0 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,0,0,0,0,0|3,0,1]=4 1 B6R0.1 CCCC(=O)NC WXVL_AK00442SB0073 [0,0,0,0,0,0|3,0,1]=4 2 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,0,0,0,0,0|3,0,1]=4 3 B6R0.1 CCNC(=O)CC WXVL_AK00476SB0064 [0,0,0,0,0,0|3,0,1]=4 4 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,0,0,0,0,0|2,0,1]=4 5 B5R0.3 CCC(=O)NC WXVL_AK00442SB0064 [1,0,0,0,0,0|2,0,1]=4 6 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [1,0,0,0,0,0|2,0,1]=4 7 B5R0.3 CNC(=O)CO WXVL_AK00442SB2706 [1,0,0,0,0,0|2,0,1]=4 8 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,1,0,0,0,0|0,0,2]=3 9 B7R0.2 CCC(C)CC(=O)N WXVL_AK0084SB0353 [0,1,0,0,0,0|0,0,2]=3 10 B7R0.2 CCC(O)CC(=O)N WXVL_AK0084SB4092 [0,1,0,0,0,0|1,0,2]=4 11 B7R0.2 CCC(O)CC(=O)N WXVL_AK0084SB4092 [0,1,0,0,0,0|1,0,2]=4 12 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,1,0,0,0,0|0,0,2]=3 13 B7R0.2 CC[C@@H](C)CC(=O)N WXVL_AK0084SB8650 [0,1,0,0,0,0|0,0,2]=3 14 B7R0.2 CC[C@H](C)NC(=O)C WXVL_AK00678SB0150 [0,1,0,0,0,0|1,0,2]=4 15 B7R0.2 CC[C@H](C)NC(=O)C WXVL_AK00678SB0150 [0,1,0,0,0,0|1,0,2]=4 16 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,1,0,0,0,0|2,0,1]=4 17 B7R0.2 CNC(=O)CC(C)O WXVL_AK00442SB3643 [0,1,0,0,0,0|2,0,1]=4 18 B7R0.3 CCC(=O)NCCF WXVL_AK00466SB0064 [0,1,0,0,0,0|2,0,1]=4 19 B7R0.3 CCC(=O)NCCF WXVL_AK00466SB0064 [0,1,0,0,0,0|2,0,1]=4 20 B7R0.3 CCCNC(=O)CC WXVL_AK00504SB0064 [0,1,0,0,0,0|2,0,1]=4 21 B7R0.3 CCCNC(=O)CC WXVL_AK00504SB0064 [0,1,0,0,0,0|2,0,1]=4 22 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [0,1,0,0,0,0|2,0,1]=4 23 B7R0.3 CNC(=O)CCOC WXVL_AK00442SB0156 [0,1,0,0,0,0|2,0,1]=4 24 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,1,0,0,0,0|1,0,1]=3 25 B7R0.5 CC(=O)N(C)CCO WXVL_AN2670SB0150 [0,1,0,0,0,0|1,0,1]=3 26 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [0,1,0,0,0,0|2,0,1]=4 27 B7R0.5 CCCC(C)C(=O)N WXVL_AK0084SB0352 [0,1,0,0,0,0|2,0,1]=4 28 B7R0.7 CCCC(=O)NCC WXVL_AK00476SB0073 [0,1,0,0,0,0|2,0,1]=4 29 B7R0.7 CCCC(=O)NCC WXVL_AK00476SB0073 [0,1,0,0,0,0|2,0,1]=4 30 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [0,1,0,0,0,0|2,0,1]=4 31 B7R0.10 CCC(C)C(=O)NC WXVL_AK00442SB0054 [0,1,0,0,0,0|2,0,1]=4 32 