2e total-2D7412 HB3 22 LYS HD2 4.50 # 1 12000.0 e total-2D3530 HB3 22 LYS HD3 5.00 # 1 6279.0 e total-2D3539 HB3 22 LYS HE2 6.00 # w 1 578.0 e total-2D6784 HB3 23 THR HN 5.20 # 2 5617.0 e total-2D3048 HB3 23 THR HA 6.00 # 2 2346.0 e total-2D5283 HB3 23 THR HB 6.00 # w 5 1300.0 e total-2D8326 HB3 25 THR HN 6.00 # w 3 2238.0 e total-2D2659 HB3 27 VAL HN 6.00 # w 5 2829.0 e total-2D8155 QG 22 LYS HD2 4.50 <# m 1 51350.0*2e total-2D5774 QG 22 LYS HD3 5.80 ># m 1 7680.0*2e total-2D3541 QG 22 LYS HE2 7.00 # m w 1 0.0*2e total-2D5780 QG 22 LYS HE3 6.20 # m 1 4576.5*2e total-2D3548 QG 23 THR HN 7.00 # m w 5 269.0*2e total-2D3047 QG 24 ASP HN 7.00 # m w 5 4016.5*2e total-2D3050 QG 25 THR HN 7.00 # m w 5 1410.5*2e total-2D3075 QG 29 PRO HG3 7.00 # m w 5 5430.0*2e total-2D8336 HD2 22 LYS HE2 5.10 # 1 5517.0 e total-2D5781 HD2 22 LYS HE3 5.00 # 1 6400.0 e total-2D3550 HD2 28 LYS HB2 6.00 # w 5 3442.0 e total-2D8483 HD3 22 LYS HE2 4.30 # 1 15190.0 e total-2D3527 HD3 22 LYS HE3 4.60 # 1 9815.0 e total-2D3549 HD3 23 THR HN 6.00 # w 5 756.0 e total-2D3046 HE2 28 LYS HB2 6.00 # w 5 1075.0 e total-2D8481 23 THR HN 23 THR HA 3.70 # 2 46600.0 e total-2D1002 HN 23 THR HB 3.80 # 2 38340.0 e total-2D1035 HN 23 THR QG2 4.80 # 1M 11590.0 e total-2D1182 HN 24 ASP HN 4.60 # 2 12790.0 e total-2D1430 HN 25 THR HN 6.00 # w 3 1672.0 e total-2D6460 HA 23 THR HB 3.80 # 2 38420.0 e total-2D5765 HA 23 THR QG2 4.00 # 1M 31710.0 e total-2D6154 HA 24 ASP HN 3.80 # 2 38010.0 e total-2D2434 HA 24 ASP HA 5.00 # 2 7326.0 e total-2D7861 HA 25 THR HN 5.10 # 3 13020.0 e total-2D2662 HA 26 GLY HA1 4.80 # 3 19650.0 e total-2D8560 HA 26 GLY HA2 4.60 # 3 24710.0 e total-2D8333 HA 27 VAL HN 6.00 # 3 4956.0 e total-2D8558 HA 31 ALA HA 6.00 # 4 1286.0 e total-2D8183 HB 23 THR QG2 5.50 # 1M 5130.0 e total-2D6153 HB 24 ASP HN 5.70 # 2 3297.0 e total-2D3052 HB 25 THR HN 6.00 # w 3 4090.0 e total-2D7958 QG2 24 ASP HN 6.10 # 5M 10420.0 e total-2D2658 QG2 24 ASP HA 6.20 # 5M 9010.0 e total-2D7205 QG2 24 ASP QB 8.00 # m w 5M 1491.5*2e total-2D7857 QG2 25 THR HN 7.00 # w 5M 869.0 e total-2D7660 QG2 67 ILE QG1 6.80 # m 5M 12935.0*2e total-2D8060 QG2 67 ILE QD1 7.00 # m 5M 10800.0 e total-2D7872 QG2 91 LEU QD1 6.00 # m 5M 27380.0 e total-2D8143 QG2 95 GLY HN 7.00 # w 5M 1674.0 e total-2D8327 QG2 95 GLY HA1 7.00 # w 5M 1281.0 e total-2D8328 24 ASP HN 24 ASP HA 3.70 # 2 48480.0 e total-2D 277 HN 24 ASP QB 4.90 # i 2 17200.0*2e total-2D1038 HN 25 THR HN 4.00 # 2 30510.0 e total-2D1427 HN 26 GLY HN 6.00 # w 3 2640.0 e total-2D7666 HA 24 ASP QB 4.10 # i 2 59450.0*2e total-2D6155 HA 25 THR HN 4.60 # 2 12910.0 e total-2D2435 HA 26 GLY HN 6.00 # w 3 1857.0 e total-2D7292 HA 26 GLY HA2 6.00 # w 3 3878.0 e total-2D7221 HA 67 ILE QG1 7.00 # m w 5 940.0*2e total-2D8180 HA 95 GLY HA1 5.60 # 4 1957.0 e total-2D8329 QB 25 THR HN 5.70 # m 2 11035.0*2e total-2D2661 QB 25 THR QG2 8.00 # m w 5M 3721.0*2e total-2D7858 25 THR HN 25 THR HA 3.90 # 2 34500.0 e total-2D 680 HN 25 THR HB 4.50 # 2 13120.0 e total-2D1039 HN 25 THR QG2 4.80 # 1M 11090.0 e total-2D1184 HN 26 GLY HN 3.40 # 2 70610.0 e total-2D1440 HN 27 VAL HN 6.00 # w 3 3207.0 e total-2D6035 HA 25 THR HB 3.50 # 2 65670.0 e total-2D5104 HA 25 THR QG2 3.50 # 1M 73430.0 e total-2D6158 HA 26 GLY HN 3.60 # 2 55460.0 e total-2D2436 HA 26 GLY HA1 5.80 # 2 2911.0 e total-2D8215 HA 26 GLY HA2 6.00 # 2 2462.0 e total-2D7222 HA 27 VAL HN 6.00 # w 3 2126.0 e total-2D6772 HA 27 VAL QG1 7.00 # w 5M 2351.0 e total-2D7852 HA 27 VAL QG2 7.00 # w 5M 2490.0 e total-2D7330 HB 25 THR QG2 3.40 # s 1M 121600.0 e total-2D3570 HB 26 GLY HN 4.10 # 2 23720.0 e total-2D7518 HB 27 VAL HN 5.80 # 3 6305.0 e total-2D3324 HB 27 VAL HA 6.00 # w 3 3685.0 e total-2D7869 HB 27 VAL HB 6.00 # w 5 3321.0 e total-2D7664 HB 27 VAL QG1 6.60 # 5M 6974.0 e total-2D5106 HB 27 VAL QG2 6.60 # 5M 6974.0 e total-2D7329 QG2 26 GLY HN 5.90 # 5M 11430.0 e total-2D2664 QG2 26 GLY HA2 7.00 # w 5M 2317.0 e total-2D5338 QG2 27 VAL HN 6.70 # 5M 6431.0 e total-2D5814 QG2 27 VAL HB 5.90 # 5M 11530.0 e total-2D5341 QG2 27 VAL QG1 5.70 # m 5M 38490.0 e total-2D8331 QG2 27 VAL QG2 5.70 # m 5M 38770.0 e total-2D8332 26 GLY HN 26 GLY HA1 3.40 # 2 69580.0 e total-2D1444 HN 26 GLY HA2 3.70 # 2 44130.0 e total-2D1443 HN 27 VAL HN 3.80 # 2 41190.0 e total-2D1451 HN 27 VAL HA 5.90 # 2 2574.0 e total-2D7335 HN 28 LYS HN 6.00 # w 3 3881.0 e total-2D7998 HA1 27 VAL HN 4.40 # 2 15930.0 e total-2D2437 HA2 27 VAL HN 5.00 # 2 7215.0 e total-2D2438 HA2 29 PRO HG2 6.00 # w 5 4862.0 e total-2D8485 HA2 29 PRO HD2 6.00 # w 5 1145.0 e total-2D8486 27 VAL HN 27 VAL HA 3.70 # 2 48380.0 e total-2D 893 HN 27 VAL HB 4.30 # 2 19180.0 e total-2D1040 HN 27 VAL QG1 4.30 # 1M 22940.0 e total-2D2556 HN 27 VAL QG2 4.10 # 1M 31320.0 e total-2D2675 HN 28 LYS HN 6.00 # 2 2528.0 e total-2D2301 HN 28 LYS HB2 6.00 # w 2 872.0 e total-2D7194 HA 27 VAL HB 4.20 # 2 20930.0 e total-2D3577 HA 27 VAL QG1 4.60 # 1M 14630.0 e total-2D3582 HA 27 VAL QG2 5.00 # 1M 8811.0 e total-2D3583 HA 28 LYS HN 3.60 # 2 58010.0 e ! total-2D2439 HA 28 LYS HG3 6.00 # w 5 1672.0 e total-2D7523 HA 28 LYS QD 7.00 # m w 5 168.0*2e ! total-2D7866 HB 27 VAL QG1 4.30 # 1M 22270.0 e total-2D3581 HB 27 VAL QG2 4.40 # 1M 18650.0 e total-2D3580 HB 28 LYS HN 6.00 # w 2 1299.0 e total-2D6452 QG1 28 LYS HN 4.20 <# 5M 69980.0 e total-2D2674 QG2 28 LYS HN 6.00 ># 5M 10560.0 e total-2D8334 QG2 28 LYS HA 7.00 # w 5M 1832.0 e total-2D8488 QG2 28 LYS HG3 5.00 # 5M 28400.0 e total-2D8487 28 LYS HN 28 LYS HA 4.00 # 2 27630.0 e total-2D 60 HN 28 LYS HB2 5.30 ># 2 5223.0 e total-2D1041 HN 28 LYS HB3 4.10 <# 2 24410.0 e total-2D1042 HN 28 LYS HG2 4.60 # 1 9452.0 e total-2D1187 HN 28 LYS HG3 4.50 # 1 11870.0 e total-2D1188 HN 28 LYS QD 6.40 # m 1 3721.0*2e total-2D1189 HN 28 LYS HE2 6.00 # w 1 1272.0 e total-2D1191 HN 28 LYS HE3 6.00 # w 1 0.0 - total-2D1190 HN 29 PRO HD2 6.00 <# w 5 5843.0 e total-2D7524 HN 29 PRO HD3 6.00 ># w 5 544.0 e total-2D7414 HA 28 LYS HB2 4.80 <# 2 9643.0 e total-2D3586 HA 28 LYS HB3 6.00 ># w 2 1897.0 e total-2D3596 HA 28 LYS HG2 4.90 # 1 6879.0 e total-2D6790 HA 28 LYS HG3 5.10 # 1 5627.0 e total-2D6788 HA 28 LYS QD 5.30 # m 1 14975.0*2e total-2D6789 HA 28 LYS HE3 4.80 # 1 7862.0 e total-2D6791 HA 29 PRO HD2 4.80 # 5 49920.0 e total-2D7803 HA 29 PRO HD3 5.40 # 5 24550.0 e total-2D6412 HB2 28 LYS HG2 3.90 # 1 28840.0 e total-2D3590 HB2 28 LYS HG3 4.50 # 1 11930.0 e total-2D3592 HB2 28 LYS QD 6.50 ># m 1 3515.5*2e total-2D3614 HB2 28 LYS HE2 5.10 # 1 5189.0 e total-2D3620 HB2 29 PRO HD2 6.00 # w 5 7792.0 e total-2D6314 HB2 29 PRO HD3 6.00 # w 5 2377.0 e total-2D6478 HB3 28 LYS HG2 3.60 # 1 42490.0 e total-2D3593 HB3 28 LYS HG3 4.30 # 1 14560.0 e total-2D3595 HB3 28 LYS QD 4.50 <# m 1 56550.0*2e total-2D3615 HB3 28 LYS HE2 4.80 # 1 7461.0 e total-2D3622 HB3 29 PRO HB3 6.00 # w 5 11120.0 e total-2D6482 HB3 29 PRO HG2 6.00 # w 5 5381.0 e total-2D6481 HB3 29 PRO HD2 6.00 # w 5 5184.0 e total-2D7805 HB3 29 PRO HD3 6.00 # w 5 1692.0 e total-2D7804 HG2 28 LYS QD 4.40 <# m 1 59450.0*2e total-2D3613 HG2 28 LYS HE2 5.40 # 1 3595.0 e total-2D3621 HG2 28 LYS HE3 5.50 # 1 3280.0 e total-2D5998 HG3 28 LYS QD 5.70 ># m 1 8995.0*2e total-2D3612 HG3 28 LYS HE2 4.60 # 1 10340.0 e total-2D3627 HG3 28 LYS HE3 6.00 # w 1 838.0 e total-2D5999 QD 28 LYS HE2 5.30 # m 1 15445.0*2e total-2D3623 QD 28 LYS HE3 7.00 # m w 1 0.0*2e total-2D3616 29 PRO HA 29 PRO HB2 4.60 # 2 12060.0 e total-2D5894 HA 29 PRO HB3 4.20 # 2 20700.0 e total-2D5893 HA 29 PRO HG2 4.00 # 1 22880.0 e total-2D5913 HA 29 PRO HG3 4.50 # 1 11140.0 e total-2D5910 HA 29 PRO HD3 6.00 # w 1 1021.0 e total-2D6594 HA 30 GLU HN 3.80 # 2 39160.0 e total-2D3433 HA 30 GLU QG 7.00 # m w 5 782.0*2e total-2D6490 HA 33 GLN HE21 6.00 # w 5 2718.0 e total-2D7155 HA 33 GLN HE22 6.00 # w 5 1257.0 e total-2D7232 HA 35 ILE QG2 7.00 # w 5M 1590.0 e total-2D8144 HB2 29 PRO HG2 3.50 # 1 48490.0 e total-2D6307 HB2 29 PRO HG3 3.40 # 1 59610.0 e total-2D6311 HB2 29 PRO HD2 6.00 # w 1 991.0 e total-2D5898 HB2 29 PRO HD3 5.40 # 1 3913.0 e total-2D5916 HB2 30 GLU HN 4.50 <# 2 13560.0 e total-2D3435 HB2 30 GLU QG 7.00 # m w 5 7125.0*2e total-2D6489 HB2 35 ILE QD1 7.00 # w 5M 4178.0 e total-2D8145 HB3 29 PRO HG2 3.60 # 1 44310.0 e total-2D6305 HB3 29 PRO HG3 3.60 # 1 45860.0 e total-2D6312 HB3 29 PRO HD2 5.10 # 1 5138.0 e total-2D5897 HB3 29 PRO HD3 4.70 # 1 9245.0 e total-2D5915 HB3 30 GLU HN 5.40 ># 2 4492.0 e total-2D3436 HB3 35 ILE QD1 6.60 # 5M 6668.0 e total-2D8146 HG2 29 PRO HD2 4.10 # 1 21120.0 e total-2D5890 HG2 29 PRO HD3 4.60 # 1 9672.0 e total-2D5911 HG2 30 GLU HN 6.00 # w 5 9324.0 e total-2D3437 HG2 35 ILE QD1 6.70 # 5M 6279.0 e total-2D8270 HG3 29 PRO HD2 4.70 # 1 8308.0 e total-2D5895 HG3 29 PRO HD3 3.90 # 1 27180.0 e total-2D5908 HG3 30 GLU HN 5.90 # 5 15000.0 e total-2D3438 30 GLU HN 30 GLU HA 4.00 # 2 28290.0 e total-2D 768 HN 30 GLU HB2 4.60 ># 2 12880.0 e total-2D1043 HN 30 GLU HB3 3.90 <# 2 32280.0 e total-2D1192 HN 30 GLU QG 5.20 # m 1 16300.0*2e total-2D1193 HN 31 ALA HN 4.90 # 2 7828.0 e total-2D6492 HN 31 ALA QB 7.00 # w 2M 0.0 e total-2D7525 HN 33 GLN HB2 5.60 # 3 7876.0 e total-2D8196 HN 33 GLN HB3 6.00 # w 3 4089.0 e total-2D7043 HN 33 GLN HG3 6.00 # w 5 5411.0 e total-2D7911 HN 33 GLN HE21 5.70 <# 5 17930.0 e total-2D8337 HN 33 GLN HE22 6.00 ># w 5 3527.0 e total-2D8489 HA 30 GLU HB2 3.60 # 2 56410.0 e total-2D5755 HA 30 GLU HB3 4.10 # 2 24760.0 e total-2D5756 HA 30 GLU QG 4.40 # i 1 31890.0*2e total-2D5754 HA 31 ALA HN 3.80 # 2 35770.0 e total-2D2689 HA 31 ALA HA 6.00 # w 2 1608.0 e total-2D6425 HA 31 ALA QB 5.90 # 2M 1331.0 e total-2D5347 HB2 30 GLU QG 4.40 # m 1 64600.0*2e total-2D5757 HB2 31 ALA HN 4.50 # 2 13750.0 e total-2D2687 HB2 31 ALA QB 6.60 # 5M 6578.0 e total-2D7246 HB2 33 GLN HE22 6.00 # w 5 4806.0 e total-2D8338 HB3 30 GLU QG 4.10 # m 1 103800.0*2e total-2D3639 HB3 31 ALA HN 4.30 # 2 19120.0 e total-2D2686 HB3 33 GLN HG2 6.00 # w 5 1379.0 e total-2D7528 HB3 33 GLN HG3 6.00 # w 5 921.0 e total-2D7529 HB3 33 GLN HE21 6.00 # w 5 3305.0 e total-2D8063 HB3 33 GLN HE22 6.00 # w 5 4130.0 e total-2D8062 QG 31 ALA HN 7.00 # m w 5 5620.0*2e total-2D2688 QG 33 GLN HE21 7.00 <# m w 5 5810.0*2e total-2D7848 QG 33 GLN HE22 7.00 ># m w 5 1480.5*2e total-2D7846 31 ALA HN 31 ALA HA 3.70 # 2 42910.0 e total-2D 974 HN 31 ALA QB 3.40 # s 2M 83750.0 e total-2D1044 HN 32 GLY HN 5.10 # 2 6612.0 e total-2D1501 HN 91 LEU QD2 7.00 # w 5M 1604.0 e total-2D7530 HA 31 ALA QB 3.40 # s 2M 81940.0 e total-2D5113 HA 32 GLY HN 3.10 # 2 129600.0 e total-2D2441 HA 32 GLY HA1 6.00 # 2 2457.0 e total-2D7243 HA 32 GLY HA2 6.00 # w 2 1289.0 e total-2D7536 HA 33 GLN HN 6.00 # w 3 2374.0 e total-2D3626 HA 91 LEU HB2 6.00 # w 5 3525.0 e total-2D7111 HA 91 LEU HG 6.00 # w 5 5002.0 e total-2D8339 HA 91 LEU QD1 7.00 # w 5M 3107.0 e total-2D8246 HA 91 LEU QD2 7.00 # w 5M 3059.0 e total-2D7241 HA 97 LEU QD2 7.00 # w 5M 2650.0 e ! total-2D7239 QB 32 GLY HN 4.00 # 2M 14230.0 e total-2D2692 QB 33 GLN HN 5.70 # 3M 1373.0 e total-2D7854 QB 91 LEU HA 7.00 # w 5M 1126.0 e total-2D7828 QB 91 LEU HB2 7.00 # w 5M 706.0 e total-2D8340 QB 92 GLY HA2 6.10 # 5M 10430.0 e total-2D7416 QB 93 GLU HN 7.00 # w 5M 809.0 e total-2D7927 QB 93 GLU HA 5.70 # 5M 14160.0 e total-2D6068 QB 93 GLU HB2 7.00 # w 5M 879.0 e total-2D7117 QB 93 GLU QG 7.00 # m 5M 10520.0*2e total-2D6541 QB 94 ASP HN 7.00 # w 5M 1105.0 e total-2D6987 QB 95 GLY HN 7.00 # w 5M 3254.0 e total-2D7853 32 GLY HN 32 GLY HA1 3.30 <# 2 96560.0 e total-2D 577 HN 32 GLY HA2 3.80 ># 2 38170.0 e total-2D5604 HN 33 GLN HN 3.40 # 2 74940.0 e total-2D1522 HN 90 VAL QG2 5.50 # 5M 17570.0 e total-2D5714 HN 91 LEU HB2 6.00 <# w 5 7269.0 e total-2D7503 HN 91 LEU HB3 6.00 ># w 5 2360.0 e total-2D7534 HN 97 LEU QD2 7.00 # w 5M 1214.0 e ! total-2D7960 HA1 33 GLN HN 4.50 ># 2 13940.0 e total-2D2442 HA1 90 VAL QG2 5.60 # 5M 15460.0 e total-2D5231 HA2 33 GLN HN 3.60 <# 2 49700.0 e total-2D7533 HA2 90 VAL QG2 6.00 # 5M 10680.0 e total-2D8216 33 GLN HN 33 GLN HA 3.60 # 2 53400.0 e total-2D 856 HN 33 GLN HB2 3.70 <# 2 43970.0 e total-2D1046 HN 33 GLN HB3 4.30 ># 2 17360.0 e total-2D1194 HN 33 GLN HG2 4.20 # 1 17500.0 e total-2D1196 HN 33 GLN HG3 3.80 # 1 31790.0 e total-2D1195 HN 33 GLN HE21 5.10 # 1 5586.0 e total-2D2288 HN 33 GLN HE22 6.00 # w 1 0.0 - total-2D8065 HN 34 ARG HN 4.80 # 2 9320.0 e total-2D1526 HN 90 VAL HB 6.00 # w 5 5221.0 e total-2D5969 HN 90 VAL QG2 7.00 # 5M 5030.0 e total-2D6608 HN 91 LEU HN 4.10 # 4 13340.0 e total-2D7036 HN 91 LEU HB2 6.00 <# w 5 2478.0 e total-2D7537 HN 91 LEU HB3 6.00 ># w 5 524.0 e total-2D8438 HN 97 LEU QD2 7.00 # w 5M 917.0 e ! total-2D6898 HA 33 GLN HB2 4.10 # 2 24480.0 e total-2D5121 HA 33 GLN HB3 4.10 # 2 25140.0 e total-2D5120 HA 33 GLN HG2 4.10 # 1 18690.0 e total-2D5122 HA 33 GLN HG3 4.30 # 1 15130.0 e total-2D6159 HA 34 ARG HN 3.40 # 2 78360.0 e total-2D2444 HA 35 ILE QG2 6.10 # 5M 9828.0 e total-2D7871 HA 90 VAL QG2 7.00 # w 5M 2823.0 e total-2D8344 HB2 33 GLN HG2 3.40 # 1 61580.0 e total-2D3658 HB2 33 GLN HG3 3.40 # 1 65910.0 e total-2D6160 HB2 33 GLN HE21 5.60 # 1 3192.0 e total-2D2757 HB2 34 ARG HN 4.70 # 2 10200.0 e total-2D2698 HB2 35 ILE QG2 6.30 # 5M 8307.0 e total-2D7168 HB3 33 GLN HG2 3.30 # 1 79740.0 e total-2D3663 HB3 33 GLN HG3 3.50 # 1 50610.0 e total-2D3664 HB3 33 GLN HE21 6.00 # w 1 1787.0 e total-2D8343 HB3 33 GLN HE22 6.00 # w 1 957.0 e total-2D8342 HB3 34 ARG HN 4.70 # 2 9984.0 e total-2D2697 HB3 35 ILE QG2 6.90 # 5M 5335.0 e total-2D7169 HG2 33 GLN HE21 3.70 # 1 40650.0 e total-2D5641 HG2 33 GLN HE22 4.30 # 1 14150.0 e total-2D5674 HG3 33 GLN HE21 4.10 # 1 20540.0 e total-2D5640 HG3 33 GLN HE22 4.30 # 1 14380.0 e total-2D6196 HG3 34 ARG HN 6.00 # w 5 3846.0 e total-2D8490 HG3 35 ILE QG2 7.00 # w 5M 2644.0 e total-2D7478 HE21 35 ILE QG2 7.00 # w 5M 1450.0 e total-2D6543 HE22 35 ILE QG2 7.00 # w 5M 2411.0 e total-2D6551 34 ARG HN 34 ARG HA 3.50 # 2 58630.0 e total-2D 118 HN 34 ARG HB2 3.90 # 2 35050.0 e total-2D1047 HN 34 ARG HB3 3.90 # 2 31020.0 e total-2D1048 HN 34 ARG HG2 4.40 <# 1 13960.0 e total-2D1197 HN 34 ARG HG3 5.60 ># 1 3132.0 e total-2D1198 HN 34 ARG QD 7.00 # m w 1 1141.0*2e total-2D1199 HN 35 ILE HN 5.40 # 2 4411.0 e total-2D1535 HN 90 VAL QG2 6.20 # 5M 9441.0 e total-2D8345 HA 34 ARG HB2 4.10 # 2 25060.0 e total-2D3693 HA 34 ARG HB3 4.20 # 2 21300.0 e total-2D3694 HA 34 ARG HG2 4.20 # 1 18030.0 e total-2D3704 HA 34 ARG HG3 4.50 # 1 11660.0 e total-2D3705 HA 34 ARG QD 7.00 # m w 1 541.0*2e total-2D6792 HA 35 ILE HN 3.60 # 2 53050.0 e total-2D2399 HA 90 VAL HA 3.40 # 4 40410.0 e total-2D5427 HA 90 VAL QG1 7.00 # w 5M 4629.0 e total-2D5044 HA 90 VAL QG2 7.00 # w 5M 4493.0 e total-2D8008 HA 91 LEU HN 3.50 # 4 33880.0 e ! total-2D7035 HB2 34 ARG HG2 4.30 # 1 15710.0 e total-2D3698 HB2 34 ARG HG3 3.80 # 1 33660.0 e total-2D6165 HB2 34 ARG QD 6.10 # m 1 5635.0*2e total-2D6162 HB2 35 ILE HN 5.10 # 2 6180.0 e total-2D3087 HB2 90 VAL HA 6.00 <# w 5 2871.0 e total-2D6501 HB2 90 VAL HB 4.60 # 5 67540.0 e total-2D6612 HB2 90 VAL QG1 6.20 # 5M 9362.0 e total-2D6614 HB3 34 ARG HG2 4.10 # 1 20340.0 e total-2D3701 HB3 34 ARG HG3 3.50 # 1 48780.0 e total-2D6166 HB3 34 ARG QD 5.70 # m 1 9290.0*2e total-2D6161 HB3 35 ILE HN 5.60 # 2 3793.0 e total-2D3086 HB3 90 VAL HA 6.00 ># w 5 938.0 e total-2D6504 HG2 34 ARG QD 4.80 # m 1 34215.0*2e total-2D3708 HG2 35 ILE HN 6.00 # w 5 7654.0 e total-2D3088 HG2 90 VAL HA 6.00 # w 5 1015.0 e total-2D6615 HG2 90 VAL HB 5.60 # 5 20370.0 e total-2D6616 HG2 90 VAL QG1 5.30 # 5M 19700.0 e total-2D6617 HG3 34 ARG QD 4.70 # m 1 36560.0*2e total-2D3709 HG3 35 ILE HN 6.00 # w 5 10640.0 e total-2D3085 QD 88 GLN HE21 7.00 # m w 5 926.0*2e total-2D6387 QD 90 VAL QG1 8.00 # m w 5M 3907.5*2e total-2D7541 35 ILE HN 35 ILE HA 3.70 # 2 46580.0 e total-2D 506 HN 35 ILE HB 4.30 # 2 17090.0 e total-2D1049 HN 35 ILE QG2 4.30 # 1M 23120.0 e total-2D1202 HN 35 ILE HG12 4.60 # 1 10580.0 e total-2D1201 HN 35 ILE HG13 4.20 # 1 16550.0 e total-2D1200 HN 35 ILE QD1 5.20 # 1M 7306.0 e total-2D1203 HN 36 ARG HN 6.00 # w 2 751.0 e total-2D2446 HN 89 GLY HN 3.30 # 4 45040.0 e total-2D6505 HN 90 VAL HA 3.30 # 4 45760.0 e total-2D5632 HA 35 ILE HB 3.70 # 2 48830.0 e total-2D6000 HA 35 ILE QG2 3.80 # 1M 47800.0 e total-2D4713 HA 35 ILE HG12 6.00 ># w 1 1276.0 e total-2D4711 HA 35 ILE HG13 4.60 <# 1 9744.0 e total-2D4729 HA 35 ILE QD1 5.90 # 1M 3236.0 e total-2D4738 HA 36 ARG HN 3.10 # 2 135200.0 e total-2D2445 HB 35 ILE QG2 3.40 # 1M 97650.0 e total-2D4716 HB 35 ILE HG12 3.80 # 1 33160.0 e total-2D3725 HB 35 ILE HG13 3.90 # 1 26810.0 e total-2D6005 HB 35 ILE QD1 4.10 # 1M 28570.0 e total-2D4715 HB 36 ARG HN 3.90 # 2 33620.0 e total-2D3093 HB 91 LEU QD2 7.00 # w 5M 2751.0 e total-2D8491 QG2 35 ILE HG12 4.40 ># 1M 17920.0 e total-2D6002 QG2 35 ILE HG13 3.40 <# 1M 84200.0 e total-2D4730 QG2 35 ILE QD1 4.40 # m s 1M 101000.0 e total-2D4734 QG2 36 ARG HN 5.50 # 5M 17350.0 e total-2D3091 QG2 91 LEU HN 7.00 # w 5M 3016.0 e total-2D5637 HG12 35 ILE QD1 3.40 # s 1M 103000.0 e total-2D4736 HG12 36 ARG HN 6.00 # w 5 6474.0 e total-2D3092 HG12 91 LEU QD2 6.80 # 5M 5793.0 e total-2D8492 HG13 35 ILE QD1 3.60 # 1M 60650.0 e total-2D4735 HG13 37 VAL HN 6.00 # w 5 2130.0 e total-2D3095 QD1 36 ARG HN 7.00 # 5M 5062.0 e total-2D5809 QD1 37 VAL HB 6.70 # 5M 6070.0 e total-2D6719 QD1 37 VAL QG1 6.20 # m 5M 22040.0 e total-2D7547 QD1 37 VAL QG2 7.10 # m 5M 10360.0 e total-2D7548 QD1 91 LEU HN 7.00 # w 5M 2261.0 e total-2D5704 QD1 91 LEU HB3 7.00 # w 5M 4505.0 e total-2D6954 QD1 91 LEU QD1 5.70 # m 5M 37470.0 e total-2D6370 QD1 91 LEU QD2 5.60 # m 5M 43700.0 e total-2D6371 QD1 97 LEU QD1 6.40 # m 5M 18770.0 e total-2D8493 36 ARG HN 36 ARG HA 4.00 # 2 26460.0 e total-2D 238 HN 36 ARG HB2 3.70 # 2 48680.0 e total-2D1050 HN 36 ARG HB3 3.90 # 2 33130.0 e total-2D1206 HN 36 ARG HG2 6.00 ># w 1 1403.0 e total-2D1205 HN 36 ARG HG3 3.60 <# 1 46340.0 e total-2D1204 HN 36 ARG QD 7.00 # m w 1 0.0*2- total-2D1208 HN 37 VAL HN 6.00 # w 2 903.0 e total-2D3204 HA 36 ARG HB2 4.30 # 2 17560.0 e total-2D5785 HA 36 ARG HB3 4.10 # 2 23580.0 e total-2D5784 HA 36 ARG HG2 4.50 # 1 11800.0 e total-2D5782 HA 36 ARG HG3 4.00 # 1 21760.0 e total-2D5783 HA 36 ARG QD 7.00 # m w 1 827.5*2e total-2D6794 HA 37 VAL HN 3.00 # 2 152000.0 e total-2D2394 HA 88 GLN HA 3.20 # 4 57020.0 e total-2D5002 HA 88 GLN HB3 6.00 # w 5 757.0 e total-2D6513 HA 88 GLN HG2 6.00 # w 5 1687.0 e total-2D6512 HA 89 GLY HN 3.80 # 4 19880.0 e total-2D5633 HB2 36 ARG HG2 4.80 # 1 8156.0 e total-2D3748 HB2 36 ARG HG3 3.90 # 1 27700.0 e total-2D5789 HB2 36 ARG QD 5.70 ># m 1 8430.0*2e total-2D3749 HB2 37 VAL HN 4.00 # 2 30230.0 e total-2D2396 HB2 86 VAL HA 6.00 # w 5 8607.0 e total-2D7172 HB2 89 GLY HN 6.00 # w 5 7280.0 e total-2D3400 HB3 36 ARG HG2 3.30 # 1 79280.0 e total-2D5790 HB3 36 ARG HG3 4.30 # 1 15180.0 e total-2D5791 HB3 36 ARG QD 5.10 <# m 1 21265.0*2e total-2D5786 HB3 37 VAL HN 4.20 # 2 20160.0 e total-2D2395 HB3 86 VAL HA 6.00 # w 5 8840.0 e total-2D7171 HB3 86 VAL QG1 7.00 # 5M 5174.0 e total-2D6621 HB3 86 VAL QG2 7.00 # w 5M 4408.0 e total-2D6622 HB3 88 GLN HA 6.00 # w 5 1338.0 e total-2D8348 HG2 36 ARG QD 5.00 # m 1 23805.0*2e total-2D6798 HG2 37 VAL HN 6.00 # 5 12880.0 e total-2D3516 HG2 88 GLN HA 6.00 # w 5 1462.0 e total-2D5003 HG2 88 GLN HB2 6.00 # w 5 2329.0 e total-2D7126 HG2 88 GLN HB3 6.00 # w 5 5174.0 e total-2D7125 HG2 88 GLN HG2 6.00 # w 5 4881.0 e total-2D8352 HG2 88 GLN HG3 6.00 # w 5 2224.0 e total-2D8494 HG3 36 ARG QD 5.20 # m 1 18550.0*2e total-2D6797 HG3 37 VAL HN 6.00 # w 5 10200.0 e total-2D2397 HG3 88 GLN HA 6.00 # w 5 1616.0 e total-2D8349 HG3 88 GLN HB2 6.00 # w 5 7282.0 e total-2D6514 HG3 88 GLN HG2 6.00 # w 5 4226.0 e total-2D8350 HG3 88 GLN HG3 6.00 # w 5 11010.0 e total-2D8351 HG3 89 GLY HN 6.00 # w 5 2079.0 e total-2D2965 QD 37 VAL HN 7.00 # m w 5 365.0*2e total-2D7129 QD 86 VAL QG2 7.80 # m 5M 5815.0*2e total-2D7552 QD 103 LEU QD1 8.00 <# m w 5M 1988.0*2e total-2D7551 QD 103 LEU QD2 8.00 ># m w 5M 548.0*2e total-2D7553 37 VAL HN 37 VAL HA 3.90 # 2 35010.0 e total-2D 229 HN 37 VAL HB 4.30 # 2 19210.0 e total-2D1051 HN 37 VAL QG1 5.20 ># 1M 6571.0 e total-2D1209 HN 37 VAL QG2 4.40 <# 1M 17980.0 e total-2D1210 HN 38 GLY HN 6.00 # w 2 901.0 e total-2D7130 HN 86 VAL HA 6.00 # w 4 801.0 e total-2D6515 HN 86 VAL QG1 7.00 # w 5M 2667.0 e total-2D8534 HN 87 ALA HN 3.30 # 4 50400.0 e ! total-2D1558 HN 87 ALA QB 6.50 # 5M 7065.0 e total-2D3096 HN 88 GLN HA 3.50 # 4 32700.0 e total-2D2234 HA 37 VAL HB 3.90 # 2 30540.0 e total-2D3763 HA 37 VAL QG1 3.80 # 1M 45890.0 e total-2D3771 HA 37 VAL QG2 4.00 # 1M 33060.0 e total-2D3774 HA 38 GLY HN 3.50 # 2 66630.0 e total-2D2873 HB 37 VAL QG1 4.50 ># 1M 17240.0 e total-2D3770 HB 37 VAL QG2 3.40 <# s 1M 125500.0 e total-2D3768 HB 38 GLY HN 4.90 # 2 7792.0 e total-2D3540 QG1 38 GLY HN 5.60 # 5M 15260.0 e total-2D3515 QG1 39 GLY HN 6.80 # 5M 5952.0 e total-2D5649 QG1 87 ALA HN 7.00 # w 5M 3820.0 e total-2D7914 QG2 38 GLY HN 5.40 # 5M 17940.0 e total-2D2700 QG2 69 VAL QG2 5.50 # m 5M 44670.0 e total-2D8353 QG2 79 PHE CG 9.00 # r w 5M 747.0*2e ! total-2D8550 QG2 87 ALA QB 5.50 # m 5M 45200.0 e ! total-2D8432 38 GLY HN 38 GLY HA1 3.50 <# 2 68810.0 e total-2D3623 HN 38 GLY HA2 4.00 ># 2 26660.0 e total-2D1316 HN 39 GLY HN 5.40 # 2 4697.0 e total-2D6292 HA1 39 GLY HN 3.50 <# 2 66320.0 e total-2D3624 HA1 86 VAL HA 3.40 <# 4 39040.0 e total-2D4826 HA1 86 VAL QG1 7.00 # w 5M 668.0 e total-2D8354 HA1 87 ALA HN 3.30 <# 4 44390.0 e total-2D3625 HA2 39 GLY HN 4.10 ># 2 25720.0 e total-2D2447 HA2 86 VAL HA 4.20 ># 4 10530.0 e total-2D5411 HA2 86 VAL QG1 7.00 # w 5M 2091.0 e total-2D8190 HA2 87 ALA HN 4.50 ># 4 7122.0 e total-2D2235 39 GLY HN 39 GLY HA1 4.10 # 2 25840.0 e total-2D1007 HN 39 GLY HA2 4.10 # 2 23480.0 e total-2D 909 HN 40 MET HN 6.00 # w 2 0.0 e total-2D1574 HN 59 VAL QG2 7.00 # w 5M 3430.0 e total-2D7966 HN 84 GLY HA1 6.00 # w 4 960.0 e total-2D6629 HN 85 ILE HN 3.50 # 4 34740.0 e total-2D1573 HN 86 VAL HA 3.60 # 4 28140.0 e total-2D2236 HA1 40 MET HN 3.60 # 2 54630.0 e total-2D2449 HA2 40 MET HN 3.40 # 2 82930.0 e total-2D2448 HA2 59 VAL QG2 5.80 # 5M 12750.0 e total-2D8451 40 MET HN 40 MET HA 4.30 # 2 17560.0 e total-2D 508 HN 40 MET HB2 4.00 # 2 27520.0 e total-2D1052 HN 40 MET HB3 4.00 # 2 30030.0 e total-2D1053 HN 40 MET HG2 4.90 # 1 6858.0 e total-2D1213 HN 40 MET HG3 4.60 # 1 10010.0 e total-2D1212 HN 40 MET QE 4.80 # 1M 11560.0 e total-2D2202 HN 41 VAL HN 5.20 # 2 5708.0 e total-2D1575 HN 59 VAL QG1 7.00 # w 5M 3554.0 e total-2D7558 HN 59 VAL QG2 6.70 # 5M 6323.0 e total-2D6430 HN 60 HIS HN 3.70 # 4 23090.0 e total-2D3628 HN 60 HIS HB2 6.00 # w 5 4746.0 e ! total-2D6431 HN 61 ASP HA 5.60 # 4 1938.0 e total-2D8355 HA 40 MET HB2 5.50 # 2 4058.0 e total-2D5024 HA 40 MET HG2 6.00 # w 1 607.0 e total-2D3808 HA 40 MET HG3 6.00 # w 1 0.0 - total-2D3807 HA 40 MET QE 5.80 # 1M 3686.0 e total-2D3798 HA 41 VAL HN 3.20 # 2 116300.0 e total-2D2450 HA 41 VAL QG2 7.00 # w 5M 2342.0 e total-2D7968 HA 84 GLY HA1 2.90 <# 4 100000.0 e total-2D5022 HA 84 GLY HA2 3.50 ># 4 33500.0 e total-2D5020 HA 85 ILE HN 3.50 # 4 30860.0 e total-2D2237 HB2 40 MET HG2 3.50 # 1 52010.0 e total-2D3802 HB2 40 MET HG3 3.30 # 1 71160.0 e total-2D3801 HB2 40 MET QE 5.00 ># 1M 8668.0 e total-2D3796 HB2 41 VAL HN 4.70 # 2 10140.0 e total-2D2713 HB3 40 MET HG2 3.30 # 1 73960.0 e total-2D3800 HB3 40 MET HG3 4.00 # 1 24260.0 e total-2D3799 HB3 40 MET QE 4.00 <# 1M 35920.0 e total-2D3797 HB3 41 VAL HN 4.80 # 2 8804.0 e total-2D6025 HB3 84 GLY HA1 6.00 # w 5 1925.0 e total-2D8356 HG2 40 MET QE 5.30 # 1M 6273.0 e total-2D3803 HG2 41 VAL HN 6.00 <# w 5 8283.0 e total-2D2714 HG3 40 MET QE 5.70 # 1M 4032.0 e total-2D3804 HG3 41 VAL HN 6.00 ># w 5 1609.0 e total-2D6026 QE 41 VAL HN 6.60 # 5M 6562.0 e total-2D3560 41 VAL HN 41 VAL HA 4.20 # 2 22240.0 e total-2D 611 HN 41 VAL HB 3.80 # 2 41400.0 e total-2D1054 HN 41 VAL QG1 5.00 ># 1M 8413.0 e total-2D1215 HN 41 VAL QG2 3.70 <# 1M 52870.0 e total-2D1214 HN 42 THR HN 6.00 # 2 2335.0 e total-2D6922 HN 82 GLY HN 5.50 # 4 2104.0 e total-2D5692 HN 83 GLN HN 3.40 # 4 40060.0 e ! total-2D1951 HN 84 GLY HA1 3.40 <# 4 35910.0 e total-2D2541 HN 84 GLY HA2 4.50 ># 4 7567.0 e total-2D2239 HN 85 ILE HN 6.00 # 4 1222.0 e total-2D6637 HN 85 ILE QD1 7.00 # w 5M 900.0 e total-2D6027 HA 41 VAL HB 4.60 # 2 11570.0 e total-2D3811 HA 41 VAL QG1 4.50 ># 1M 15660.0 e total-2D3810 HA 41 VAL QG2 3.70 <# 1M 51810.0 e total-2D3809 HA 42 THR HN 3.20 # 2 119900.0 e total-2D2451 HA 59 VAL HA 3.70 # 4 22800.0 e total-2D5428 HA 59 VAL QG1 5.70 # 5M 13790.0 e total-2D8219 HA 59 VAL QG2 5.70 # 5M 13780.0 e total-2D7562 HA 60 HIS HN 6.00 # w 4 787.0 e total-2D3608 HB 41 VAL QG1 4.00 # 1M 31900.0 e total-2D3819 HB 41 VAL QG2 3.60 # 1M 61920.0 e total-2D3812 HB 42 THR HN 6.00 # w 2 0.0 e total-2D3559 HB 59 VAL QG1 6.60 # 5M 6958.0 e total-2D7970 HB 83 GLN HN 5.50 # 5 23000.0 e total-2D5670 QG1 42 THR HN 5.20 # 5M 22410.0 e total-2D2716 QG1 45 SER HG 7.00 # w 5M 2622.0 e ! total-2D6072 QG1 57 PHE CG 9.00 # r w 5M 2056.5*2e total-2D8191 QG1 57 PHE CZ 9.00 # r w 5M 1730.0*2e total-2D6195 QG1 57 PHE HZ 7.00 # w 5M 2694.0 e total-2D8105 QG1 59 VAL HA 7.00 # w 5M 2343.0 e total-2D7600 QG1 59 VAL QG2 7.30 # m 5M 8339.0 e total-2D7561 QG1 79 PHE CZ 9.00 ># r w 5M 279.0*2e total-2D8519 QG1 81 GLU HA 4.80 <# 5M 34080.0 e total-2D8227 QG1 82 GLY HN 7.00 # w 5M 4078.0 e total-2D8357 QG1 83 GLN HN 7.00 ># w 5M 1989.0 e total-2D2910 QG1 85 ILE HG12 5.00 # 5M 28540.0 e total-2D8497 QG1 85 ILE QD1 5.80 # m 5M 33950.0 e ! total-2D8498 QG2 42 THR HN 5.80 # 5M 13470.0 e total-2D2715 QG2 57 PHE CG 9.00 # r w 5M 4808.5*2e total-2D6330 QG2 57 PHE CZ 9.00 # r w 5M 2853.5*2e total-2D8198 QG2 59 VAL QG1 8.00 # m w 5M 2414.0 e total-2D8358 QG2 79 PHE CZ 9.00 <# r w 5M 2172.0*2e total-2D6688 QG2 79 PHE HZ 7.00 # w 5M 2695.0 e total-2D8100 QG2 81 GLU HA 6.60 ># 5M 7017.0 e total-2D5817 QG2 82 GLY HN 7.00 # w 5M 2719.0 e total-2D8495 QG2 83 GLN HN 6.90 <# 5M 5360.0 e total-2D2909 QG2 85 ILE QG2 5.20 # m 5M 66720.0 e ! total-2D8496 42 THR HN 42 THR HA 4.60 # 2 11440.0 e total-2D 71 HN 42 THR HB 3.90 # 2 33710.0 e total-2D1055 HN 42 THR QG2 4.80 # 1M 10940.0 e total-2D1219 HN 43 VAL HN 4.40 # 2 16640.0 e total-2D1600 HN 43 VAL HA 6.00 # w 2 0.0 e total-2D3498 HN 45 SER HB3 6.00 # w 3 2069.0 e total-2D5594 HN 45 SER HG 6.00 # w 5 9216.0 e total-2D6077 HN 58 ALA HN 6.00 # w 4 893.0 e total-2D7969 HN 59 VAL HN 6.00 # 4 1245.0 e total-2D8257 HN 59 VAL HA 4.00 # 4 14410.0 e total-2D3629 HN 59 VAL QG1 7.00 # 5M 4960.0 e total-2D5591 HA 42 THR HB 3.30 # 2 97310.0 e total-2D3824 HA 42 THR QG2 4.20 # 1M 25940.0 e total-2D5030 HA 43 VAL HN 3.60 # 2 53160.0 e total-2D2452 HA 43 VAL QG1 6.40 # 5M 8162.0 e total-2D5988 HA 43 VAL QG2 6.60 # 5M 6676.0 e total-2D7277 HA 44 GLY HN 5.40 # 3 9711.0 e total-2D6640 HB 42 THR QG2 3.50 # 1M 74760.0 e total-2D3823 HB 43 VAL HN 5.00 # 2 7311.0 e total-2D3216 HB 45 SER HN 5.50 # 3 8625.0 e total-2D5863 HB 45 SER HB2 5.60 <# 5 20680.0 e total-2D8359 HB 45 SER HB3 6.00 ># w 5 8089.0 e total-2D6525 HB 45 SER HG 5.20 # 5 32390.0 e total-2D5885 HB 58 ALA HN 6.00 # w 5 3047.0 e total-2D5866 HB 58 ALA QB 6.70 # 5M 6347.0 e total-2D7563 QG2 43 VAL HN 5.60 # 5M 15360.0 e total-2D3449 QG2 43 VAL HB 5.90 # 5M 12160.0 e total-2D8360 QG2 43 VAL QG1 6.40 # m 5M 18060.0 e total-2D8361 QG2 44 GLY HN 6.50 # 5M 7396.0 e total-2D3117 QG2 45 SER HN 7.00 # w 5M 1731.0 e total-2D6521 QG2 45 SER HA 5.30 # 5M 20650.0 e total-2D5147 QG2 45 SER HB2 4.60 # 5M 42670.0 e total-2D5145 QG2 45 SER HB3 5.10 # 5M 23770.0 e total-2D5138 QG2 45 SER HG 4.80 # 5M 34250.0 e total-2D6049 43 VAL HN 43 VAL HA 3.60 # 2 51990.0 e total-2D 40 HN 43 VAL HB 3.90 # 2 30920.0 e total-2D1056 HN 43 VAL QG1 3.40 <# s 1M 108700.0 e total-2D3836 HN 43 VAL QG2 4.80 ># 1M 10670.0 e total-2D1222 HN 44 GLY HN 3.20 # 2 102300.0 e total-2D3597 HN 45 SER HN 5.60 # 3 7719.0 e total-2D8367 HN 45 SER HB2 6.00 # w 3 3329.0 e total-2D8362 HN 45 SER HG 6.00 # w 5 873.0 e total-2D6063 HN 81 GLU HB2 6.00 # w 5 6581.0 e total-2D7504 HN 81 GLU HB3 6.00 # w 5 12120.0 e total-2D7564 HA 43 VAL HB 4.00 # 2 30260.0 e total-2D3829 HA 43 VAL QG1 4.50 # 1M 17100.0 e total-2D3835 HA 43 VAL QG2 3.90 # 1M 38120.0 e total-2D3828 HA 44 GLY HN 3.70 # 2 41880.0 e total-2D2453 HA 45 SER HN 4.70 # 3 21080.0 e total-2D3502 HA 81 GLU HA 4.70 # 4 5390.0 e total-2D8365 HA 81 GLU HB2 6.00 # 5 13190.0 e total-2D8231 HA 81 GLU HB3 5.80 # 5 15330.0 e total-2D8364 HA 82 GLY HN 6.00 # w 4 1099.0 e total-2D8363 HA 82 GLY HA2 4.00 # 4 13590.0 e ! total-2D8366 HB 43 VAL QG1 4.20 # 1M 26550.0 e total-2D3834 HB 43 VAL QG2 4.00 # 1M 33820.0 e total-2D3831 HB 44 GLY HN 4.50 # 2 13460.0 e total-2D2723 HB 82 GLY HN 6.00 # w 5 4107.0 e total-2D8499 QG1 44 GLY HN 5.00 # 5M 28350.0 e total-2D2721 QG1 82 GLY HN 6.30 # 5M 8566.0 e total-2D2903 QG1 82 GLY HA1 7.00 # w 5M 2465.0 e total-2D8218 QG1 82 GLY HA2 7.00 # w 5M 3959.0 e total-2D5144 QG2 44 GLY HN 4.70 # 5M 38220.0 e total-2D2720 QG2 45 SER HN 6.70 # 5M 6311.0 e total-2D2724 QG2 82 GLY HA1 7.00 # w 5M 2052.0 e total-2D7565 44 GLY HN 44 GLY HA1 3.40 # 2 69550.0 e total-2D 679 HN 44 GLY HA2 3.50 # 2 66450.0 e total-2D 278 HN 45 SER HN 3.70 # 2 44490.0 e total-2D1631 HN 45 SER HB2 5.80 # 2 2932.0 e total-2D8500 HN 45 SER HG 6.00 # w 5 634.0 e total-2D7285 HN 46 MET HN 6.00 # 3 4982.0 e total-2D3757 HA1 45 SER HN 4.10 # 2 23740.0 e total-2D2454 HA1 46 MET HN 6.00 # w 3 2045.0 e total-2D6526 HA2 45 SER HN 4.50 # 2 13990.0 e total-2D2455 HA2 46 MET HN 6.00 # w 3 1236.0 e total-2D3565 45 SER HN 45 SER HA 3.60 # 2 56860.0 e total-2D 560 HN 45 SER HB2 4.60 # 2 12000.0 e total-2D1057 HN 45 SER HB3 4.00 # 2 29880.0 e total-2D1058 HN 45 SER HG 3.70 # 1 39960.0 e total-2D5663 HN 46 MET HN 3.40 # 2 81680.0 e total-2D1628 HN 46 MET HB2 5.80 # 2 3012.0 e total-2D3219 HN 58 ALA HN 5.80 # 4 1562.0 e total-2D7282 HN 58 ALA QB 7.00 # w 5M 1566.0 e total-2D8195 HA 45 SER HB2 3.10 # 2 132600.0 e total-2D3843 HA 45 SER HB3 3.50 # 2 65320.0 e total-2D3842 HA 45 SER HG 4.90 # 1 6922.0 e total-2D6048 HA 46 MET HN 4.10 # 2 23360.0 e total-2D2456 HA 58 ALA HN 5.70 # 4 1632.0 e total-2D7956 HA 58 ALA QB 7.00 # w 5M 4811.0 e total-2D7566 HB2 45 SER HG 3.80 # 1 31200.0 e total-2D6070 HB2 46 MET HN 5.30 # 2 5025.0 e total-2D3564 HB2 58 ALA HN 6.00 # w 5 7980.0 e total-2D7176 HB2 58 ALA QB 7.00 # w 5M 3584.0 e total-2D7567 HB2 68 LEU QD2 6.60 # 5M 6611.0 e total-2D7568 HB3 45 SER HG 3.30 # 1 68750.0 e total-2D6071 HB3 46 MET HN 6.00 # w 2 0.0 e total-2D3120 HB3 58 ALA HN 6.00 # w 5 9578.0 e total-2D6189 HB3 58 ALA QB 7.00 # w 5M 1985.0 e total-2D5149 HG 46 MET HN 6.00 # w 5 4871.0 e total-2D6075 HG 57 PHE HA 6.00 # w 5 718.0 e total-2D6074 HG 58 ALA HN 5.60 # 5 19770.0 e total-2D6076 46 MET HN 46 MET HA 3.70 # 2 44820.0 e total-2D 833 HN 46 MET HB2 3.90 # 2 31870.0 e total-2D1060 HN 46 MET HB3 4.10 # 2 23780.0 e total-2D1059 HN 46 MET HG2 4.90 # 1 6982.0 e total-2D2195 HN 46 MET HG3 4.80 # 1 7286.0 e total-2D2194 HN 46 MET QE 5.60 # 1M 4550.0 e total-2D2196 HN 47 VAL HN 4.80 # 2 8804.0 e total-2D3758 HN 47 VAL QG2 7.00 # w 5M 1218.0 e total-2D3641 HA 46 MET HB2 4.10 # 2 24340.0 e total-2D3861 HA 46 MET HB3 4.00 # 2 28450.0 e total-2D3851 HA 46 MET HG2 4.30 # 1 14790.0 e total-2D3872 HA 46 MET HG3 4.20 # 1 16320.0 e total-2D3871 HA 46 MET QE 5.00 # 1M 9099.0 e total-2D3877 HA 47 VAL HN 3.00 # 2 164100.0 e total-2D2457 HA 47 VAL QG2 6.50 # 5M 7302.0 e total-2D8161 HA 57 PHE HA 3.30 # 4 49930.0 e total-2D5300 HA 57 PHE HB2 5.90 ># 5 13960.0 e total-2D5151 HA 57 PHE HB3 4.90 <# 5 46570.0 e total-2D5150 HA 58 ALA HN 5.00 # 4 3626.0 e total-2D5865 HB2 46 MET HG2 4.20 # 1 17390.0 e total-2D3868 HB2 46 MET HG3 3.30 # 1 76680.0 e total-2D3857 HB2 46 MET QE 4.40 # 1M 18700.0 e total-2D3853 HB2 47 VAL HN 5.10 # 2 6495.0 e total-2D2735 HB2 57 PHE HB3 6.00 # w 5 650.0 e total-2D7472 HB3 46 MET HG2 3.00 # 1 122200.0 e total-2D3865 HB3 46 MET HG3 3.20 # 1 99510.0 e total-2D3866 HB3 46 MET QE 4.40 # 1M 18110.0 e total-2D3873 HB3 47 VAL HN 5.50 # 2 4176.0 e total-2D3562 HB3 57 PHE HB2 6.00 # w 5 10330.0 e total-2D5681 HG2 46 MET QE 6.00 ># 1M 2964.0 e total-2D3863 HG2 47 VAL HN 6.00 # w 5 9650.0 e total-2D2736 HG2 55 VAL QG1 7.00 # w 5M 3487.0 e total-2D8166 HG2 55 VAL QG2 7.00 # w 5M 2111.0 e total-2D8571 HG2 57 PHE HB2 6.00 # w 5 8595.0 e total-2D7470 HG2 57 PHE HB3 6.00 # w 5 8399.0 e total-2D7323 HG2 81 GLU HB3 6.00 # 5 13300.0 e total-2D7731 HG2 81 GLU HG2 5.70 # 5 17360.0 e total-2D7729 HG2 81 GLU HG3 5.60 # 5 19160.0 e total-2D7730 HG3 46 MET QE 4.60 <# 1M 15340.0 e total-2D3864 HG3 47 VAL HN 6.00 # w 5 10320.0 e total-2D3563 HG3 48 ARG HN 6.00 # w 5 0.0 e total-2D3125 HG3 55 VAL QG1 7.00 # w 5M 4106.0 e total-2D8167 HG3 57 PHE HB2 6.00 # w 5 1891.0 e total-2D7471 HG3 57 PHE HB3 6.00 # 5 12990.0 e total-2D6015 HG3 79 PHE CZ 8.00 # r w 5 735.5*2e total-2D8147 QE 47 VAL HN 7.00 # w 5M 4262.0 e total-2D3124 QE 55 VAL HB 4.90 # 5M 29440.0 e total-2D7727 QE 57 PHE HA 7.00 # w 5M 1680.0 e total-2D7473 QE 57 PHE HB3 6.90 # 5M 5563.0 e total-2D6014 QE 75 LEU QD1 7.10 # m 5M 9756.0 e total-2D6820 QE 75 LEU QD2 7.50 # m 5M 7248.0 e total-2D6821 QE 79 PHE CZ 9.00 # r w 5M 686.5*2e total-2D8093 47 VAL HN 47 VAL HA 3.80 # 2 38800.0 e total-2D 79 HN 47 VAL HB 4.50 # 2 13050.0 e total-2D1061 HN 47 VAL QG1 4.70 # 1M 13330.0 e total-2D1225 HN 47 VAL QG2 4.40 # 1M 18920.0 e total-2D1224 HN 48 ARG HN 4.60 # 2 11510.0 e total-2D1667 HN 55 VAL QG1 6.70 # 5M 6456.0 e total-2D5716 HN 56 GLN HN 3.20 # 4 58080.0 e total-2D1742 HN 56 GLN HG2 6.00 ># w 5 685.0 e total-2D6886 HN 56 GLN HG3 6.00 <# w 5 4414.0 e total-2D8368 HN 57 PHE HA 3.50 # 4 31530.0 e total-2D2405 HN 57 PHE HB2 6.00 ># w 5 807.0 e total-2D6887 HN 57 PHE HB3 6.00 <# w 5 9069.0 e total-2D5715 HA 47 VAL HB 4.30 # 2 18790.0 e total-2D3883 HA 47 VAL QG1 4.50 # 1M 17110.0 e total-2D3889 HA 47 VAL QG2 4.70 # 1M 12480.0 e total-2D3888 HA 48 ARG HN 3.00 # 2 171400.0 e total-2D2458 HB 47 VAL QG1 4.60 # 1M 14560.0 e total-2D3886 HB 47 VAL QG2 4.90 # 1M 10370.0 e total-2D3887 HB 48 ARG HN 5.20 # 2 5831.0 e total-2D2739 HB 56 GLN HN 6.00 # w 5 6146.0 e total-2D7571 HB 56 GLN HG2 6.00 # w 5 11680.0 e total-2D8504 HB 56 GLN HE21 6.00 # w 5 4029.0 e total-2D8369 HB 56 GLN HE22 6.00 # w 5 2403.0 e total-2D8370 QG1 48 ARG HN 5.60 <# 5M 16170.0 e total-2D2738 QG1 56 GLN HN 6.50 # 5M 7426.0 e total-2D7570 QG1 56 GLN HG2 7.00 # w 5M 4215.0 e total-2D8502 QG1 56 GLN HE21 7.00 # w 5M 4192.0 e total-2D7877 QG1 56 GLN HE22 6.80 # 5M 5696.0 e total-2D6940 QG1 57 PHE HA 7.00 # w 5M 2736.0 e total-2D8501 QG1 57 PHE CG 9.00 # r w 5M 2275.0*2e total-2D8553 QG2 48 ARG HN 7.00 ># w 5M 4556.0 e total-2D7569 QG2 56 GLN HN 7.00 # w 5M 3141.0 e total-2D2785 QG2 56 GLN HB3 5.50 # 5M 17450.0 e ! total-2D7593 QG2 56 GLN HG2 7.00 # w 5M 2606.0 e total-2D8503 QG2 56 GLN HE21 7.00 # 5M 5089.0 e total-2D6210 QG2 56 GLN HE22 6.70 # 5M 6341.0 e total-2D6231 48 ARG HN 48 ARG HA 3.60 # 2 50270.0 e total-2D 87 HN 48 ARG HB2 4.10 # 2 23370.0 e total-2D1062 HN 48 ARG HB3 3.80 # 2 41420.0 e total-2D1063 HN 48 ARG QG 5.90 # m 1 7175.0*2e total-2D1227 HN 48 ARG QD 5.90 # m 1 6725.0*2e total-2D1226 HN 49 ASP HN 5.80 # 2 3020.0 e total-2D2460 HA 48 ARG HB2 4.10 # 2 26060.0 e total-2D3900 HA 48 ARG HB3 4.30 # 2 18230.0 e total-2D3901 HA 48 ARG QG 4.60 # i 1 22820.0*2e total-2D3905 HA 48 ARG QD 6.00 # m 1 6410.0*2e total-2D3909 HA 49 ASP HN 3.10 # 2 146400.0 e total-2D2459 HA 55 VAL HA 3.10 # 4 67480.0 e total-2D4860 HA 55 VAL HB 6.00 # w 5 3311.0 e total-2D5548 HA 55 VAL QG2 5.40 # 5M 18660.0 e total-2D7733 HA 56 GLN HN 3.30 # 4 50120.0 e total-2D3734 HB2 48 ARG QG 5.70 # m 1 8480.0*2e total-2D3895 HB2 48 ARG QD 5.00 # m 1 21835.0*2e total-2D3908 HB2 49 ASP HN 4.10 # 2 24240.0 e total-2D2748 HB2 55 VAL HA 6.00 # w 5 5806.0 e total-2D5553 HB2 55 VAL HB 4.80 # 5 53760.0 e total-2D7734 HB2 55 VAL QG1 5.70 # 5M 13620.0 e total-2D7573 HB2 55 VAL QG2 5.60 # 5M 15930.0 e total-2D7572 HB3 48 ARG QG 5.80 # m 1 7965.0*2e total-2D3902 HB3 48 ARG QD 4.90 # m 1 26365.0*2e total-2D3907 HB3 49 ASP HN 4.30 # 2 18560.0 e total-2D3517 HB3 55 VAL QG1 5.70 # 5M 14010.0 e total-2D7576 HB3 55 VAL QG2 5.90 # 5M 12270.0 e total-2D7575 QG 48 ARG QD 6.20 # mm 1 16265.0*4e total-2D3906 QG 49 ASP HN 7.00 # m w 5 5170.0*2e total-2D2747 QG 55 VAL HB 7.00 # m w 5 4477.5*2e total-2D5166 QG 55 VAL QG2 8.00 # m w 5M 4459.5*2e total-2D8371 QD 49 ASP HN 7.00 # m w 5 5950.0*2e total-2D2749 QD 55 VAL HB 7.00 # m w 5 2393.0*2e total-2D5551 QD 55 VAL QG1 8.00 # m 5M 5060.0*2e total-2D5154 QD 55 VAL QG2 8.00 # m w 5M 2663.0*2e total-2D5557 49 ASP HN 49 ASP HA 3.60 # 2 52820.0 e total-2D 99 HN 49 ASP HB2 3.60 # 2 53900.0 e total-2D1064 HN 49 ASP HB3 3.40 # 2 71150.0 e total-2D1065 HN 51 ASN HN 6.00 # w 3 2275.0 e total-2D7386 HN 51 ASN HD22 6.00 # w 5 609.0 e total-2D7749 HN 52 SER HN 6.00 # w 3 1478.0 e total-2D7736 HN 53 LEU HN 6.00 # w 3 1173.0 e total-2D7582 HN 54 HIS HN 3.70 # 4 24570.0 e ! total-2D7355 HN 55 VAL HA 3.60 # 4 28210.0 e total-2D2407 HN 55 VAL HB 6.00 # w 5 637.0 e total-2D3132 HN 55 VAL QG1 6.40 # 5M 8022.0 e total-2D2746 HN 55 VAL QG2 6.70 # 5M 6369.0 e total-2D7579 HA 49 ASP HB2 4.50 # 2 13780.0 e total-2D3912 HA 49 ASP HB3 4.30 # 2 19170.0 e total-2D3910 HA 50 PRO HG3 6.00 # w 5 2354.0 e total-2D5156 HA 50 PRO HD2 4.30 # 5 102200.0 e total-2D5157 HA 50 PRO HD3 4.60 # 5 68350.0 e total-2D7253 HA 51 ASN HN 5.70 # 3 6851.0 e total-2D5798 HA 51 ASN HD22 6.00 # w 5 3285.0 e total-2D8079 HB2 51 ASN HN 6.00 # w 3 3040.0 e total-2D7584 HB2 51 ASN HD22 6.00 # w 5 3472.0 e total-2D8373 HB2 54 HIS HN 5.90 <# 5 14660.0 e total-2D5688 HB2 54 HIS HB2 5.30 # 5 28500.0 e total-2D6647 HB2 54 HIS HB3 5.40 # 5 24940.0 e total-2D6648 HB3 51 ASN HD22 6.00 # w 5 2312.0 e total-2D8372 HB3 53 LEU HN 6.00 # w 3 2980.0 e total-2D7581 HB3 54 HIS HN 6.00 ># w 5 2059.0 e total-2D7580 HB3 54 HIS HB2 6.00 # w 5 5744.0 e total-2D6649 HB3 54 HIS HB3 5.80 # 5 16040.0 e total-2D6650 HB3 54 HIS HD2 6.00 # w 5 855.0 e total-2D8047 50 PRO HA 50 PRO HB2 3.30 # 2 85800.0 e total-2D5930 HA 50 PRO HB3 3.80 # 2 41100.0 e total-2D5929 HA 50 PRO HG2 4.00 # 1 22100.0 e total-2D5955 HA 50 PRO HG3 4.20 # 1 17550.0 e total-2D5934 HA 50 PRO HD2 5.50 # 1 3436.0 e total-2D5937 HA 50 PRO HD3 5.60 # 1 3164.0 e total-2D5936 HA 51 ASN HN 3.90 # 2 31660.0 e total-2D1328 HA 52 SER HN 5.70 # 3 6641.0 e total-2D7583 HA 53 LEU QD1 7.00 # w 5M 436.0 e ! total-2D7744 HB2 50 PRO HG2 3.80 # 1 30980.0 e total-2D5964 HB2 50 PRO HG3 3.80 # 1 31840.0 e total-2D5963 HB2 50 PRO HD2 6.00 # w 1 1790.0 e total-2D5951 HB2 50 PRO HD3 5.20 # 1 4652.0 e total-2D5950 HB2 51 ASN HN 5.70 # 2 3259.0 e total-2D1331 HB3 50 PRO HG2 3.10 # 1 116400.0 e total-2D6806 HB3 50 PRO HG3 3.10 # 1 116500.0 e total-2D6805 HB3 50 PRO HD2 4.60 # 1 10050.0 e total-2D5942 HB3 50 PRO HD3 4.30 # 1 14870.0 e total-2D5938 HB3 51 ASN HN 5.20 # 2 5557.0 e total-2D1332 HG2 50 PRO HD2 3.90 # 1 27520.0 e total-2D5944 HG2 50 PRO HD3 3.90 # 1 26100.0 e total-2D5940 HG2 51 ASN HN 6.00 # w 5 3590.0 e total-2D2197 HG2 51 ASN HA 6.00 # w 5 366.0 e total-2D7761 HG2 51 ASN HD22 6.00 # w 5 2755.0 e total-2D8505 HG3 50 PRO HD2 4.10 # 1 20970.0 e total-2D5957 HG3 50 PRO HD3 4.10 # 1 19410.0 e total-2D5939 HG3 51 ASN HN 6.00 # w 5 5126.0 e total-2D1330 HD2 51 ASN HN 6.00 # 5 12500.0 e total-2D2198 HD2 53 LEU QD1 7.00 # w 5M 1126.0 e ! total-2D7746 HD3 51 ASN HN 6.00 # w 5 8614.0 e total-2D1329 51 ASN HN 51 ASN HA 3.60 # 2 53130.0 e total-2D 549 HN 51 ASN HB2 3.70 # 2 47100.0 e total-2D1067 HN 51 ASN HB3 4.10 # 2 24440.0 e total-2D1066 HN 51 ASN HD21 5.80 # 1 2533.0 e total-2D2287 HN 51 ASN HD22 6.00 # w 1 0.0 - total-2D2286 HN 52 SER HN 3.30 # 2 84980.0 e total-2D1700 HN 52 SER HA 5.00 # 2 7037.0 e total-2D7387 HN 53 LEU HN 5.30 # 3 10900.0 e total-2D7356 HA 51 ASN HB2 4.30 # 2 18290.0 e total-2D3921 HA 51 ASN HB3 3.70 # 2 43340.0 e total-2D3920 HA 51 ASN HD21 5.40 # 1 3590.0 e total-2D6172 HA 52 SER HN 4.20 # 2 20880.0 e total-2D2463 HA 53 LEU QD2 6.70 # 5M 6275.0 e total-2D7763 HB2 51 ASN HD21 3.60 # 1 43390.0 e total-2D2751 HB2 51 ASN HD22 4.00 # 1 23020.0 e total-2D2754 HB2 52 SER HN 4.40 # 2 16490.0 e total-2D2764 HB2 53 LEU HN 6.00 # w 3 2155.0 e total-2D8374 HB2 54 HIS HN 5.50 <# 3 8472.0 e total-2D2771 HB2 54 HIS HB2 6.00 # w 5 12390.0 e total-2D7754 HB2 54 HIS HB3 5.80 # 5 15700.0 e total-2D7755 HB3 51 ASN HD21 4.10 # 1 21110.0 e total-2D2752 HB3 51 ASN HD22 4.80 # 1 8197.0 e total-2D6173 HB3 52 SER HN 4.10 # 2 24130.0 e total-2D2765 HB3 53 LEU HN 6.00 # w 3 1140.0 e total-2D8375 HB3 54 HIS HN 6.00 ># w 3 3093.0 e total-2D7390 52 SER HN 52 SER HA 3.70 # 2 42940.0 e total-2D 539 HN 52 SER HB2 4.20 # 2 21460.0 e total-2D1069 HN 52 SER HB3 4.70 # 2 10990.0 e total-2D1068 HN 53 LEU HN 3.80 # 2 38730.0 e total-2D1699 HN 53 LEU QD1 7.00 # w 5M 3394.0 e total-2D6280 HN 53 LEU QD2 7.00 # w 5M 2310.0 e total-2D6279 HN 54 HIS HN 5.80 # 3 5929.0 e total-2D8376 HN 54 HIS HD2 6.00 # w 5 1840.0 e total-2D6294 HA 52 SER HB2 3.60 # 2 53110.0 e total-2D3927 HA 52 SER HB3 3.50 # 2 67090.0 e total-2D3926 HA 53 LEU HN 3.60 # 2 54550.0 e total-2D2464 HA 53 LEU QD1 5.90 # 5M 12250.0 e ! total-2D5164 HA 54 HIS HN 5.30 # 3 10590.0 e total-2D7585 HA 74 LEU QD2 6.30 # 5M 8749.0 e total-2D6643 HB2 53 LEU HN 4.60 # 2 11720.0 e total-2D2768 HB2 53 LEU QD1 7.00 # w 5M 1418.0 e total-2D8377 HB2 74 LEU QD2 7.00 # w 5M 795.0 e total-2D6644 HB3 53 LEU HN 4.60 # 2 11570.0 e total-2D2767 HB3 54 HIS HN 6.00 # w 3 0.0 e total-2D2773 HB3 74 LEU QD1 6.50 # 5M 7157.0 e total-2D7685 HB3 74 LEU QD2 6.20 # 5M 9336.0 e total-2D7684 53 LEU HN 53 LEU HA 4.30 # 2 19270.0 e total-2D 501 HN 53 LEU HB2 4.10 <# 2 25120.0 e total-2D1070 HN 53 LEU HB3 4.90 ># 2 8237.0 e total-2D1071 HN 53 LEU HG 4.90 # 1 7214.0 e total-2D1228 HN 53 LEU QD1 5.40 # 1M 5606.0 e total-2D1230 HN 53 LEU QD2 5.30 # 1M 6168.0 e total-2D1229 HN 54 HIS HN 3.80 # 2 41520.0 e total-2D7131 HN 55 VAL QG2 6.50 # 5M 7271.0 e total-2D7586 HA 53 LEU HB2 3.90 # 2 33190.0 e total-2D3931 HA 53 LEU HB3 3.60 # 2 51830.0 e total-2D3930 HA 53 LEU HG 4.80 # 1 8225.0 e total-2D3932 HA 53 LEU QD1 5.20 ># 1M 7199.0 e total-2D3929 HA 53 LEU QD2 4.00 <# 1M 33930.0 e ! total-2D3928 HA 54 HIS HN 4.10 # 2 23850.0 e total-2D2465 HA 73 ASP HA 3.60 # 4 26140.0 e total-2D6646 HA 74 LEU HG 6.00 # w 5 3789.0 e total-2D7477 HA 74 LEU QD1 7.00 ># w 5M 1103.0 e total-2D7225 HA 74 LEU QD2 7.00 <# w 5M 2916.0 e total-2D8378 HB2 53 LEU HG 3.60 <# 1 46450.0 e total-2D3944 HB2 53 LEU QD1 4.30 # 1M 22560.0 e total-2D3949 HB2 53 LEU QD2 4.20 # 1M 23770.0 e total-2D3954 HB2 54 HIS HN 4.50 # 2 13930.0 e total-2D2770 HB2 73 ASP HA 6.00 # w 5 2197.0 e total-2D5512 HB3 53 LEU HG 4.30 ># 1 16020.0 e total-2D3935 HB3 53 LEU QD1 4.90 # 1M 9420.0 e total-2D3940 HB3 53 LEU QD2 4.20 # 1M 25060.0 e total-2D3953 HB3 54 HIS HN 4.70 # 2 10360.0 e total-2D3134 HB3 73 ASP HN 6.00 # w 5 819.0 e total-2D6912 HB3 73 ASP HA 6.00 # w 5 2897.0 e total-2D8409 HB3 74 LEU HN 6.00 # w 5 1426.0 e total-2D7395 HG 53 LEU QD1 4.80 ># 1M 11660.0 e total-2D3950 HG 53 LEU QD2 4.10 <# 1M 30490.0 e total-2D3955 HG 54 HIS HN 6.00 # w 5 5302.0 e total-2D3135 QD1 54 HIS HN 7.00 # w 5M 2735.0 e total-2D3136 QD2 54 HIS HN 7.00 # w 5M 4828.0 e total-2D3137 QD2 73 ASP HA 6.70 # 5M 6129.0 e total-2D7679 QD2 74 LEU HN 5.90 # 5M 11940.0 e ! total-2D5733 54 HIS HN 54 HIS HA 3.60 # 2 50750.0 e total-2D 734 HN 54 HIS HB2 3.50 # 2 64910.0 e total-2D5612 HN 54 HIS HB3 3.70 # 2 48370.0 e total-2D1073 HN 55 VAL HN 5.60 # 2 3567.0 e total-2D1726 HA 54 HIS HB2 3.90 # 2 30760.0 e total-2D3961 HA 54 HIS HB3 4.30 # 2 18150.0 e total-2D3962 HA 55 VAL HN 3.30 # 2 88030.0 e total-2D2466 HA 72 ASP HA 3.20 # 4 58300.0 e total-2D5048 HA 72 ASP HB2 6.00 # w 5 1265.0 e total-2D7675 HA 72 ASP HB3 6.00 # w 5 2298.0 e total-2D7674 HA 73 ASP HN 5.20 # 4 3115.0 e total-2D8408 HB2 54 HIS HD2 6.00 # 1 1919.0 e total-2D8048 HB2 55 VAL HN 5.80 ># 2 2955.0 e total-2D2775 HB2 72 ASP HB2 6.00 # w 5 1441.0 e ! total-2D7466 HB3 54 HIS HD2 5.90 # 1 2112.0 e total-2D8049 HB3 55 VAL HN 4.80 <# 2 9471.0 e total-2D2776 HB3 72 ASP HB2 6.00 # w 5 10130.0 e total-2D7467 HD2 72 ASP HB2 6.00 # w 5 2719.0 e total-2D8046 55 VAL HN 55 VAL HA 3.90 # 2 32370.0 e total-2D 129 HN 55 VAL HB 4.90 # 2 8416.0 e total-2D1074 HN 55 VAL QG1 4.60 # 1M 15460.0 e total-2D1231 HN 55 VAL QG2 4.50 # 1M 16880.0 e total-2D1232 HN 56 GLN HN 5.20 # 2 5478.0 e total-2D1740 HN 71 TYR HN 3.40 # 4 37830.0 e total-2D2554 HN 72 ASP HA 3.40 # 4 41110.0 e total-2D2548 HN 72 ASP HB2 6.00 # w 5 0.0 e total-2D2774 HN 73 ASP HN 6.00 # w 4 822.0 e total-2D8379 HA 55 VAL HB 3.40 # 2 73130.0 e total-2D3966 HA 55 VAL QG1 4.50 <# 1M 16420.0 e total-2D3972 HA 55 VAL QG2 5.30 ># 1M 6166.0 e total-2D3971 HA 56 GLN HN 3.00 # 2 159500.0 e total-2D2467 HB 55 VAL QG1 3.90 # 1M 42070.0 e total-2D3965 HB 55 VAL QG2 3.40 # 1M 90220.0 e total-2D3969 HB 56 GLN HN 3.80 # 2 36380.0 e total-2D2786 QG1 56 GLN HN 5.40 <# 5M 18590.0 e total-2D2784 QG1 57 PHE CZ 9.00 # r w 5M 974.0*2e total-2D7334 QG1 71 TYR HN 7.00 # 5M 4931.0 e total-2D2862 QG1 71 TYR HB2 6.70 # 5M 6110.0 e total-2D6844 QG1 71 TYR HB3 7.00 # w 5M 3361.0 e total-2D6845 QG1 71 TYR CG 9.00 # r w 5M 2337.0*2e total-2D8154 QG1 74 LEU HA 7.00 # w 5M 1381.0 e total-2D8380 QG1 74 LEU QD1 7.30 # m 5M 8691.0 e total-2D6651 QG1 74 LEU QD2 6.50 # m 5M 17260.0 e total-2D6652 QG1 75 LEU HN 7.00 # w 5M 3056.0 e total-2D7686 QG1 75 LEU HB2 6.70 # 5M 6170.0 e total-2D7588 QG1 75 LEU HG 6.40 # 5M 7714.0 e total-2D6656 QG1 75 LEU QD1 7.20 # m 5M 9169.0 e total-2D6655 QG1 75 LEU QD2 7.60 # m 5M 6845.0 e total-2D6654 QG2 56 GLN HN 6.90 ># 5M 5321.0 e total-2D7590 QG2 57 PHE CG 9.00 # r w 5M 720.5*2e total-2D6763 QG2 57 PHE CZ 9.00 # r w 5M 874.0*2e total-2D8570 QG2 71 TYR HN 5.90 # 5M 11700.0 e total-2D2863 QG2 71 TYR HB2 6.70 # 5M 6108.0 e total-2D5556 QG2 71 TYR HB3 7.00 # w 5M 4413.0 e total-2D6841 QG2 71 TYR CG 9.00 # r w 5M 1618.5*2e total-2D8569 QG2 73 ASP HN 7.00 # w 5M 894.0 e total-2D6911 QG2 74 LEU HG 6.40 # 5M 8074.0 e total-2D6653 QG2 75 LEU HB2 5.60 # 5M 15530.0 e total-2D7574 QG2 75 LEU QD1 7.30 # m 5M 8657.0 e total-2D8266 QG2 75 LEU QD2 7.50 # m 5M 7533.0 e total-2D7587 56 GLN HN 56 GLN HA 4.20 # 2 20840.0 e total-2D 440 HN 56 GLN HB2 4.20 # 2 20350.0 e total-2D7888 HN 56 GLN HB3 4.20 # 2 22080.0 e total-2D1075 HN 56 GLN HG2 6.00 # w 1 0.0 e total-2D1233 HN 56 GLN HG3 5.10 # 1 5177.0 e total-2D2199 HN 56 GLN HE21 6.00 # w 1 1534.0 e total-2D5974 HN 56 GLN HE22 6.00 # w 1 1309.0 e total-2D5851 HN 57 PHE HN 6.00 # w 2 0.0 e total-2D1747 HA 56 GLN HB2 4.10 # 2 23400.0 e total-2D7889 HA 56 GLN HB3 4.00 # 2 27770.0 e total-2D3973 HA 56 GLN HG2 3.70 # 1 37680.0 e ! total-2D3975 HA 56 GLN HG3 3.90 # 1 26770.0 e total-2D5173 HA 57 PHE HN 3.10 # 2 128100.0 e total-2D2468 HA 57 PHE CG 8.00 # r w 5 217.5*2e total-2D8381 HA 70 THR HA 3.10 # 4 65570.0 e total-2D5049 HA 70 THR HB 6.00 # w 5 4104.0 e total-2D7592 HA 70 THR QG2 5.20 # 5M 22390.0 e total-2D5196 HA 71 TYR HN 3.30 # 4 44170.0 e total-2D2220 HB2 56 GLN HG2 3.70 # 1 37540.0 e total-2D7894 HB2 56 GLN HG3 3.50 # 1 49880.0 e total-2D7891 HB2 56 GLN HE22 5.10 # 1 5472.0 e total-2D7934 HB2 57 PHE HN 4.40 # 2 15310.0 e total-2D7933 HB2 68 LEU QD1 7.00 # w 5M 3678.0 e total-2D8385 HB2 70 THR HA 6.00 # w 5 1195.0 e total-2D8382 HB2 70 THR QG2 5.80 # 5M 12890.0 e total-2D8384 HB2 71 TYR HN 6.00 # w 5 7259.0 e total-2D7925 HB3 56 GLN HG2 3.00 # 1 129000.0 e total-2D5170 HB3 56 GLN HG3 4.60 # 1 10080.0 e total-2D5169 HB3 56 GLN HE21 5.10 # 1 5213.0 e total-2D6227 HB3 56 GLN HE22 6.00 # 1 1920.0 e total-2D6229 HB3 57 PHE HN 4.90 # 2 8316.0 e total-2D2795 HB3 70 THR HA 6.00 # w 5 859.0 e total-2D8383 HB3 71 TYR HN 6.00 # w 5 3508.0 e total-2D7589 HG2 56 GLN HE21 3.50 # 1 49360.0 e total-2D6228 HG2 56 GLN HE22 4.10 # 1 19980.0 e total-2D5723 HG2 57 PHE HN 6.00 # w 5 8878.0 e total-2D6012 HG2 70 THR QG2 6.00 # 5M 10670.0 e total-2D7591 HG3 56 GLN HE21 4.10 # 1 19550.0 e total-2D7820 HG3 56 GLN HE22 5.50 # 1 3300.0 e total-2D6230 HG3 57 PHE HN 5.80 # 5 15310.0 e total-2D7821 HG3 70 THR QG2 6.10 # 5M 10220.0 e total-2D8214 HE21 68 LEU QD1 5.60 # 5M 15900.0 e total-2D7092 HE21 68 LEU QD2 5.80 # 5M 13440.0 e total-2D7091 HE22 68 LEU QD1 5.70 # 5M 13590.0 e total-2D7876 HE22 68 LEU QD2 6.00 # 5M 10810.0 e total-2D6939 57 PHE HN 57 PHE HA 3.60 # 2 50260.0 e total-2D 487 HN 57 PHE HB2 5.70 # 2 3371.0 e total-2D1078 HN 57 PHE HB3 5.80 # 2 2862.0 e total-2D1077 HN 57 PHE CG 8.00 # r 1 2057.5*2e total-2D5867 HN 57 PHE CZ 7.00 # m w 1 812.0*2e total-2D6315 HN 57 PHE HZ 6.00 # w 1 0.0 - total-2D6316 HN 58 ALA HN 4.80 # 2 9906.0 e total-2D1759 HN 68 LEU QD2 5.10 # 5M 25590.0 e total-2D3141 HN 69 VAL HN 3.20 # 4 53700.0 e ! total-2D1749 HN 69 VAL HB 6.00 # w 5 11540.0 e total-2D5794 HN 69 VAL QG1 6.70 # 5M 6494.0 e total-2D5793 HN 69 VAL QG2 6.50 # 5M 7554.0 e total-2D5792 HN 70 THR HA 3.60 # 4 29430.0 e ! total-2D2218 HA 57 PHE HB2 3.60 # 2 56410.0 e total-2D3985 HA 57 PHE HB3 3.50 # 2 65120.0 e total-2D3984 HA 57 PHE CG 7.00 # m w 1 1822.0*2e total-2D6324 HA 58 ALA HN 3.50 # 2 63770.0 e total-2D2469 HB2 57 PHE CG 7.00 # r 1 6160.0*2e total-2D6205 HB2 57 PHE CZ 8.00 <# r w 1 703.5*2e total-2D6327 HB2 58 ALA HN 3.80 # 2 41500.0 e total-2D2801 HB3 57 PHE CG 6.40 # r 1 13730.0*2e total-2D6406 HB3 57 PHE CZ 8.00 ># r w 1 169.5*2e total-2D6271 HB3 57 PHE HZ 6.00 # w 1 1227.0 e total-2D6289 HB3 58 ALA HN 4.10 # 2 23460.0 e total-2D2802 HB3 71 TYR CG 8.00 # r w 5 1218.5*2e total-2D8150 CG 57 PHE CZ 7.80 # rr 1 30650.0*4e total-2D6322 CG 57 PHE HZ 5.10 # r 1 119000.0*2e total-2D6319 CG 58 ALA HN 8.00 # r w 5 3695.5*2e total-2D5868 CG 59 VAL QG1 8.00 <# r 5M 10885.0*2e total-2D5701 CG 59 VAL QG2 9.00 ># r w 5M 1129.0*2e total-2D7594 CG 69 VAL QG1 9.00 # r w 5M 1159.5*2e total-2D8205 CG 69 VAL QG2 9.00 # r w 5M 1486.5*2e total-2D6759 CG 75 LEU QD1 9.00 # r w 5M 326.5*2e total-2D7690 CG 75 LEU QD2 9.00 # r w 5M 294.0*2e total-2D7689 CG 79 PHE CZ 10.00 # rrw 5 107.3*4e total-2D8391 CZ 57 PHE HZ 6.10 # r 1 19705.0*2e total-2D6321 CZ 59 VAL QG1 8.00 <# r 5M 11140.0*2e total-2D6328 CZ 59 VAL QG2 9.00 ># r w 5M 3285.0*2e total-2D8539 CZ 69 VAL HB 8.00 # r w 5 3136.5*2e total-2D8206 CZ 69 VAL QG1 9.00 # r w 5M 4702.0*2e total-2D8203 CZ 69 VAL QG2 9.00 # r w 5M 2565.0*2e total-2D8204 CZ 71 TYR CG 10.00 # rrw 5 980.3*4e total-2D8389 CZ 71 TYR CZ 10.00 # rrw 5 198.3*4e total-2D8552 CZ 75 LEU QD2 8.70 # r 5M 6210.0*2e total-2D8207 CZ 79 PHE CG 9.10 # rr 5 35850.0*4e total-2D8108 CZ 79 PHE CZ 10.00 # rrw 5 1358.5*4e total-2D6269 CZ 85 ILE HB 8.00 # r w 5 645.5*2e total-2D6540 CZ 85 ILE QG2 9.00 # r w 5M 2153.5*2e total-2D8200 CZ 85 ILE HG12 8.00 # r w 5 422.0*2e total-2D8078 CZ 85 ILE QD1 8.80 # r 5M 5880.0*2e total-2D8386 CZ 102 VAL QG2 9.00 # r w 5M 3730.0*2e total-2D8208 HZ 59 VAL QG1 6.30 # 5M 8583.0 e total-2D8104 HZ 75 LEU QD1 7.00 # w 5M 1333.0 e total-2D7688 HZ 75 LEU QD2 7.00 # w 5M 2538.0 e total-2D7687 HZ 79 PHE CG 6.80 # r 5 48140.0*2e total-2D8109 HZ 79 PHE CZ 8.00 # r w 5 7320.0*2e total-2D8390 HZ 85 ILE HB 6.00 # w 5 1373.0 e total-2D6766 HZ 85 ILE HG12 6.00 # w 5 989.0 e total-2D8077 HZ 85 ILE QD1 6.70 # 5M 6345.0 e total-2D8387 HZ 102 VAL QG1 7.00 # w 5M 2552.0 e total-2D8388 HZ 102 VAL QG2 7.00 # w 5M 2730.0 e total-2D8209 58 ALA HN 58 ALA HA 4.00 # 2 28290.0 e total-2D 248 HN 58 ALA QB 3.50 # 2M 32990.0 e total-2D1079 HA 58 ALA QB 3.40 # s 2M 102900.0 e total-2D3991 HA 59 VAL HN 3.40 # 2 74760.0 e total-2D2470 HA 67 ILE QG2 6.50 # 5M 7262.0 e total-2D7596 HA 68 LEU HA 3.10 # 4 71030.0 e total-2D4841 HA 68 LEU QD1 7.00 ># w 5M 2530.0 e total-2D8392 HA 68 LEU QD2 5.00 <# 5M 26420.0 e total-2D5818 HA 69 VAL HN 3.20 # 4 59660.0 e total-2D2403 QB 59 VAL HN 4.00 # 2M 13970.0 e total-2D2808 QB 66 GLU HG2 6.20 # 5M 9199.0 e total-2D7447 QB 66 GLU HG3 6.20 # 5M 9288.0 e total-2D7119 QB 67 ILE HN 7.00 # w 5M 3881.0 e total-2D5811 QB 68 LEU HN 6.30 # 5M 8480.0 e total-2D2842 QB 68 LEU HA 6.20 # 5M 9594.0 e total-2D8395 QB 68 LEU HG 4.40 # 5M 52660.0 e total-2D8394 QB 68 LEU QD1 6.20 # m 5M 23590.0 e total-2D5178 QB 68 LEU QD2 6.80 # m 5M 12630.0 e total-2D8393 QB 69 VAL HN 6.20 # 5M 8920.0 e total-2D3375 59 VAL HN 59 VAL HA 4.10 # 2 23250.0 e total-2D2336 HN 59 VAL HB 3.90 # 2 31760.0 e total-2D2335 HN 59 VAL QG1 4.40 <# 1M 19370.0 e total-2D2334 HN 59 VAL QG2 5.20 ># 1M 7293.0 e total-2D2333 HN 60 HIS HN 4.50 # 2 14030.0 e total-2D3755 HN 60 HIS HD2 6.00 # w 5 8906.0 e total-2D5989 HN 67 ILE HN 3.20 # 4 59680.0 e total-2D1817 HN 67 ILE QG2 6.00 # 5M 10520.0 e total-2D7598 HN 67 ILE QD1 7.00 # w 5M 2471.0 e total-2D5683 HN 68 LEU HA 3.40 # 4 41360.0 e total-2D2402 HN 68 LEU QD2 5.70 # 5M 14080.0 e total-2D2846 HA 59 VAL HB 4.50 # 2 14720.0 e total-2D3997 HA 59 VAL QG1 4.70 ># 1M 13510.0 e total-2D3992 HA 59 VAL QG2 3.90 <# 1M 42770.0 e total-2D4003 HA 60 HIS HN 3.10 # 2 133000.0 e total-2D2471 HA 67 ILE QG2 7.00 # w 5M 1393.0 e total-2D7601 HB 59 VAL QG1 4.00 # 1M 35640.0 e total-2D3999 HB 59 VAL QG2 3.60 # 1M 61220.0 e total-2D3996 HB 60 HIS HN 5.20 # 2 6052.0 e total-2D2812 HB 67 ILE QG2 6.00 # 5M 11420.0 e total-2D5188 HB 69 VAL QG1 7.00 # w 5M 4528.0 e total-2D6659 HB 69 VAL QG2 7.00 # w 5M 4652.0 e total-2D6658 QG1 60 HIS HN 5.80 # 5M 12710.0 e total-2D2810 QG1 67 ILE HN 7.00 # w 5M 1082.0 e total-2D8506 QG1 67 ILE QG2 7.00 # m 5M 10680.0 e total-2D8507 QG1 69 VAL HB 5.70 # 5M 14270.0 e total-2D6664 QG1 69 VAL QG1 7.90 # m 5M 5471.0 e total-2D6661 QG1 69 VAL QG2 6.50 # m 5M 16610.0 e total-2D6660 QG1 79 PHE CZ 9.00 # r w 5M 319.5*2e total-2D8418 QG2 60 HIS HN 5.10 # 5M 25850.0 e total-2D2809 QG2 67 ILE HB 7.00 # 5M 4901.0 e total-2D6666 QG2 67 ILE QG1 8.00 # m w 5M 1466.0*2e total-2D6665 QG2 84 GLY HA2 7.00 # w 5M 3686.0 e total-2D6560 60 HIS HN 60 HIS HA 4.50 # 2 13840.0 e total-2D1319 HN 60 HIS HB2 6.00 # w 2 1956.0 e total-2D1081 HN 60 HIS HB3 5.80 # 2 3120.0 e total-2D1082 HN 60 HIS HD2 6.00 # w 1 957.0 e total-2D8396 HN 61 ASP HN 4.50 # 2 13930.0 e total-2D2349 HA 60 HIS HB2 3.80 # 2 40880.0 e total-2D4004 HA 60 HIS HB3 4.10 # 2 22670.0 e total-2D4005 HA 61 ASP HN 3.40 # 2 82120.0 e total-2D2472 HA 66 GLU HA 3.10 # 4 68140.0 e total-2D4840 HA 66 GLU QB 7.00 # m w 5 4172.0*2e total-2D5181 HA 66 GLU HG2 6.00 # w 5 1742.0 e total-2D5182 HA 66 GLU HG3 6.00 # w 5 2352.0 e total-2D8508 HA 67 ILE HN 4.10 # 4 13270.0 e total-2D3743 HB2 60 HIS HD2 4.10 # 1 19030.0 e total-2D6214 HB2 60 HIS HE1 6.00 ># w 1 1363.0 e total-2D6218 HB2 61 ASP HN 4.00 <# 2 29430.0 e total-2D6201 HB2 61 ASP HB3 6.00 # w 5 9237.0 e total-2D7603 HB2 66 GLU QB 7.00 <# m w 5 1272.0*2e total-2D7445 HB2 66 GLU HG3 6.00 # w 5 12430.0 e total-2D7602 HB3 60 HIS HD2 4.80 # 1 8154.0 e total-2D6213 HB3 60 HIS HE1 5.50 <# 1 3539.0 e total-2D6217 HB3 61 ASP HN 4.70 ># 2 11140.0 e total-2D5644 HB3 66 GLU HA 6.00 # w 5 1546.0 e total-2D7443 HB3 66 GLU QB 7.00 ># m w 5 506.0*2e total-2D7444 HB3 66 GLU HG2 6.00 # w 5 3315.0 e total-2D7607 HD2 61 ASP HA 6.00 # w 5 2266.0 e total-2D6216 HD2 66 GLU HA 6.00 # w 5 2534.0 e total-2D6215 61 ASP HN 61 ASP HA 4.50 # 2 14240.0 e total-2D 741 HN 61 ASP HB2 4.10 <# 2 24850.0 e total-2D1083 HN 61 ASP HB3 4.80 ># 2 9445.0 e total-2D1084 HN 63 LEU HN 4.70 # 3 22800.0 e total-2D7127 HN 63 LEU HA 6.00 # w 3 0.0 e total-2D7152 HN 65 GLY HN 4.30 # 3 37430.0 e total-2D1787 HN 66 GLU HA 4.60 # 4 6036.0 e total-2D2818 HN 66 GLU HG2 6.00 # w 5 1032.0 e total-2D3551 HA 61 ASP HB2 3.70 # 2 42660.0 e total-2D4011 HA 61 ASP HB3 3.80 # 2 39400.0 e total-2D4010 HA 63 LEU HN 6.00 # w 3 573.0 e total-2D7149 HB2 63 LEU HN 6.00 <# w 3 4028.0 e total-2D7148 HB3 63 LEU HN 6.00 ># w 3 440.0 e total-2D3533 63 LEU HN 63 LEU HA 3.70 # 2 43000.0 e total-2D 443 HN 63 LEU HB2 3.50 # 2 61840.0 e total-2D1085 HN 63 LEU HB3 4.10 # 2 25140.0 e total-2D1086 HN 63 LEU HG 4.40 # 1 13020.0 e total-2D1236 HN 63 LEU QD1 5.90 # 1M 3145.0 e total-2D1237 HN 63 LEU QD2 6.10 # 1M 2534.0 e total-2D1238 HN 64 GLY HN 3.70 # 2 45090.0 e total-2D1800 HN 64 GLY HA2 6.00 # w 2 1958.0 e total-2D2821 HN 65 GLY HN 5.40 # 3 9037.0 e total-2D1795 HN 65 GLY HA1 6.00 # w 3 1586.0 e total-2D2822 HA 63 LEU HB2 4.20 ># 2 22130.0 e total-2D4016 HA 63 LEU HB3 3.50 <# 2 62190.0 e total-2D4017 HA 63 LEU HG 5.70 # 1 2827.0 e total-2D4018 HA 63 LEU QD1 5.00 ># 1M 8952.0 e total-2D4019 HA 63 LEU QD2 4.20 <# 1M 23970.0 e total-2D4020 HA 64 GLY HN 3.60 # 2 50430.0 e total-2D2474 HB2 63 LEU HG 3.30 <# 1 73140.0 e total-2D4038 HB2 63 LEU QD1 5.40 # 1M 5258.0 e total-2D4025 HB2 63 LEU QD2 5.10 # 1M 7712.0 e total-2D4048 HB2 64 GLY HN 5.10 # 2 6176.0 e total-2D2825 HB2 65 GLY HN 5.40 # 3 9018.0 e total-2D2829 HB3 63 LEU HG 4.30 ># 1 14710.0 e total-2D4022 HB3 63 LEU QD1 4.80 # 1M 10620.0 e total-2D4042 HB3 63 LEU QD2 4.70 # 1M 12640.0 e total-2D4047 HB3 64 GLY HN 4.80 # 2 9356.0 e total-2D2824 HB3 65 GLY HN 5.30 # 3 10790.0 e total-2D2828 HG 63 LEU QD1 4.60 # 1M 15270.0 e total-2D4041 HG 63 LEU QD2 4.60 # 1M 15460.0 e total-2D4046 HG 64 GLY HN 6.00 # w 5 4468.0 e total-2D6756 64 GLY HN 64 GLY HA1 4.10 # 2 25720.0 e total-2D 908 HN 64 GLY HA2 3.90 # 2 33040.0 e total-2D1008 HN 65 GLY HN 3.50 # 2 58920.0 e total-2D1802 HN 65 GLY HA2 6.00 # w 2 707.0 e total-2D7442 HA1 65 GLY HN 6.00 ># w 2 632.0 e total-2D2476 HA2 65 GLY HN 5.20 <# 2 5869.0 e total-2D2475 65 GLY HN 65 GLY HA1 4.00 # 2 27940.0 e total-2D 913 HN 65 GLY HA2 3.60 # 2 53240.0 e total-2D1009 HN 66 GLU HN 5.00 # 2 7002.0 e total-2D1811 HA1 66 GLU HN 3.40 # 2 78020.0 e total-2D2835 HA2 66 GLU HN 3.70 # 2 47600.0 e total-2D2834 66 GLU HN 66 GLU HA 4.10 # 2 24890.0 e total-2D3553 HN 66 GLU QB 4.30 # i 2 45335.0*2e total-2D1087 HN 66 GLU HG2 6.00 # w 1 1835.0 e total-2D1239 HN 66 GLU HG3 6.00 # 1 1943.0 e total-2D1240 HN 67 ILE HN 6.00 # w 2 1834.0 e total-2D7133 HA 66 GLU QB 4.80 # m 2 37060.0*2e total-2D4053 HA 66 GLU HG2 3.90 # 1 27010.0 e total-2D4055 HA 66 GLU HG3 3.90 # 1 26970.0 e total-2D4054 HA 67 ILE HN 3.20 # 2 113700.0 e total-2D2477 HA 67 ILE QG2 7.00 # w 5M 1193.0 e total-2D8510 QB 66 GLU HG2 4.60 <# m 1 45375.0*2e total-2D4060 QB 66 GLU HG3 5.50 ># m 1 11220.0*2e total-2D4057 QB 67 ILE HN 6.10 # m 2 6735.0*2e total-2D7604 HG2 67 ILE HN 5.60 # 5 19100.0 e total-2D7606 HG3 67 ILE HN 5.50 # 5 21910.0 e total-2D7605 67 ILE HN 67 ILE HA 4.00 # 2 30440.0 e total-2D2550 HN 67 ILE HB 4.60 # 2 11370.0 e total-2D1089 HN 67 ILE QG2 5.00 # 1M 8714.0 e total-2D1242 HN 67 ILE QG1 5.90 # m 1 6750.0*2e total-2D1241 HN 67 ILE QD1 5.60 # 1M 4359.0 e total-2D1243 HA 67 ILE HB 4.60 # 2 11340.0 e total-2D4072 HA 67 ILE QG2 5.20 # 1M 6932.0 e total-2D4080 HA 67 ILE QG1 5.50 # i 1 6865.0*2e total-2D4076 HA 67 ILE QD1 4.10 # 1M 31070.0 e total-2D4084 HA 68 LEU HN 3.30 # 2 96890.0 e total-2D2478 HB 67 ILE QG2 4.40 # 1M 18660.0 e total-2D4079 HB 67 ILE QG1 7.00 # m w 1 1229.5*2e total-2D4071 HB 67 ILE QD1 4.20 # 1M 25560.0 e total-2D4070 HB 68 LEU HN 4.40 # 2 14900.0 e total-2D2840 QG2 67 ILE QG1 5.70 # m 1M 12170.0*2e total-2D4078 QG2 67 ILE QD1 4.70 # m 1M 52060.0 e total-2D4081 QG2 68 LEU HN 7.00 # w 5M 3261.0 e total-2D3409 QG2 69 VAL QG1 6.80 # m 5M 13220.0 e total-2D8515 QG2 97 LEU QD2 5.20 # m 5M 63320.0 e total-2D8398 QG1 67 ILE QD1 4.60 # m 1M 65800.0*2e total-2D4073 QG1 68 LEU HN 7.00 # m w 5 10005.0*2e total-2D3411 QG1 96 LYS HD2 7.00 # m w 5 7360.0*2e total-2D5190 QG1 97 LEU QD1 8.00 # m w 5M 4408.0*2e total-2D7609 QG1 97 LEU QD2 8.00 # m w 5M 2667.5*2e total-2D7610 QD1 68 LEU HN 5.70 # 5M 14210.0 e total-2D3410 QD1 96 LYS HD2 5.40 # 5M 18440.0 e total-2D5374 QD1 97 LEU HN 5.90 # 5M 12400.0 e total-2D7608 QD1 97 LEU HB2 6.40 # 5M 8095.0 e total-2D5375 QD1 97 LEU QD2 5.80 # m 5M 35280.0 e total-2D5373 68 LEU HN 68 LEU HA 4.20 # 2 20530.0 e total-2D1826 HN 68 LEU HB2 3.50 <# 2 63890.0 e total-2D1827 HN 68 LEU HB3 4.10 ># 2 22690.0 e total-2D1829 HN 68 LEU HG 4.80 # 1 7567.0 e total-2D1828 HN 68 LEU QD1 5.40 # 1M 5262.0 e total-2D7613 HN 68 LEU QD2 5.70 # 1M 3777.0 e total-2D1831 HN 69 VAL HN 5.50 # 2 4084.0 e total-2D1836 HN 96 LYS QG 7.00 # m w 5 6220.0*2e total-2D3524 HN 96 LYS HD2 5.20 # 5 32340.0 e total-2D2839 HN 97 LEU HN 5.70 # 4 1787.0 e total-2D1837 HN 97 LEU HG 6.00 # w 5 4152.0 e total-2D7611 HA 68 LEU HB2 3.80 # 2 38300.0 e total-2D4099 HA 68 LEU HB3 3.50 # 2 67720.0 e total-2D4098 HA 68 LEU HG 5.30 # 1 4481.0 e total-2D4104 HA 68 LEU QD1 4.80 # 1M 10890.0 e total-2D4114 HA 68 LEU QD2 4.90 # 1M 9589.0 e total-2D4109 HA 69 VAL HN 3.40 # 2 78260.0 e total-2D3060 HB2 68 LEU HG 3.40 # 1 58620.0 e total-2D4100 HB2 68 LEU QD1 6.20 # 1M 2322.0 e total-2D4093 HB2 68 LEU QD2 5.50 # 1M 5118.0 e total-2D4092 HB2 69 VAL HN 4.70 # 2 10440.0 e total-2D3159 HB2 70 THR QG2 7.00 # w 5M 1514.0 e total-2D5388 HB2 96 LYS HB3 5.30 # 5 27310.0 e total-2D6670 HB2 96 LYS HD3 5.50 # 5 21950.0 e total-2D6671 HB2 96 LYS HE2 6.00 # w 5 3387.0 e total-2D8512 HB3 68 LEU HG 3.10 # 1 113500.0 e total-2D4101 HB3 68 LEU QD1 4.40 # 1M 20050.0 e total-2D4111 HB3 68 LEU QD2 4.80 # 1M 11160.0 e total-2D4106 HB3 69 VAL HN 4.20 # 2 20840.0 e total-2D3520 HB3 96 LYS HB3 5.40 # 5 24080.0 e total-2D6673 HB3 96 LYS QG 7.00 # m w 5 10380.0*2e total-2D6672 HG 68 LEU QD1 5.60 ># 1M 4376.0 e total-2D4103 HG 68 LEU QD2 4.60 <# 1M 15180.0 e total-2D4102 HG 69 VAL HN 5.30 # 5 29230.0 e total-2D2845 QD1 69 VAL HN 6.40 ># 5M 8135.0 e total-2D8399 QD1 96 LYS QG 8.00 # m w 5M 4231.5*2e total-2D8439 QD1 96 LYS HE2 7.00 # w 5M 4498.0 e total-2D7651 QD1 96 LYS HE3 7.00 # w 5M 4337.0 e total-2D7652 QD2 69 VAL HN 4.40 <# 5M 49710.0 e total-2D2843 QD2 96 LYS QG 7.60 # m 5M 6540.0*2e total-2D8440 QD2 96 LYS HE2 7.00 # w 5M 4709.0 e total-2D8511 QD2 96 LYS HE3 7.00 # w 5M 4306.0 e total-2D6382 69 VAL HN 69 VAL HA 4.00 # 2 29840.0 e total-2D1844 HN 69 VAL HB 4.00 # 2 26230.0 e total-2D1843 HN 69 VAL QG1 5.10 ># 1M 7987.0 e total-2D1842 HN 69 VAL QG2 4.20 <# 1M 26270.0 e total-2D1841 HN 70 THR HN 5.10 # 2 6769.0 e total-2D7135 HA 69 VAL HB 4.20 # 2 20410.0 e total-2D4120 HA 69 VAL QG1 4.00 # 1M 32770.0 e total-2D4123 HA 69 VAL QG2 3.90 # 1M 37710.0 e total-2D4126 HA 70 THR HN 3.30 # 2 88900.0 e total-2D2481 HA 70 THR QG2 4.70 # 5M 35930.0 e total-2D5195 HA 97 LEU HN 3.80 # 4 19620.0 e total-2D2569 HA 97 LEU HB2 6.00 <# w 5 10380.0 e total-2D6674 HA 97 LEU HB3 6.00 ># w 5 907.0 e total-2D6676 HB 69 VAL QG1 3.40 <# 1M 86140.0 e total-2D4121 HB 69 VAL QG2 4.30 ># 1M 22120.0 e total-2D4125 HB 70 THR HN 5.30 # 2 5128.0 e total-2D3483 HB 99 ALA QB 6.90 # 5M 5468.0 e total-2D7617 QG1 70 THR HN 4.90 # 5M 29720.0 e total-2D2849 QG1 70 THR HA 7.00 # w 5M 1060.0 e total-2D6095 QG1 79 PHE CG 9.00 # r w 5M 1073.5*2e total-2D6138 QG1 87 ALA QB 5.90 # m 5M 30870.0 e total-2D8401 QG1 96 LYS QG 8.00 # m w 5M 2663.0*2e total-2D5381 QG1 97 LEU HN 6.40 # 5M 8227.0 e total-2D7614 QG1 97 LEU HB2 5.50 # 5M 16780.0 e total-2D5384 QG1 97 LEU HB3 4.40 # 5M 54980.0 e total-2D6678 QG1 97 LEU QD2 6.60 # m 5M 16020.0 e total-2D8513 QG1 99 ALA HN 5.10 <# 5M 25240.0 e total-2D3741 QG1 99 ALA QB 7.40 <# m 5M 8078.0 e total-2D7618 QG2 70 THR HN 5.40 # 5M 18060.0 e total-2D7616 QG2 87 ALA QB 6.10 # m 5M 24400.0 e total-2D8402 QG2 96 LYS QG 8.00 # m w 5M 3579.0*2e total-2D5379 QG2 97 LEU HN 6.60 # 5M 6964.0 e total-2D7615 QG2 97 LEU HB2 5.50 # 5M 17050.0 e total-2D5522 QG2 99 ALA HN 7.00 ># w 5M 2345.0 e total-2D8400 QG2 99 ALA QB 8.00 ># m w 5M 2116.0 e total-2D8514 70 THR HN 70 THR HA 3.90 # 2 31530.0 e total-2D 314 HN 70 THR HB 4.80 # 2 9663.0 e total-2D1093 HN 70 THR QG2 4.30 # 1M 22240.0 e total-2D1251 HN 71 TYR HN 5.00 # 2 7453.0 e total-2D1869 HN 96 LYS QG 7.00 # m w 5 707.5*2e total-2D7047 HN 97 LEU HN 3.50 # 4 31700.0 e ! total-2D3632 HN 98 ALA HA 3.10 # 4 68240.0 e total-2D3680 HN 99 ALA HN 3.40 # 4 37130.0 e total-2D3747 HA 70 THR HB 3.50 # 2 58700.0 e total-2D4130 HA 70 THR QG2 3.50 # 1M 75690.0 e total-2D4132 HA 71 TYR HN 3.30 # 2 89620.0 e total-2D2483 HB 70 THR QG2 3.40 # s 1M 123000.0 e total-2D4131 HB 71 TYR HN 4.30 # 2 17260.0 e total-2D2864 HB 98 ALA HA 6.00 # w 5 1017.0 e total-2D8403 HB 98 ALA QB 7.00 # w 5M 3153.0 e total-2D6679 QG2 71 TYR HN 5.50 # 5M 17360.0 e total-2D5635 QG2 96 LYS HB2 7.00 # w 5M 3811.0 e total-2D8516 QG2 98 ALA HA 7.00 # w 5M 1001.0 e total-2D5518 71 TYR HN 71 TYR HA 4.60 # 2 11490.0 e total-2D1864 HN 71 TYR HB2 3.80 <# 2 36030.0 e total-2D1863 HN 71 TYR HB3 5.20 ># 2 5977.0 e total-2D1862 HN 72 ASP HN 5.50 # 2 4210.0 e total-2D7136 HA 71 TYR HB2 4.70 # 2 10060.0 e total-2D4136 HA 71 TYR HB3 4.30 # 2 17370.0 e total-2D4133 HA 71 TYR CG 5.80 # m 1 7550.0*2e total-2D6256 HA 72 ASP HN 3.10 # 2 127900.0 e total-2D2400 HA 99 ALA HN 4.30 # 4 9816.0 e total-2D6192 HB2 71 TYR CG 6.60 # r 1 9715.0*2e total-2D6261 HB2 72 ASP HN 5.70 # 2 3365.0 e total-2D7062 HB3 71 TYR CG 7.20 # r 1 4680.5*2e total-2D6266 HB3 72 ASP HN 4.90 # 2 7992.0 e total-2D2867 HB3 75 LEU QD1 7.00 # w 5M 911.0 e total-2D6683 HB3 75 LEU QD2 7.00 # w 5M 748.0 e total-2D6680 HB3 102 VAL QG2 7.00 # w 5M 3737.0 e total-2D6827 CG 71 TYR CZ 7.50 # rr 1 54525.0*4e total-2D7851 CG 71 TYR HH 6.50 # r 1 11245.0*2e total-2D8026 CG 72 ASP HN 8.00 # r w 5 8580.0*2e total-2D8034 CG 73 ASP HN 8.00 # r w 5 1493.0*2e total-2D6323 CG 75 LEU QD2 8.50 # r 5M 7345.0*2e total-2D8113 CG 99 ALA QB 8.40 # r 5M 7640.0*2e total-2D8532 CG 100 THR HG1 8.00 # r w 5 5760.0*2e total-2D8015 CG 102 VAL QG2 9.00 # r w 5M 2145.0*2e total-2D7921 CZ 71 TYR HH 5.20 # r 1 89050.0*2e total-2D8031 CZ 73 ASP HN 8.00 # r w 5 6575.0*2e total-2D6913 CZ 73 ASP HB2 8.00 # r w 5 5175.0*2e total-2D8081 CZ 73 ASP HB3 8.00 # r w 5 2599.0*2e total-2D8088 CZ 75 LEU HA 8.00 # r w 5 6970.0*2e total-2D8087 CZ 75 LEU QD1 9.00 # r w 5M 4372.0*2e total-2D8086 CZ 75 LEU QD2 9.00 # r w 5M 4380.0*2e total-2D8084 CZ 100 THR HA 8.00 # r w 5 411.5*2e total-2D8549 CZ 100 THR HG1 6.80 # r 5 48720.0*2e total-2D6344 CZ 101 GLU HN 8.00 # r w 5 1056.0*2e total-2D8404 CZ 102 VAL HN 8.00 # r w 5 2279.0*2e total-2D8092 CZ 102 VAL QG2 8.60 # r 5M 6545.0*2e total-2D8085 HH 73 ASP HB2 6.00 # w 5 4314.0 e total-2D8020 HH 75 LEU HA 6.00 # w 5 1540.0 e total-2D8024 HH 75 LEU QD2 7.00 # 5M 5071.0 e total-2D8028 HH 100 THR HA 6.00 # w 5 1349.0 e total-2D8022 HH 100 THR HG1 5.70 # 5 18030.0 e total-2D8089 HH 101 GLU HA 6.00 # w 5 3042.0 e total-2D8023 HH 102 VAL HN 6.00 # w 5 1793.0 e total-2D8406 HH 102 VAL HB 6.00 # w 5 803.0 e total-2D8029 HH 102 VAL QG2 7.00 # w 5M 4331.0 e total-2D8027 72 ASP HN 72 ASP HA 3.90 # 2 34280.0 e total-2D 113 HN 72 ASP HB2 3.70 # 2 42620.0 e total-2D1095 HN 72 ASP HB3 3.60 # 2 55990.0 e total-2D1096 HN 73 ASP HN 3.80 # 2 38850.0 e total-2D1872 HN 73 ASP HB3 6.00 # w 2 0.0 e total-2D3522 HA 72 ASP HB2 4.40 # 2 15850.0 e total-2D4143 HA 72 ASP HB3 4.30 # 2 18220.0 e total-2D4144 HA 73 ASP HN 3.80 # 2 39000.0 e total-2D2485 HB2 73 ASP HN 5.00 <# 2 7332.0 e total-2D2871 HB3 73 ASP HN 5.90 ># 2 2578.0 e total-2D2870 73 ASP HN 73 ASP HA 3.60 # 2 52770.0 e total-2D 262 HN 73 ASP HB2 4.00 # 2 26870.0 e total-2D1098 HN 73 ASP HB3 4.00 # 2 29190.0 e total-2D1097 HN 74 LEU HN 5.90 # 2 2562.0 e total-2D5717 HA 73 ASP HB2 4.70 # 2 10010.0 e total-2D4149 HA 73 ASP HB3 4.60 # 2 11380.0 e total-2D5038 HA 74 LEU HN 3.30 # 2 85240.0 e total-2D2878 HA 74 LEU HB2 6.00 # 2 2399.0 e total-2D7677 HA 74 LEU HB3 6.00 # 2 2403.0 e total-2D7678 HA 74 LEU QD2 7.00 # w 5M 3072.0 e total-2D5197 HB2 74 LEU HN 4.50 # 2 14460.0 e total-2D2877 HB2 74 LEU QD1 7.00 # w 5M 1500.0 e total-2D7766 HB2 100 THR HG1 6.00 # w 5 2084.0 e total-2D6339 HB3 74 LEU HN 4.80 # 2 8866.0 e total-2D2876 74 LEU HN 74 LEU HA 4.00 # 2 30070.0 e total-2D 456 HN 74 LEU HB2 3.40 <# 2 77000.0 e total-2D1099 HN 74 LEU HB3 4.00 ># 2 27920.0 e total-2D7396 HN 74 LEU HG 4.30 # 1 15070.0 e total-2D1253 HN 74 LEU QD1 5.70 # 1M 3891.0 e total-2D1255 HN 74 LEU QD2 5.40 # 1M 5310.0 e total-2D1254 HN 75 LEU HN 4.70 # 2 10880.0 e total-2D1898 HA 74 LEU HB2 3.90 # 2 35020.0 e total-2D4154 HA 74 LEU HB3 4.00 # 2 26520.0 e total-2D4153 HA 74 LEU HG 4.20 # 1 17780.0 e total-2D4155 HA 74 LEU QD1 4.40 # 1M 19850.0 e total-2D4151 HA 74 LEU QD2 4.50 # 1M 16100.0 e total-2D4180 HA 75 LEU HN 3.30 # 2 99110.0 e total-2D2486 HA 75 LEU HB2 4.60 # 2 12200.0 e total-2D7683 HA 75 LEU HG 6.00 # w 5 1596.0 e total-2D7682 HA 75 LEU QD1 7.00 # w 5M 1316.0 e total-2D8410 HB2 74 LEU HG 3.40 # 1 61800.0 e total-2D4169 HB2 74 LEU QD1 4.40 # 1M 19470.0 e total-2D4173 HB2 74 LEU QD2 4.10 # 1M 29000.0 e total-2D4178 HB2 75 LEU HN 4.10 # 2 23460.0 e total-2D7401 HB3 74 LEU HG 3.40 # 1 60260.0 e total-2D4168 HB3 74 LEU QD1 4.50 # 1M 16700.0 e total-2D4172 HB3 74 LEU QD2 4.30 # 1M 22560.0 e total-2D4177 HB3 75 LEU HN 4.30 # 2 18830.0 e total-2D7400 HG 74 LEU QD1 4.50 # 1M 16540.0 e total-2D4174 HG 74 LEU QD2 4.30 # 1M 23230.0 e total-2D4179 HG 75 LEU HN 6.00 # w 5 11370.0 e total-2D7402 QD1 75 LEU HN 6.70 # 5M 6122.0 e total-2D7399 QD2 75 LEU HN 7.00 # w 5M 3726.0 e total-2D7398 75 LEU HN 75 LEU HA 4.20 # 2 22270.0 e total-2D 95 HN 75 LEU HB2 3.60 <# 2 54130.0 e total-2D1101 HN 75 LEU HB3 4.80 ># 2 9169.0 e total-2D1102 HN 75 LEU HG 4.50 # 1 10940.0 e total-2D1256 HN 75 LEU QD1 5.70 # 1M 4050.0 e total-2D1258 HN 75 LEU QD2 5.20 # 1M 7111.0 e total-2D1257 HN 76 PRO HD2 6.00 # w 5 1770.0 e total-2D7403 HN 76 PRO HD3 6.00 # w 5 964.0 e total-2D6903 HN 78 LEU HN 6.00 # w 3 1614.0 e total-2D7767 HN 78 LEU HA 5.80 # 3 6403.0 e total-2D7768 HA 75 LEU HB2 3.70 # 2 43470.0 e total-2D4184 HA 75 LEU HB3 4.10 # 2 23240.0 e total-2D4183 HA 75 LEU HG 4.50 # 1 10920.0 e total-2D4185 HA 75 LEU QD1 5.10 ># 1M 8210.0 e total-2D4205 HA 75 LEU QD2 4.30 <# 1M 21350.0 e total-2D4210 HA 76 PRO HD2 4.50 # 5 77170.0 e total-2D5487 HA 76 PRO HD3 4.90 # 5 47350.0 e total-2D5488 HA 100 THR HG1 6.00 # w 5 994.0 e total-2D7719 HA 102 VAL QG1 7.00 # w 5M 2306.0 e total-2D7721 HA 102 VAL QG2 6.90 # 5M 5315.0 e total-2D8517 HB2 75 LEU HG 4.30 # 1 14940.0 e total-2D4193 HB2 75 LEU QD1 4.70 # 1M 12710.0 e total-2D4203 HB2 75 LEU QD2 5.50 # 1M 5085.0 e total-2D4208 HB2 76 PRO HD3 5.90 # 5 14040.0 e total-2D5493 HB2 78 LEU HA 4.10 # 3 51540.0 e total-2D7770 HB3 75 LEU HG 4.40 # 1 12840.0 e total-2D4198 HB3 75 LEU QD1 4.80 # 1M 11190.0 e total-2D4202 HB3 75 LEU QD2 5.00 # 1M 8685.0 e total-2D4207 HB3 76 PRO HG3 5.20 # 5 32970.0 e total-2D7698 HB3 76 PRO HD2 6.00 # w 5 1377.0 e total-2D7696 HB3 76 PRO HD3 4.70 # 5 58550.0 e total-2D5496 HB3 79 PHE HN 6.00 # w 3 491.0 e total-2D8411 HB3 79 PHE HB2 6.00 # w 5 1222.0 e total-2D8412 HB3 102 VAL HB 6.00 # w 5 5375.0 e ! total-2D7771 HB3 102 VAL QG1 7.00 # w 5M 3834.0 e total-2D7772 HG 75 LEU QD1 4.00 # 1M 33080.0 e total-2D4204 HG 75 LEU QD2 3.90 # 1M 39500.0 e total-2D4209 QD1 76 PRO HG3 7.00 # w 5M 277.0 e total-2D7697 QD1 76 PRO HD2 7.00 # w 5M 1164.0 e total-2D5489 QD1 76 PRO HD3 6.60 # 5M 6969.0 e total-2D5511 QD1 79 PHE HB2 7.00 # w 5M 842.0 e total-2D8414 QD1 79 PHE HB3 7.00 # w 5M 1746.0 e total-2D6824 QD1 79 PHE CG 9.00 ># r w 5M 881.5*2e total-2D7692 QD1 79 PHE CZ 9.00 # r w 5M 2102.0*2e total-2D7691 QD1 102 VAL HB 6.30 # 5M 8850.0 e total-2D6856 QD1 102 VAL QG1 7.50 # m 5M 7385.0 e total-2D6853 QD2 76 PRO HG2 7.00 # w 5M 1460.0 e total-2D8417 QD2 76 PRO HD2 5.50 # 5M 17580.0 e total-2D5201 QD2 76 PRO HD3 5.20 # 5M 22040.0 e total-2D5200 QD2 79 PHE HB2 7.00 # w 5M 1036.0 e total-2D8413 QD2 79 PHE HB3 7.00 # w 5M 677.0 e total-2D6825 QD2 79 PHE CG 9.00 <# r w 5M 3866.0*2e total-2D6142 QD2 79 PHE CZ 9.00 # r w 5M 907.0*2e total-2D6140 QD2 100 THR HG1 7.00 # w 5M 2073.0 e total-2D8019 QD2 102 VAL QG1 8.00 # m w 5M 4834.0 e total-2D6854 QD2 102 VAL QG2 7.30 # m 5M 8362.0 e total-2D8450 76 PRO HA 76 PRO HB2 4.10 ># 2 23670.0 e total-2D5444 HA 76 PRO HB3 3.40 <# 2 74160.0 e total-2D5453 HA 76 PRO HG2 4.30 <# 1 14670.0 e total-2D5471 HA 76 PRO HG3 6.00 ># w 1 1507.0 e total-2D5443 HA 76 PRO HD2 6.00 # w 1 1146.0 e total-2D5480 HA 76 PRO HD3 6.00 # w 1 479.0 e total-2D5447 HA 77 ASP HN 3.80 # 2 41370.0 e total-2D1333 HA 78 LEU HN 5.90 # 3 5482.0 e total-2D3697 HB2 76 PRO HG2 3.60 # 1 45520.0 e total-2D5455 HB2 76 PRO HG3 3.70 # 1 39080.0 e total-2D5454 HB2 76 PRO HD2 5.00 # 1 6125.0 e total-2D5458 HB2 76 PRO HD3 6.00 # w 1 430.0 e total-2D5485 HB2 77 ASP HN 4.80 <# 2 8899.0 e total-2D1337 HB2 78 LEU HN 6.00 # w 3 3483.0 e total-2D3277 HB2 79 PHE HN 5.70 # 3 6795.0 e total-2D3610 HB3 76 PRO HG2 3.70 # 1 37430.0 e total-2D5463 HB3 76 PRO HG3 3.50 # 1 53640.0 e total-2D5448 HB3 76 PRO HD2 6.00 # w 1 858.0 e total-2D5451 HB3 76 PRO HD3 6.00 # w 1 531.0 e total-2D5452 HB3 77 ASP HN 6.00 ># w 2 1271.0 e total-2D1336 HB3 78 LEU HN 6.00 # w 3 1509.0 e total-2D6883 HG2 76 PRO HD2 4.00 # 1 22580.0 e total-2D5477 HG2 76 PRO HD3 4.50 # 1 11350.0 e total-2D5464 HG2 77 ASP HN 6.00 # w 5 7049.0 e total-2D1338 HG2 79 PHE HN 6.00 # w 5 849.0 e total-2D6739 HG2 85 ILE QD1 7.00 # w 5M 3389.0 e total-2D8187 HG2 102 VAL QG1 7.00 # w 5M 1994.0 e total-2D8184 HG2 102 VAL QG2 7.00 # w 5M 1327.0 e total-2D8416 HG2 104 ALA QB 6.80 # 5M 5944.0 e total-2D7773 HG3 76 PRO HD2 4.70 # 1 8896.0 e total-2D5475 HG3 76 PRO HD3 4.50 # 1 11260.0 e total-2D5486 HG3 77 ASP HN 6.00 # w 5 8775.0 e total-2D1339 HG3 79 PHE HN 6.00 # w 5 1942.0 e total-2D7742 HG3 85 ILE QD1 7.00 # w 5M 4709.0 e total-2D8186 HG3 102 VAL HB 6.00 # w 5 9043.0 e total-2D8188 HG3 102 VAL QG1 7.00 # w 5M 1650.0 e total-2D8185 HG3 104 ALA QB 7.00 # w 5M 2949.0 e total-2D7774 HD2 77 ASP HN 6.00 # w 5 8582.0 e total-2D1334 HD2 79 PHE HN 6.00 # w 5 556.0 e total-2D8415 HD2 102 VAL HB 6.00 # w 5 913.0 e total-2D8189 HD2 102 VAL QG1 7.00 # w 5M 3376.0 e total-2D7777 HD2 102 VAL QG2 7.00 # w 5M 1095.0 e total-2D5828 HD3 79 PHE HB3 6.00 # w 5 1589.0 e total-2D7778 HD3 79 PHE CG 8.00 # r w 5 464.0*2e total-2D6498 HD3 102 VAL QG1 6.50 # 5M 7457.0 e total-2D7776 HD3 102 VAL QG2 6.30 # 5M 8675.0 e total-2D7775 77 ASP HN 77 ASP HA 4.70 # 2 11310.0 e total-2D 156 HN 77 ASP HB2 6.00 ># w 2 2266.0 e total-2D1106 HN 77 ASP HB3 4.10 <# 2 25260.0 e total-2D1259 HN 78 LEU HN 4.10 # 2 25660.0 e total-2D2490 HN 78 LEU HB3 6.00 # w 2 1733.0 e total-2D7705 HN 79 PHE HN 6.00 # w 3 1427.0 e total-2D7391 HA 77 ASP HB2 6.00 # w 2 0.0 - total-2D4212 HA 77 ASP HB3 3.20 # 2 101000.0 e total-2D4211 HA 78 LEU HN 4.30 # 2 17230.0 e total-2D2487 HA 79 PHE HN 5.10 # 3 13250.0 e total-2D2892 HA 80 ARG HN 6.00 # w 3 3890.0 e total-2D3701 HA 80 ARG HG2 6.00 # w 5 4633.0 e total-2D7702 HA 80 ARG HD2 6.00 # w 5 704.0 e total-2D7704 HB3 78 LEU HN 4.90 # 2 7881.0 e total-2D2882 HB3 78 LEU HB3 6.00 # w 5 7759.0 e total-2D5537 HB3 78 LEU QD1 6.30 # 5M 8656.0 e total-2D5538 HB3 79 PHE HN 5.60 # 3 7305.0 e total-2D7779 HB3 80 ARG HA 6.00 # w 3 3749.0 e total-2D7315 HB3 80 ARG HD3 6.00 # w 5 4714.0 e total-2D8518 78 LEU HN 78 LEU HA 3.70 # 2 42160.0 e total-2D1907 HN 78 LEU HB2 4.80 # 2 9537.0 e total-2D2200 HN 78 LEU HB3 4.20 # 2 20640.0 e total-2D1905 HN 78 LEU HG 5.70 # 1 2736.0 e total-2D1906 HN 78 LEU QD1 5.50 # 1M 4777.0 e total-2D1904 HN 78 LEU QD2 5.80 # 1M 3471.0 e total-2D1903 HN 79 PHE HN 3.60 # 2 50710.0 e total-2D1909 HN 80 ARG HN 6.00 # w 3 3755.0 e total-2D7706 HA 78 LEU HB2 4.70 ># 2 11190.0 e total-2D4232 HA 78 LEU HB3 3.70 <# 2 45390.0 e total-2D4220 HA 78 LEU HG 4.00 # 1 25090.0 e total-2D4219 HA 78 LEU QD1 3.90 # 1M 42790.0 e ! total-2D4244 HA 79 PHE HN 4.30 # 2 18430.0 e total-2D2491 HA 80 ARG HN 6.00 # w 3 1494.0 e total-2D7099 HB2 78 LEU HG 4.70 ># 1 8363.0 e total-2D4239 HB2 78 LEU QD1 3.80 # 1M 45040.0 e total-2D4229 HB2 78 LEU QD2 5.20 # 1M 6770.0 e total-2D4228 HB3 78 LEU HG 4.00 <# 1 24800.0 e total-2D4238 HB3 78 LEU QD1 4.00 # 1M 33450.0 e total-2D4242 HB3 78 LEU QD2 6.40 # 1M 1969.0 e total-2D4227 HB3 79 PHE HN 4.70 # 2 11150.0 e total-2D2887 HG 78 LEU QD1 5.20 # 1M 6931.0 e total-2D4241 HG 78 LEU QD2 5.80 # 1M 3748.0 e total-2D4236 HG 79 PHE HN 6.00 # 5 13110.0 e total-2D3453 HG 80 ARG HN 6.00 # w 5 4560.0 e total-2D7781 HG 80 ARG HA 6.00 # w 5 2312.0 e total-2D7782 HG 80 ARG HB2 6.00 # w 5 1204.0 e total-2D7783 HG 80 ARG HG3 6.00 # w 5 4136.0 e total-2D7784 QD1 79 PHE HN 7.00 # w 5M 4039.0 e total-2D7068 QD1 80 ARG HB3 7.00 # w 5M 4050.0 e total-2D7785 QD2 79 PHE HN 6.50 # 5M 7248.0 e total-2D2885 QD2 79 PHE CG 9.00 # r w 5M 1671.0*2e total-2D6762 QD2 80 ARG HD2 6.50 # 5M 7510.0 e total-2D8520 79 PHE HN 79 PHE HA 3.60 # 2 55280.0 e total-2D 703 HN 79 PHE HB2 4.00 # 2 26460.0 e total-2D1912 HN 79 PHE HB3 3.80 # 2 35800.0 e total-2D1107 HN 79 PHE CG 7.30 # r 1 4151.5*2e total-2D8071 HN 80 ARG HN 3.50 # 2 67660.0 e total-2D3700 HN 80 ARG HD3 6.00 # w 5 0.0 e ! total-2D3547 HA 79 PHE HB2 4.60 # 2 11740.0 e total-2D4250 HA 79 PHE HB3 4.60 # 2 11550.0 e total-2D4252 HA 79 PHE CG 7.00 # m w 1 1240.5*2e total-2D6108 HA 80 ARG HN 3.60 # 2 54610.0 e total-2D2492 HA 85 ILE QG2 7.00 # w 5M 4691.0 e total-2D7714 HA 104 ALA QB 7.00 # w 5M 2323.0 e total-2D6858 HB2 79 PHE CG 6.80 # r 1 7270.0*2e total-2D6111 HB2 80 ARG HN 6.00 # w 2 1988.0 e total-2D3284 HB2 85 ILE QG2 7.00 # w 5M 1586.0 e total-2D7716 HB2 102 VAL QG1 7.00 # w 5M 1591.0 e total-2D7715 HB3 79 PHE CG 6.90 # r 1 6995.0*2e total-2D6114 HB3 80 ARG HN 5.80 # 2 2867.0 e total-2D3546 CG 79 PHE CZ 7.20 # rr 1 87275.0*4e total-2D6100 CG 79 PHE HZ 5.60 # r 1 43190.0*2e total-2D6102 CG 80 ARG HN 8.00 # r w 5 1178.5*2e total-2D7713 CG 85 ILE HG13 8.00 # r w 5 560.5*2e total-2D6497 CG 85 ILE QD1 7.70 # r 5M 13700.0*2e total-2D6118 CG 102 VAL QG1 8.90 <# r 5M 5420.0*2e total-2D6761 CG 102 VAL QG2 9.00 ># r w 5M 2068.5*2e total-2D7973 CZ 79 PHE HZ 6.00 # r 1 24865.0*2e total-2D6270 CZ 85 ILE QG2 9.00 # r w 5M 1316.0*2e total-2D7708 CZ 85 ILE HG13 8.00 # r w 5 613.5*2e total-2D6496 CZ 85 ILE QD1 9.00 # r w 5M 1970.5*2e total-2D6135 CZ 102 VAL QG1 9.00 # r w 5M 2093.5*2e total-2D7707 HZ 85 ILE HG13 6.00 # w 5 2199.0 e total-2D8103 80 ARG HN 80 ARG HA 4.10 # 2 23420.0 e total-2D 91 HN 80 ARG HB2 4.20 # 2 22190.0 e total-2D1109 HN 80 ARG HB3 4.30 # 2 18140.0 e total-2D1110 HN 80 ARG HG2 4.50 # 1 11290.0 e total-2D1264 HN 80 ARG HG3 4.40 # 1 12470.0 e total-2D1263 HN 80 ARG HD2 6.00 # w 1 0.0 e total-2D1266 HN 80 ARG HD3 6.00 # w 1 0.0 e total-2D1265 HN 81 GLU HN 6.00 # w 2 1859.0 e total-2D7138 HA 80 ARG HB2 4.50 # 2 13990.0 e total-2D5095 HA 80 ARG HB3 4.20 # 2 20610.0 e total-2D4277 HA 80 ARG HG2 4.50 # 1 11950.0 e total-2D5096 HA 80 ARG HG3 4.80 # 1 7280.0 e total-2D5097 HA 80 ARG HD2 4.90 <# 1 6739.0 e total-2D5100 HA 80 ARG HD3 6.00 ># w 1 535.0 e total-2D5099 HA 81 GLU HN 3.40 # 2 71560.0 e total-2D2499 HB2 80 ARG HG2 3.30 # 1 70650.0 e total-2D4281 HB2 80 ARG HG3 3.90 # 1 28460.0 e total-2D4263 HB2 80 ARG HD2 4.50 # 1 11150.0 e total-2D4294 HB2 80 ARG HD3 4.60 # 1 9627.0 e total-2D4274 HB2 81 GLU HN 4.70 # 2 10460.0 e total-2D2896 HB3 80 ARG HG2 4.20 # 1 17660.0 e total-2D4271 HB3 80 ARG HG3 3.70 # 1 40570.0 e total-2D4282 HB3 80 ARG HD2 4.60 # 1 10290.0 e total-2D4291 HB3 80 ARG HD3 4.20 # 1 17210.0 e total-2D4298 HB3 81 GLU HN 4.90 # 2 8624.0 e total-2D2837 HB3 83 GLN HN 6.00 # w 3 3154.0 e ! total-2D6919 HB3 83 GLN QG 7.00 # m w 5 2459.0*2e total-2D7170 HB3 83 GLN HE21 6.00 # w 5 1041.0 e total-2D8422 HB3 83 GLN HE22 6.00 # w 5 721.0 e total-2D8419 HG2 80 ARG HD2 4.20 # 1 16720.0 e total-2D4293 HG2 80 ARG HD3 4.10 # 1 20160.0 e total-2D4285 HG2 81 GLU HN 6.00 # 5 12490.0 e total-2D2836 HG2 83 GLN HE22 6.00 # w 5 983.0 e total-2D8421 HG3 80 ARG HD2 3.80 # 1 31400.0 e total-2D4292 HG3 80 ARG HD3 4.30 # 1 16140.0 e total-2D4288 HG3 81 GLU HN 6.00 # w 5 10930.0 e total-2D2899 HG3 83 GLN HE21 6.00 # w 5 3390.0 e total-2D5738 HG3 83 GLN HE22 6.00 # w 5 612.0 e total-2D8420 81 GLU HN 81 GLU HA 3.80 # 2 40910.0 e total-2D 462 HN 81 GLU HB2 4.30 # 2 19210.0 e total-2D1267 HN 81 GLU HB3 3.90 # 2 33400.0 e total-2D1111 HN 81 GLU HG2 3.70 <# 1 37480.0 e total-2D1269 HN 81 GLU HG3 4.80 ># 1 7956.0 e total-2D1268 HN 82 GLY HN 5.90 # 2 2699.0 e total-2D2305 HA 81 GLU HB2 3.60 # 2 50200.0 e total-2D4306 HA 81 GLU HB3 3.30 # 2 89090.0 e total-2D4305 HA 81 GLU HG2 5.10 # 1 5380.0 e total-2D4321 HA 81 GLU HG3 4.60 # 1 10500.0 e total-2D4304 HA 82 GLY HN 3.30 # 2 93080.0 e total-2D2494 HA 83 GLN HN 5.30 # 3 10410.0 e total-2D5675 HB2 81 GLU HG2 3.80 # 1 31310.0 e total-2D4315 HB2 81 GLU HG3 4.80 # 1 7483.0 e total-2D4309 HB2 82 GLY HN 4.60 # 2 11900.0 e total-2D2907 HB2 83 GLN HN 6.00 # w 3 1572.0 e total-2D6920 HB3 81 GLU HG2 3.60 # 1 46150.0 e total-2D4316 HB3 81 GLU HG3 4.70 # 1 8645.0 e total-2D4310 HB3 82 GLY HN 4.10 # 2 25020.0 e total-2D2908 HG3 82 GLY HN 5.90 # 5 13930.0 e total-2D2905 82 GLY HN 82 GLY HA1 3.30 <# 2 84030.0 e total-2D 373 HN 82 GLY HA2 4.00 ># 2 29430.0 e total-2D 351 HN 83 GLN HN 3.70 # 2 46610.0 e total-2D1953 HA1 83 GLN HN 4.40 # 2 16540.0 e total-2D2495 HA2 83 GLN HN 4.80 # 2 8851.0 e total-2D2496 83 GLN HN 83 GLN HA 3.70 # 2 43140.0 e total-2D 555 HN 83 GLN HB2 3.90 # 2 31270.0 e total-2D5669 HN 83 GLN HB3 4.00 # 2 29400.0 e total-2D1113 HN 83 GLN QG 5.50 # m 1 11595.0*2e total-2D1270 HN 83 GLN HE21 4.60 <# 1 9978.0 e total-2D2284 HN 83 GLN HE22 6.00 ># 1 2022.0 e total-2D2283 HN 84 GLY HN 5.90 # 2 2670.0 e total-2D1959 HN 106 HIS HB2 6.00 # w 5 3008.0 e ! total-2D5676 HA 83 GLN HB2 4.00 # 2 28230.0 e total-2D6180 HA 83 GLN HB3 4.40 # 2 15440.0 e total-2D4334 HA 83 GLN QG 6.20 # i 1 2977.0*2e total-2D4337 HA 84 GLY HN 3.60 # 2 57520.0 e total-2D2497 HB2 83 GLN QG 5.00 ># m 1 23915.0*2e total-2D4336 HB2 83 GLN HE21 4.40 # 1 13880.0 e total-2D5651 HB2 83 GLN HE22 5.60 # 1 3122.0 e total-2D6182 HB2 84 GLY HN 3.90 # 2 30590.0 e total-2D5685 HB3 83 GLN QG 4.40 <# m 1 61850.0*2e total-2D4335 HB3 83 GLN HE21 5.90 # 1 2304.0 e total-2D5740 HB3 84 GLY HN 4.50 # 2 13480.0 e total-2D2936 QG 83 GLN HE21 5.70 <# m 1 9075.0*2e total-2D5652 QG 83 GLN HE22 7.00 ># m w 1 1884.0*2e total-2D6181 QG 84 GLY HN 7.00 # m w 5 3786.0*2e total-2D2938 QG 85 ILE QD1 8.00 # m w 5M 1956.0*2e total-2D7620 HE21 84 GLY HN 6.00 # w 5 583.0 e total-2D8423 HE22 104 ALA QB 7.00 # w 5M 1381.0 e total-2D6764 84 GLY HN 84 GLY HA1 3.80 # 2 36500.0 e total-2D 388 HN 84 GLY HA2 3.30 # 2 90180.0 e total-2D 705 HN 85 ILE HN 4.60 # 2 11460.0 e total-2D1965 HA1 85 ILE HN 3.50 # 2 66150.0 e total-2D2500 HA1 85 ILE QG2 7.00 # w 5M 3590.0 e total-2D7621 HA2 85 ILE HN 3.70 # 2 45270.0 e total-2D2501 85 ILE HN 85 ILE HA 4.40 # 2 15760.0 e total-2D 511 HN 85 ILE HB 5.00 # 2 7508.0 e total-2D1114 HN 85 ILE QG2 4.70 # 1M 12770.0 e total-2D1274 HN 85 ILE HG12 3.90 # 1 27110.0 e total-2D1271 HN 85 ILE HG13 4.50 # 1 11610.0 e total-2D1272 HN 85 ILE QD1 5.40 # 1M 5574.0 e total-2D1273 HN 86 VAL HN 5.50 # 2 4210.0 e total-2D2503 HA 85 ILE HB 3.40 # 2 72710.0 e total-2D4349 HA 85 ILE QG2 3.70 # 1M 54620.0 e total-2D4369 HA 85 ILE HG12 4.30 # 1 15580.0 e total-2D4354 HA 85 ILE HG13 4.70 # 1 8782.0 e total-2D4342 HA 85 ILE QD1 4.70 # 1M 12360.0 e total-2D4341 HA 86 VAL HN 3.30 # 2 91270.0 e total-2D3717 HA 102 VAL HB 6.00 # w 5 1648.0 e total-2D5819 HA 103 LEU HN 6.00 # w 4 833.0 e total-2D6534 HA 104 ALA HA 3.40 # 4 41540.0 e total-2D4970 HA 104 ALA QB 7.00 # w 5M 1350.0 e total-2D8425 HA 105 LYS HN 4.20 # 4 11220.0 e total-2D3362 HB 85 ILE QG2 4.30 # 1M 20580.0 e total-2D4348 HB 85 ILE HG12 4.80 # 1 8083.0 e total-2D4353 HB 85 ILE HG13 4.90 # 1 6950.0 e total-2D4358 HB 85 ILE QD1 4.60 # 1M 14400.0 e total-2D4363 HB 86 VAL HN 3.50 # 2 65530.0 e total-2D2943 HB 103 LEU HN 6.00 # w 5 3186.0 e total-2D7929 HB 104 ALA HA 6.00 # w 5 1170.0 e total-2D8426 HB 104 ALA QB 7.00 # w 5M 4061.0 e total-2D8427 QG2 85 ILE HG12 3.60 # 1M 61290.0 e total-2D4350 QG2 85 ILE HG13 4.20 # 1M 24770.0 e total-2D4366 QG2 85 ILE QD1 5.00 # m 1M 36330.0 e total-2D4365 QG2 86 VAL HN 5.50 # 5M 16910.0 e total-2D2939 QG2 104 ALA HA 5.70 # 5M 13960.0 e total-2D4973 QG2 104 ALA QB 6.20 # m 5M 21570.0 e total-2D5218 QG2 105 LYS HN 7.00 # w 5M 2820.0 e total-2D3074 HG12 85 ILE QD1 4.50 ># 1M 16700.0 e total-2D4362 HG12 86 VAL HN 5.00 <# 5 41110.0 e total-2D2940 HG13 85 ILE QD1 3.80 <# 1M 50290.0 e total-2D4361 HG13 86 VAL HN 5.80 ># 5 16320.0 e total-2D3423 QD1 86 VAL HN 5.10 # 5M 23730.0 e total-2D2942 QD1 87 ALA HN 7.00 # w 5M 3020.0 e total-2D7913 QD1 87 ALA QB 6.20 # m 5M 23120.0 e total-2D8433 QD1 102 VAL QG2 7.10 # m 5M 10380.0 e total-2D6867 QD1 104 ALA HA 7.00 # w 5M 4340.0 e total-2D5224 QD1 104 ALA QB 6.50 # m 5M 17020.0 e total-2D5222 86 VAL HN 86 VAL HA 4.10 # 2 23520.0 e total-2D 485 HN 86 VAL HB 4.50 # 2 14040.0 e total-2D1115 HN 86 VAL QG1 5.00 # 1M 8298.0 e total-2D1275 HN 86 VAL QG2 5.00 # 1M 9314.0 e total-2D1276 HN 87 ALA HN 5.40 # 2 4694.0 e total-2D5687 HN 103 LEU HN 3.40 # 4 39460.0 e total-2D1972 HN 103 LEU HB2 5.50 # 5 22490.0 e total-2D2941 HN 104 ALA HA 3.80 # 4 19400.0 e total-2D2233 HN 104 ALA QB 7.00 # w 5M 3297.0 e total-2D3364 HN 105 LYS HN 5.60 # 4 1991.0 e total-2D6904 HN 105 LYS QG 7.00 # m w 5 0.0*2e total-2D3363 HA 86 VAL HB 4.40 # 2 14940.0 e total-2D5008 HA 86 VAL QG1 3.80 # 1M 50080.0 e total-2D4378 HA 86 VAL QG2 4.20 # 1M 27130.0 e total-2D6183 HA 87 ALA HN 3.10 # 2 133300.0 e total-2D2504 HB 86 VAL QG1 3.80 # 1M 43600.0 e total-2D5007 HB 86 VAL QG2 3.70 # 1M 58050.0 e total-2D5006 HB 87 ALA HN 4.30 # 2 18620.0 e total-2D3512 HB 103 LEU HN 6.00 # w 5 960.0 e total-2D6533 QG1 87 ALA HN 6.10 ># 5M 10080.0 e total-2D3526 QG1 105 LYS QE 8.00 # m w 5M 2263.0*2e total-2D8429 QG2 87 ALA HN 5.00 <# 5M 26470.0 e total-2D2946 QG2 103 LEU HN 7.00 # w 5M 1783.0 e total-2D8428 QG2 103 LEU HB3 5.60 # 5M 16060.0 e total-2D8523 QG2 103 LEU QD2 7.90 # m 5M 5423.0 e total-2D8521 QG2 105 LYS QD 6.60 # m 5M 15655.0*2e total-2D8524 QG2 105 LYS QE 8.00 # m w 5M 1499.5*2e total-2D8430 87 ALA HN 87 ALA HA 4.00 # 2 27670.0 e total-2D 78 HN 87 ALA QB 3.40 # s 2M 56410.0 e total-2D1116 HN 88 GLN HN 6.00 # w 2 740.0 e total-2D2507 HA 87 ALA QB 3.40 # s 2M 98470.0 e total-2D4383 HA 88 GLN HN 3.20 # 2 100400.0 e total-2D2506 HA 102 VAL HA 3.10 # 4 68920.0 e total-2D4967 HA 102 VAL QG1 7.00 ># w 5M 1110.0 e total-2D6872 HA 102 VAL QG2 7.00 <# 5M 5014.0 e total-2D5820 HA 103 LEU HN 3.50 # 4 33630.0 e total-2D2232 QB 88 GLN HN 4.00 # 2M 14060.0 e total-2D2951 QB 99 ALA QB 6.60 # m 5M 16180.0 e total-2D8431 QB 101 GLU HN 7.00 # w 5M 2250.0 e total-2D6392 QB 102 VAL HA 6.70 # 5M 6426.0 e total-2D4993 QB 102 VAL HB 4.70 # 5M 36770.0 e total-2D6725 QB 102 VAL QG1 5.80 # m 5M 33740.0 e total-2D7625 QB 102 VAL QG2 6.40 # m 5M 18220.0 e total-2D4991 QB 103 LEU QD2 6.20 # m 5M 23120.0 e total-2D7624 88 GLN HN 88 GLN HA 3.90 # 2 31820.0 e total-2D 481 HN 88 GLN HB2 4.10 # 2 22630.0 e total-2D1278 HN 88 GLN HB3 3.90 # 2 33220.0 e total-2D1118 HN 88 GLN HG2 6.00 # w 1 1168.0 e total-2D1117 HN 88 GLN HG3 6.00 # w 1 707.0 e total-2D1277 HN 88 GLN HE21 6.00 # w 1 0.0 - total-2D2281 HN 99 ALA QB 7.00 # w 5M 3937.0 e total-2D2953 HN 100 THR HN 6.00 # w 4 979.0 e total-2D6746 HN 101 GLU HN 3.40 # 4 36100.0 e total-2D2210 HN 101 GLU HB2 6.00 # w 5 4953.0 e total-2D7626 HN 101 GLU HB3 6.00 # w 5 2972.0 e total-2D7627 HN 102 VAL HA 3.60 # 4 26080.0 e total-2D2229 HA 88 GLN HB2 4.20 # 2 21680.0 e total-2D4384 HA 88 GLN HB3 4.10 # 2 25340.0 e total-2D4394 HA 88 GLN HG2 4.30 # 1 15810.0 e total-2D4402 HA 88 GLN HG3 4.40 # 1 12560.0 e total-2D4403 HA 89 GLY HN 3.20 # 2 104900.0 e total-2D2508 HB2 88 GLN HG2 4.20 # 1 17000.0 e total-2D4396 HB2 88 GLN HG3 4.40 # 1 12290.0 e total-2D4391 HB2 88 GLN HE21 4.60 # 1 9516.0 e total-2D2957 HB2 88 GLN HE22 4.50 # 1 11050.0 e total-2D5728 HB2 89 GLY HN 4.50 # 2 14240.0 e total-2D2962 HB2 101 GLU HN 6.00 # w 5 5134.0 e total-2D7629 HB3 88 GLN HG2 3.90 # 1 26860.0 e total-2D4399 HB3 88 GLN HG3 3.40 # 1 61900.0 e total-2D4390 HB3 88 GLN HE21 4.60 # 1 9517.0 e total-2D2955 HB3 88 GLN HE22 4.60 # 1 10380.0 e total-2D5727 HB3 89 GLY HN 5.00 # 2 7541.0 e total-2D5684 HB3 100 THR HN 6.00 # w 5 877.0 e total-2D6744 HB3 101 GLU HN 6.00 # w 5 2374.0 e total-2D7628 HG2 88 GLN HE21 3.90 # 1 25710.0 e total-2D2956 HG2 88 GLN HE22 5.10 # 1 5343.0 e total-2D5726 HG2 89 GLY HN 5.90 # 5 13940.0 e total-2D2963 HG3 88 GLN HE21 4.70 # 1 8510.0 e total-2D2954 HG3 88 GLN HE22 5.40 # 1 3947.0 e total-2D6184 HG3 89 GLY HN 5.80 # 5 16610.0 e total-2D3528 HE21 101 GLU HB2 6.00 # w 5 6194.0 e total-2D7631 HE21 101 GLU HG2 6.00 # w 5 3635.0 e total-2D7633 HE21 101 GLU HG3 6.00 # w 5 6032.0 e total-2D7632 HE22 101 GLU HN 6.00 # w 5 4272.0 e total-2D7638 HE22 101 GLU HB2 6.00 # w 5 4114.0 e total-2D7634 HE22 101 GLU HB3 6.00 # w 5 3755.0 e total-2D7636 HE22 101 GLU HG2 6.00 # w 5 1393.0 e total-2D7637 HE22 101 GLU HG3 6.00 # w 5 1829.0 e total-2D7635 89 GLY HN 89 GLY HA1 3.80 # 2 40030.0 e total-2D 394 HN 89 GLY HA2 3.90 # 2 31610.0 e total-2D 575 HN 90 VAL HN 4.40 # 2 16690.0 e total-2D1486 HN 97 LEU QD1 6.90 # 5M 5616.0 e ! total-2D6532 HA1 90 VAL HN 3.80 # 2 41440.0 e total-2D2511 HA1 91 LEU QD2 7.00 # w 5M 4175.0 e ! total-2D6950 HA1 99 ALA HA 4.60 # 4 6581.0 e total-2D8436 HA1 99 ALA QB 7.00 # w 5M 1973.0 e total-2D5093 HA1 100 THR HN 3.80 <# 4 20750.0 e ! total-2D5805 HA2 90 VAL HN 3.40 # 2 75440.0 e total-2D2510 HA2 91 LEU QD2 7.00 # w 5M 4691.0 e ! total-2D6949 HA2 99 ALA HA 4.40 # 4 7745.0 e total-2D8435 HA2 99 ALA QB 7.00 # w 5M 1957.0 e total-2D7124 HA2 100 THR HN 4.70 ># 4 5571.0 e total-2D8434 90 VAL HN 90 VAL HA 3.80 # 2 37210.0 e total-2D 708 HN 90 VAL HB 3.70 # 2 43580.0 e total-2D1119 HN 90 VAL QG1 4.00 <# 1M 34580.0 e total-2D1120 HN 90 VAL QG2 5.30 ># 1M 6109.0 e total-2D1279 HN 91 LEU HN 4.70 # 2 10490.0 e total-2D2004 HN 91 LEU QD2 7.00 # w 5M 4794.0 e total-2D7116 HN 97 LEU QD1 7.00 # w 5M 1582.0 e ! total-2D5721 HN 98 ALA HN 3.50 # 4 31870.0 e total-2D3711 HN 99 ALA HA 3.60 # 4 27870.0 e total-2D7034 HN 99 ALA QB 5.30 # 5M 19900.0 e total-2D5666 HN 100 THR QG2 7.00 # w 5M 1532.0 e ! total-2D8531 HA 90 VAL HB 4.40 # 2 15040.0 e total-2D4411 HA 90 VAL QG1 4.80 # 1M 11980.0 e total-2D4414 HA 90 VAL QG2 4.60 # 1M 14860.0 e total-2D5088 HA 91 LEU HN 3.10 # 2 125400.0 e total-2D2512 HB 90 VAL QG1 4.00 # 1M 35400.0 e total-2D4410 HB 90 VAL QG2 4.10 # 1M 29550.0 e total-2D4416 HB 91 LEU HN 4.70 # 2 10940.0 e total-2D5970 QG1 91 LEU HN 6.10 ># 5M 10370.0 e total-2D2972 QG1 98 ALA QB 7.20 # m 5M 9112.0 e total-2D8437 QG2 91 LEU HN 4.70 <# 5M 35910.0 e total-2D2971 QG2 98 ALA HN 6.80 # 5M 5690.0 e total-2D3312 91 LEU HN 91 LEU HA 3.60 # 2 56360.0 e total-2D 53 HN 91 LEU HB2 3.50 <# 2 61970.0 e total-2D1121 HN 91 LEU HB3 4.20 ># 2 21350.0 e total-2D1122 HN 91 LEU HG 4.90 # 1 6910.0 e total-2D1280 HN 91 LEU QD1 5.60 # 1M 4268.0 e total-2D1281 HN 91 LEU QD2 4.90 # 1M 9798.0 e total-2D1283 HN 92 GLY HN 4.90 # 2 8628.0 e total-2D2009 HA 91 LEU HB2 4.40 # 2 16980.0 e total-2D5238 HA 91 LEU HB3 4.30 # 2 18020.0 e total-2D5236 HA 91 LEU HG 4.30 # 1 15710.0 e total-2D5237 HA 91 LEU QD1 4.60 # 1M 14930.0 e total-2D4442 HA 91 LEU QD2 4.30 # 1M 20620.0 e total-2D4447 HA 92 GLY HN 3.20 # 2 117400.0 e total-2D3724 HA 97 LEU HA 3.20 # 4 56330.0 e total-2D5500 HA 97 LEU QD1 6.30 # 5M 8668.0 e total-2D7644 HA 97 LEU QD2 6.70 # 5M 6363.0 e total-2D7645 HA 98 ALA HN 3.20 # 4 56060.0 e total-2D3529 HB2 91 LEU HG 4.50 ># 1 10800.0 e total-2D5245 HB2 91 LEU QD1 4.00 # 1M 32610.0 e total-2D4441 HB2 91 LEU QD2 3.90 # 1M 41110.0 e total-2D5242 HB2 92 GLY HN 5.20 ># 2 5458.0 e total-2D3722 HB2 97 LEU QD2 6.80 # 5M 6009.0 e total-2D7640 HB2 98 ALA HN 5.80 # 5 15730.0 e total-2D2992 HB3 91 LEU HG 3.40 <# 1 67060.0 e total-2D4435 HB3 91 LEU QD1 4.40 # 1M 20070.0 e total-2D5249 HB3 91 LEU QD2 4.50 # 1M 17350.0 e total-2D4444 HB3 92 GLY HN 4.20 <# 2 20150.0 e total-2D3720 HG 91 LEU QD1 3.70 # 1M 58560.0 e total-2D4440 HG 91 LEU QD2 3.40 # 1M 96460.0 e total-2D4445 HG 92 GLY HN 5.70 # 5 17800.0 e total-2D3721 QD1 92 GLY HN 5.30 # 5M 20600.0 e total-2D3719 QD1 93 GLU HN 7.00 # w 5M 1697.0 e total-2D6531 QD1 95 GLY HN 6.90 # 5M 5554.0 e total-2D5746 QD1 96 LYS HN 7.00 # w 5M 1217.0 e total-2D5795 QD1 97 LEU HA 7.00 ># w 5M 4215.0 e total-2D7643 QD1 97 LEU HB2 7.00 # w 5M 3658.0 e total-2D7641 QD1 97 LEU HG 5.60 # 5M 15770.0 e total-2D7647 QD1 98 ALA HN 7.00 ># w 5M 2932.0 e total-2D7328 QD2 92 GLY HN 6.30 # 5M 8487.0 e total-2D3718 QD2 97 LEU HA 6.00 <# 5M 10950.0 e total-2D6874 QD2 97 LEU HB2 7.00 # w 5M 2192.0 e total-2D7642 QD2 97 LEU HG 5.50 # 5M 16410.0 e total-2D7646 QD2 97 LEU QD2 7.00 # m 5M 10960.0 e total-2D8526 QD2 98 ALA HN 6.40 <# 5M 7771.0 e total-2D5705 92 GLY HN 92 GLY HA1 3.70 # 2 46380.0 e total-2D3726 HN 92 GLY HA2 3.50 # 2 67760.0 e total-2D3723 HN 93 GLU HN 4.20 # 2 20620.0 e total-2D7139 HN 94 ASP HN 6.00 # w 3 1016.0 e total-2D8542 HN 95 GLY HN 6.00 # w 3 777.0 e total-2D6997 HN 96 LYS HN 4.70 # 3 22960.0 e total-2D2054 HN 97 LEU HA 3.40 # 4 36580.0 e total-2D3725 HN 97 LEU HB3 6.00 # w 5 4597.0 e total-2D7649 HN 97 LEU QD2 6.00 # 5M 11310.0 e total-2D7049 HN 98 ALA HN 5.20 # 4 3120.0 e total-2D5693 HA1 93 GLU HN 4.60 # 2 12760.0 e total-2D2516 HA1 98 ALA QB 7.00 ># 5M 4865.0 e total-2D8442 HA2 93 GLU HN 4.30 # 2 18490.0 e total-2D2515 HA2 94 ASP HA 5.30 # 3 10440.0 e ! total-2D7236 HA2 98 ALA QB 5.80 <# 5M 13120.0 e total-2D8441 93 GLU HN 93 GLU HA 4.40 # 2 16430.0 e total-2D 451 HN 93 GLU HB2 6.00 ># w 2 1239.0 e total-2D1285 HN 93 GLU HB3 5.40 <# 2 4590.0 e total-2D1284 HN 93 GLU QG 6.80 # m 1 2571.0*2e total-2D1286 HN 94 ASP HN 5.30 # 2 4845.0 e total-2D5992 HN 97 LEU QD1 7.00 # w 5M 1988.0 e ! total-2D5736 HA 93 GLU HB2 3.20 # 2 101900.0 e total-2D4457 HA 93 GLU HB3 3.70 # 2 48980.0 e total-2D4452 HA 93 GLU QG 4.80 # i 1 17930.0*2e total-2D4461 HA 94 ASP HN 3.70 # 2 42470.0 e total-2D2517 HB2 93 GLU QG 4.70 # m 1 38265.0*2e total-2D4460 HB2 94 ASP HN 4.60 # 2 12110.0 e total-2D2983 HB2 96 LYS HB2 4.80 # 5 52710.0 e total-2D7457 HB2 96 LYS HB3 5.20 # 5 32970.0 e total-2D7455 HB3 93 GLU QG 4.30 # m 1 69250.0*2e total-2D4459 HB3 94 ASP HN 4.50 # 2 13640.0 e total-2D2982 HB3 96 LYS HB2 5.00 # 5 40440.0 e total-2D7456 HB3 96 LYS HB3 5.30 # 5 27650.0 e total-2D7454 QG 94 ASP HN 7.00 # m w 5 6170.0*2e total-2D2984 94 ASP HN 94 ASP HA 3.90 # 2 34840.0 e total-2D 711 HN 94 ASP HB2 4.60 # 2 12570.0 e total-2D1123 HN 95 GLY HN 3.40 # 2 79040.0 e total-2D2041 HN 95 GLY HA1 5.90 # 2 2728.0 e total-2D6988 HN 95 GLY HA2 6.00 # w 2 1997.0 e total-2D3064 HN 96 LYS HN 5.10 # 3 12650.0 e total-2D5697 HA 94 ASP HB2 3.40 # 2 71050.0 e total-2D4463 HA 95 GLY HN 5.10 # 2 6724.0 e total-2D2518 HB2 95 GLY HN 5.60 # 2 3843.0 e total-2D6702 95 GLY HN 95 GLY HA1 3.80 # 2 35910.0 e total-2D 650 HN 95 GLY HA2 3.40 # 2 75870.0 e total-2D 700 HN 96 LYS HN 3.30 # 2 88290.0 e total-2D2051 HN 96 LYS QG 7.00 # m w 5 1905.5*2e total-2D3414 HN 97 LEU QD2 7.00 # w 5M 614.0 e total-2D6991 HA1 96 LYS HN 4.40 # 2 16240.0 e total-2D2520 HA1 97 LEU QD1 7.00 # w 5M 2058.0 e total-2D6999 HA2 96 LYS HN 4.10 # 2 23220.0 e total-2D2519 HA2 97 LEU QD1 7.00 # w 5M 2911.0 e total-2D7000 96 LYS HN 96 LYS HA 4.20 # 2 21120.0 e total-2D 604 HN 96 LYS HB2 3.80 # 2 40860.0 e total-2D1125 HN 96 LYS HB3 4.00 # 2 28080.0 e total-2D1126 HN 96 LYS QG 4.70 # m 1 40155.0*2e total-2D1287 HN 96 LYS HD2 5.40 # 1 3976.0 e total-2D1288 HN 96 LYS HD3 5.30 # 1 4127.0 e total-2D1289 HN 96 LYS HE2 5.40 # 1 3947.0 e total-2D1291 HN 96 LYS HE3 5.10 # 1 5074.0 e total-2D1290 HN 97 LEU HN 5.80 # 2 3006.0 e total-2D5841 HN 97 LEU QD1 7.00 # w 5M 2748.0 e total-2D7959 HA 96 LYS HB2 4.80 ># 2 8801.0 e total-2D4474 HA 96 LYS HB3 3.90 <# 2 35230.0 e total-2D4490 HA 96 LYS QG 5.60 # i 1 6205.0*2e total-2D4470 HA 96 LYS HD2 4.60 # 1 10170.0 e total-2D4509 HA 96 LYS HD3 4.30 # 1 14810.0 e total-2D4510 HA 96 LYS HE2 6.00 # w 1 0.0 e total-2D4476 HA 96 LYS HE3 5.30 # 1 4266.0 e total-2D5276 HA 97 LEU HN 3.30 # 2 84420.0 e total-2D2521 HB2 96 LYS QG 4.80 <# m 1 31980.0*2e total-2D4477 HB2 96 LYS HD2 4.10 # 1 21230.0 e total-2D4480 HB2 96 LYS HD3 3.70 # 1 34790.0 e total-2D4479 HB2 96 LYS HE2 6.00 # 1 2058.0 e total-2D5266 HB2 96 LYS HE3 6.00 # 1 1996.0 e total-2D5273 HB2 97 LEU HN 4.70 ># 2 10970.0 e total-2D2987 HB3 96 LYS QG 5.40 ># m 1 12300.0*2e total-2D4481 HB3 96 LYS HD2 4.40 # 1 13410.0 e total-2D4500 HB3 96 LYS HD3 4.10 # 1 21140.0 e total-2D4482 HB3 96 LYS HE2 5.70 # 1 2755.0 e total-2D5531 HB3 96 LYS HE3 6.00 # w 1 611.0 e total-2D5270 HB3 97 LEU HN 3.70 <# 2 42950.0 e total-2D2986 QG 96 LYS HD2 4.80 <# m 1 31435.0*2e total-2D4499 QG 96 LYS HD3 5.50 ># m 1 11440.0*2e total-2D4498 QG 96 LYS HE2 5.20 # m 1 18250.0*2e total-2D5262 QG 96 LYS HE3 4.80 # m 1 33885.0*2e total-2D5269 QG 97 LEU HN 7.00 # m w 5 11935.0*2e total-2D2985 QG 97 LEU QD1 5.80 # m 5M 32835.0*2e ! total-2D5392 HD2 96 LYS HE2 4.20 # 1 16520.0 e total-2D5265 HD2 96 LYS HE3 4.10 # 1 20330.0 e total-2D5272 HD2 97 LEU HN 6.00 ># w 5 4065.0 e total-2D6031 HD3 96 LYS HE2 5.50 # 1 3341.0 e total-2D5264 HD3 96 LYS HE3 5.00 # 1 5737.0 e total-2D5271 HD3 97 LEU HN 5.90 <# 5 14820.0 e total-2D6030 97 LEU HN 97 LEU HA 4.10 # 2 25950.0 e total-2D 108 HN 97 LEU HB2 4.20 # 2 21690.0 e total-2D1128 HN 97 LEU HB3 4.30 # 2 17190.0 e total-2D1127 HN 97 LEU HG 5.10 # 1 5578.0 e total-2D1292 HN 97 LEU QD1 5.70 # 1M 3800.0 e total-2D1295 HN 97 LEU QD2 5.60 # 1M 4243.0 e total-2D1293 HN 98 ALA HN 5.30 # 2 5216.0 e total-2D2087 HA 97 LEU HB2 5.10 # 2 6212.0 e total-2D4529 HA 97 LEU HB3 4.80 # 2 9639.0 e total-2D4527 HA 97 LEU HG 3.80 # 1 30870.0 e total-2D4544 HA 97 LEU QD1 4.40 # 1M 19270.0 e total-2D4549 HA 97 LEU QD2 4.30 # 1M 21430.0 e total-2D4554 HA 98 ALA HN 3.10 # 2 141600.0 e total-2D2522 HA 98 ALA QB 5.10 # 2M 3353.0 e total-2D5568 HB2 97 LEU HG 3.70 <# 1 37340.0 e total-2D4533 HB2 97 LEU QD1 4.40 # 1M 18050.0 e total-2D4531 HB2 97 LEU QD2 4.00 # 1M 34710.0 e total-2D4530 HB2 98 ALA HN 6.00 # w 2 0.0 e total-2D3313 HB3 97 LEU HG 4.50 ># 1 11800.0 e total-2D4542 HB3 97 LEU QD1 5.10 # 1M 7611.0 e total-2D4536 HB3 97 LEU QD2 3.80 # 1M 47000.0 e total-2D4551 HB3 98 ALA HN 5.30 # 2 5190.0 e total-2D2990 HG 97 LEU QD1 3.50 # 1M 70280.0 e total-2D4541 HG 97 LEU QD2 3.90 # 1M 40980.0 e total-2D4552 HG 98 ALA HN 5.60 # 5 18940.0 e total-2D2991 QD1 98 ALA HN 7.00 ># w 5M 3177.0 e total-2D2989 QD1 98 ALA QB 7.50 # m 5M 7044.0 e ! total-2D6877 QD1 99 ALA HN 7.00 # w 5M 2229.0 e total-2D2997 QD2 98 ALA HN 6.10 <# 5M 10140.0 e total-2D2988 QD2 99 ALA QB 7.90 # m 5M 5527.0 e total-2D7619 98 ALA HN 98 ALA HA 3.90 # 2 35660.0 e total-2D2077 HN 98 ALA QB 3.40 # s 2M 89870.0 e total-2D2078 HN 99 ALA HN 5.00 # 2 7224.0 e total-2D5695 HA 98 ALA QB 3.40 # s 2M 51020.0 e total-2D4555 HA 99 ALA HN 3.20 # 2 102900.0 e total-2D2523 QB 99 ALA HN 5.00 # 2M 3641.0 e total-2D3484 99 ALA HN 99 ALA HA 4.10 # 2 26010.0 e total-2D 412 HN 99 ALA QB 3.40 # s 2M 82770.0 e total-2D1130 HN 100 THR HN 5.50 # 2 4318.0 e total-2D2525 HA 99 ALA QB 3.40 # s 2M 107000.0 e total-2D4558 HA 100 THR HN 3.40 # 2 71360.0 e total-2D3713 HA 101 GLU HN 4.70 # 3 22840.0 e total-2D8447 QB 100 THR HN 4.50 # 2M 7178.0 e total-2D3485 QB 100 THR HA 5.70 # 2M 1726.0 e total-2D8533 QB 101 GLU HN 4.70 # 3M 4470.0 e total-2D8446 100 THR HN 100 THR HA 3.80 # 2 36880.0 e total-2D2102 HN 100 THR HB 4.10 # 2 24120.0 e total-2D2103 HN 100 THR QG2 5.00 # 1M 8668.0 e total-2D2104 HN 100 THR HG1 6.00 # w 1 0.0 - total-2D6342 HN 101 GLU HN 3.30 # 2 92230.0 e total-2D2212 HA 100 THR HB 3.30 # 2 83300.0 e total-2D4560 HA 100 THR QG2 3.90 # 1M 39540.0 e total-2D4564 HA 100 THR HG1 6.00 # w 1 1445.0 e total-2D6347 HA 101 GLU HN 4.10 # 2 24090.0 e total-2D2526 HB 100 THR QG2 4.30 # 1M 22040.0 e total-2D4563 HB 101 GLU HN 5.00 # 2 7368.0 e total-2D3666 QG2 101 GLU HN 6.20 # 5M 9135.0 e total-2D2999 HG1 101 GLU HA 6.00 # w 5 1747.0 e total-2D7484 HG1 102 VAL QG2 7.00 # w 5M 1982.0 e total-2D8018 101 GLU HN 101 GLU HA 4.10 # 2 22800.0 e total-2D2116 HN 101 GLU HB2 5.10 ># 2 6344.0 e total-2D6185 HN 101 GLU HB3 3.80 <# 2 36170.0 e total-2D2115 HN 101 GLU HG2 5.40 ># 1 3815.0 e total-2D4586 HN 101 GLU HG3 4.40 <# 1 12630.0 e total-2D4587 HN 102 VAL HN 4.50 # 2 12980.0 e total-2D2129 HN 102 VAL QG2 7.00 # w 5M 2411.0 e total-2D5748 HA 101 GLU HB2 4.10 # 2 26200.0 e total-2D4575 HA 101 GLU HB3 3.90 # 2 33580.0 e total-2D4576 HA 101 GLU HG2 4.70 # 1 9283.0 e total-2D4584 HA 101 GLU HG3 5.20 # 1 4856.0 e total-2D4585 HA 102 VAL HN 3.40 # 2 82820.0 e total-2D2527 HA 102 VAL QG2 7.00 # w 5M 1042.0 e total-2D6833 HB2 101 GLU HG2 4.00 # 1 23130.0 e total-2D4579 HB2 101 GLU HG3 3.70 # 1 38450.0 e total-2D4580 HB2 102 VAL HN 4.60 # 2 11520.0 e total-2D3001 HB3 101 GLU HG2 4.10 # 1 20340.0 e total-2D4574 HB3 101 GLU HG3 4.20 # 1 17150.0 e total-2D4570 HB3 102 VAL HN 4.50 # 2 13770.0 e total-2D5972 HG2 102 VAL HN 5.90 <# 5 15030.0 e total-2D6416 HG3 102 VAL HN 6.00 ># w 5 2417.0 e total-2D3003 102 VAL HN 102 VAL HA 4.10 # 2 24200.0 e total-2D 728 HN 102 VAL HB 4.00 # 2 29080.0 e total-2D1133 HN 102 VAL QG1 5.00 ># 1M 8996.0 e total-2D1303 HN 102 VAL QG2 4.20 <# 1M 24280.0 e total-2D1304 HN 103 LEU HN 5.70 # 2 3447.0 e total-2D2058 HA 102 VAL HB 4.70 # 2 11050.0 e total-2D4966 HA 102 VAL QG1 3.90 # 1M 39880.0 e total-2D4596 HA 102 VAL QG2 4.00 # 1M 32370.0 e total-2D4600 HA 103 LEU HN 3.10 # 2 139500.0 e total-2D2528 HB 102 VAL QG1 3.80 ># 1M 45700.0 e total-2D4592 HB 102 VAL QG2 3.40 <# s 1M 183600.0 e total-2D4599 HB 103 LEU HN 4.90 # 2 8064.0 e total-2D8448 QG1 103 LEU HN 5.10 <# 5M 24950.0 e total-2D5622 QG2 103 LEU HN 6.40 ># 5M 8118.0 e total-2D3750 103 LEU HN 103 LEU HA 4.30 # 2 18440.0 e total-2D 731 HN 103 LEU HB2 4.00 # 2 30170.0 e total-2D1134 HN 103 LEU HB3 4.60 # 2 12340.0 e total-2D1135 HN 103 LEU HG 4.60 # 1 9861.0 e total-2D1305 HN 103 LEU QD1 4.80 # 1M 11570.0 e total-2D1306 HN 103 LEU QD2 5.00 # 1M 8947.0 e total-2D1307 HN 104 ALA HN 4.60 # 2 11550.0 e total-2D2142 HA 103 LEU HB2 5.10 ># 2 6748.0 e total-2D4605 HA 103 LEU HB3 3.60 <# 2 54940.0 e total-2D4615 HA 103 LEU HG 4.00 # 1 25060.0 e total-2D4620 HA 103 LEU QD1 4.60 # 1M 15380.0 e total-2D4630 HA 103 LEU QD2 5.00 # 1M 9266.0 e total-2D4625 HA 104 ALA HN 4.20 # 2 21820.0 e total-2D7141 HA 104 ALA QB 6.90 # 2M 515.0 e total-2D4982 HB2 103 LEU HG 4.40 # 1 13520.0 e total-2D4611 HB2 103 LEU QD1 4.50 # 1M 15930.0 e total-2D4629 HB2 103 LEU QD2 4.10 # 1M 30650.0 e total-2D4624 HB2 104 ALA HN 4.30 # 2 17720.0 e total-2D2944 HB3 103 LEU HG 4.20 # 1 16340.0 e total-2D4618 HB3 103 LEU QD1 6.20 # 1M 2350.0 e total-2D4609 HB3 103 LEU QD2 4.30 # 1M 22010.0 e total-2D4623 HB3 104 ALA HN 3.90 # 2 32730.0 e total-2D3008 HG 103 LEU QD1 4.30 # 1M 23010.0 e total-2D4627 HG 103 LEU QD2 3.90 # 1M 42390.0 e total-2D4622 HG 104 ALA HN 6.00 # w 5 11820.0 e total-2D3007 QD1 104 ALA HN 5.70 <# 5M 14220.0 e total-2D3006 QD2 104 ALA HN 7.00 ># w 5M 3527.0 e total-2D3005 QD2 105 LYS HN 7.00 # w 5M 3707.0 e total-2D3073 QD2 105 LYS QD 6.50 # m 5M 17020.0*2e ! total-2D8528 104 ALA HN 104 ALA HA 4.10 # 2 25260.0 e total-2D 123 HN 104 ALA QB 3.80 # 2M 19110.0 e total-2D1136 HN 105 LYS HN 4.70 # 2 11200.0 e total-2D2151 HA 104 ALA QB 3.40 # s 2M 93910.0 e total-2D4971 HA 105 LYS HN 3.30 # 2 90750.0 e total-2D2530 HA 105 LYS QG 6.20 # m 5 30130.0*2e total-2D5926 QB 105 LYS HN 4.50 # 2M 6877.0 e total-2D3072 QB 105 LYS HB2 7.00 # w 5M 2399.0 e total-2D4986 QB 106 HIS HN 4.90 # 3M 3161.0 e total-2D6811 105 LYS HN 105 LYS HA 4.20 # 2 22180.0 e total-2D 146 HN 105 LYS HB2 4.00 # 2 28640.0 e total-2D1137 HN 105 LYS HB3 4.10 # 2 23700.0 e total-2D1138 HN 105 LYS QG 6.30 # m 1 4241.5*2e total-2D1308 HN 105 LYS QD 5.10 # m 1 19995.0*2e total-2D1309 HN 105 LYS QE 7.00 # m w 1 0.0*2- total-2D1310 HA 105 LYS HB2 4.30 # 2 17430.0 e total-2D4633 HA 105 LYS HB3 4.70 # 2 10260.0 e total-2D4635 HA 105 LYS QG 5.30 # i 1 9030.0*2e total-2D4636 HA 105 LYS QD 5.60 # m 1 10130.0*2e total-2D4634 HA 105 LYS QE 7.00 # m w 1 1893.0*2e total-2D4637 HA 106 HIS HN 3.70 # 2 46160.0 e total-2D2531 HB2 105 LYS QG 4.80 # m 1 32080.0*2e total-2D4638 HB2 105 LYS QD 6.30 # m 1 4326.0*2e total-2D4655 HB2 105 LYS QE 7.00 ># m w 1 428.0*2e total-2D4661 HB3 105 LYS QG 4.40 # m 1 62900.0*2e total-2D4648 HB3 105 LYS QD 6.10 # m 1 5190.0*2e total-2D4642 HB3 105 LYS QE 7.00 <# m w 1 1672.5*2e total-2D4659 QG 105 LYS QD 6.50 # mm 1 11442.5*4e total-2D4649 QG 105 LYS QE 6.90 # mm 1 7097.5*4e total-2D4651 QD 105 LYS QE 6.50 # mm 1 10765.0*4e total-2D4660 QE 106 HIS HD2 7.00 # m w 5 8280.0*2e total-2D5645 106 HIS HN 106 HIS HA 6.00 # w 2 2022.0 e total-2D 836 HN 106 HIS HB2 6.00 # w 2 0.0 - total-2D1139 HN 106 HIS HB3 6.00 # w 2 0.0 - total-2D1140 HN 106 HIS HD2 6.00 # w 1 0.0 - total-2D2295 HN 107 ASP HN 4.20 # 2 21430.0 e total-2D7140 HA 106 HIS HB2 6.00 # w 2 0.0 e total-2D4663 HA 106 HIS HB3 6.00 # w 2 0.0 e total-2D4664 HA 107 ASP HN 4.10 # 2 24610.0 e total-2D3481 HB2 107 ASP HN 6.00 ># w 2 1452.0 e total-2D6200 HB3 106 HIS HD2 5.10 # 1 5449.0 e total-2D8529 HB3 107 ASP HN 4.70 <# 2 10100.0 e total-2D3482 107 ASP HN 107 ASP HA 4.00 # 2 26860.0 e total-2D 235 HN 108 GLU HN 4.30 # 2 18620.0 e total-2D5799 HA 108 GLU HN 3.90 # 2 32620.0 e total-2D2532 108 GLU HN 108 GLU HA 4.40 # 2 15680.0 e total-2D2163 HN 108 GLU HB2 3.80 # 2 36490.0 e total-2D2161 HN 108 GLU HB3 3.80 # 2 38850.0 e total-2D2162 HN 108 GLU QG 5.10 # m 1 20335.0*2e total-2D2160 HN 109 ASN HN 4.40 # 2 15430.0 e total-2D2172 HN 109 ASN HA 4.70 # 2 10170.0 e ! total-2D6701 HN 109 ASN HB3 5.00 # 2 7034.0 e ! total-2D7215 HA 108 GLU HB2 4.00 # 2 29380.0 e total-2D4680 HA 108 GLU HB3 3.80 # 2 36740.0 e total-2D4675 HA 108 GLU QG 5.40 # i 1 8155.0*2e total-2D4684 HA 109 ASN HN 3.60 # 2 57890.0 e total-2D2533 HB2 108 GLU QG 4.80 # m 1 33290.0*2e total-2D4682 HB2 109 ASN HN 5.10 <# 2 6654.0 e total-2D3459 HB3 108 GLU QG 4.60 # m 1 46165.0*2e total-2D4683 HB3 109 ASN HN 6.00 ># w 2 762.0 e total-2D8530 109 ASN HN 109 ASN HA 3.60 # 2 51440.0 e total-2D 916 HN 109 ASN HB2 4.40 # 2 16680.0 e total-2D1145 HN 109 ASN HB3 4.00 # 2 28780.0 e total-2D1146 HN 109 ASN HD21 4.90 # 1 6657.0 e total-2D5843 HN 109 ASN HD22 4.80 # 1 7987.0 e total-2D3019 HN 110 TYR HN 4.60 # 2 11980.0 e total-2D2184 HA 109 ASN HB2 4.00 # 2 27300.0 e total-2D4689 HA 109 ASN HB3 4.40 # 2 16080.0 e total-2D4690 HA 109 ASN HD21 6.00 # w 1 1002.0 e total-2D6187 HA 109 ASN HD22 6.00 # w 1 991.0 e total-2D6188 HA 110 TYR HN 3.80 # 2 38360.0 e total-2D2534 HB2 109 ASN HD21 5.00 # 1 6100.0 e total-2D5659 HB2 109 ASN HD22 5.20 # 1 4583.0 e total-2D6112 HB3 109 ASN HD21 4.00 # 1 25220.0 e total-2D3012 HB3 109 ASN HD22 5.00 # 1 5923.0 e total-2D6113 HD22 110 TYR HB2 6.00 # w 5 6378.0 e ! total-2D6109 110 TYR HN 110 TYR HA 4.30 # 2 17840.0 e total-2D 109 HN 110 TYR HB2 6.00 ># w 2 1530.0 e total-2D2201 HN 110 TYR HB3 3.80 <# 2 36680.0 e total-2D1147 HN 110 TYR CG 7.60 # r 1 3092.5*2e total-2D7008 HN 110 TYR CZ 7.00 # m w 1 632.5*2e total-2D5872 HA 110 TYR HB2 4.00 # 2 27250.0 e total-2D4695 HA 110 TYR HB3 4.30 # 2 19230.0 e total-2D4691 HA 110 TYR CG 6.40 # m 1 3985.5*2e total-2D7012 HA 110 TYR CZ 6.60 # i w 1 0.0*2e total-2D7014 HB2 110 TYR CG 6.50 # r 1 11505.0*2e total-2D7004 HB2 110 TYR CZ 8.00 # r w 1 1762.5*2e total-2D7005 HB3 110 TYR CG 6.60 # r 1 9930.0*2e total-2D7003 HB3 110 TYR CZ 7.90 # r 1 2279.5*2e total-2D7006 CG 110 TYR CZ 7.60 # rr 1 46800.0*4e total-2D7019
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