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [0,1,0,0,0,0|2,0,1]=4 33 B7R0.10 CC[C@@H](C)C(=O)NC WXVL_AK00442SB00054 [0,1,0,0,0,0|2,0,1]=4 34 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [1,1,0,0,0,0|0,0,2]=4 35 B6R0.2 CC(C)CC(=O)N WXVL_AK0084SB0063 [1,1,0,0,0,0|0,0,2]=4 36 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [1,1,0,0,0,0|1,0,1]=4 37 B6R0.3 CN(C)C(=O)CO WXVL_AN0032SB2706 [1,1,0,0,0,0|1,0,1]=4 38 B8R0.2 CC(C)N(C)C(=O)CO WXVL_AN0073SB2706 [0,2,0,0,0,0|1,0,1]=4 39 B8R0.2 CC(C)N(C)C(=O)CO WXVL_AN0073SB2706 [0,2,0,0,0,0|1,0,1]=4 40 B8R0.5 CC(=O)NC(C)CCO WXVL_AK1288SB0150 [0,2,0,0,0,0|0,0,1]=3 41 B8R0.5 CC(=O)NC(C)CCO WXVL_AK1288SB0150 [0,2,0,0,0,0|0,0,1]=3 42 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [0,2,0,0,0,0|1,0,1]=4 43 B8R0.5 CCC[C@H](C)NC(=O)C WXVL_AK00682SB0150 [0,2,0,0,0,0|1,0,1]=4 44 B8R0.5 CCNC(=O)CC(C)O WXVL_AK00476SB3643 [0,2,0,0,0,0|1,0,1]=4 45 B8R0.5 CCNC(=O)CC(C)O WXVL_AK00476SB3643 [0,2,0,0,0,0|1,0,1]=4 46 B8R0.19 CCC(=O)N[C@@H](C)CC WXVL_AK00678SB0064 [0,2,0,0,0,0|1,0,1]=4 47 B8R0.19 CCC(=O)N[C@@H](C)CC WXVL_AK00678SB0064 [0,2,0,0,0,0|1,0,1]=4 48 B8R0.19 CCC(=O)N[C@@H](C)CO WXVL_AK0109SB0064 [0,2,0,0,0,0|1,0,1]=4 49 B8R0.19 CCC(=O)N[C@@H](C)CO WXVL_AK0109SB0064 [0,2,0,0,0,0|1,0,1]=4 50 B8R0.19 CCC(C)CC(=O)NC WXVL_AK00442SB0353 [0,2,0,0,0,0|0,0,2]=4 51 B8R0.19 CCC(C)CC(=O)NC WXVL_AK00442SB0353 [0,2,0,0,0,0|0,0,2]=4 52 B8R0.19 CC[C@@H](C)CC(=O)NC WXVL_AK00442SB8650 [0,2,0,0,0,0|0,0,2]=4 53 B8R0.19 CC[C@@H](C)CC(=O)NC WXVL_AK00442SB8650 [0,2,0,0,0,0|0,0,2]=4 54 B8R0.19 CC[C@H](C)NC(=O)CO WXVL_AK00678SB2706 [0,2,0,0,0,0|0,0,1]=3 55 B8R0.19 CC[C@H](C)NC(=O)CO WXVL_AK00678SB2706 [0,2,0,0,0,0|0,0,1]=3 56 B8R0.19 C[C@@H](CF)NC(=O)CO WXVL_AK00558SB2706 [0,2,0,0,0,0|1,0,1]=4 57 B8R0.19 C[C@@H](CF)NC(=O)CO WXVL_AK00558SB2706 [0,2,0,0,0,0|1,0,1]=4 58 B8R0.19 C[C@@H](CO)NC(=O)CO WXVL_AK0109SB2706 [0,2,0,0,0,0|1,0,1]=4 59 B8R0.19 C[C@@H](CO)NC(=O)CO WXVL_AK0109SB2706 [0,2,0,0,0,0|1,0,1]=4 60 B8R0.1 CCNC(=O)CCOC WXVL_AK00476SB0156 [0,2,0,0,0,0|1,0,1]=4 61 B8R0.1 CCNC(=O)CCOC WXVL_AK00476SB0156 [0,2,0,0,0,0|1,0,1]=4 62 B8R0.3 CCC(=O)N(C)CCO WXVL_AN2670SB0064 [0,2,0,0,0,0|1,0,0]=3 63 B8R0.3 CCC(=O)N(C)CCO WXVL_AN2670SB0064 [0,2,0,0,0,0|1,0,0]=3 64 B8R0.3 CCCC(C)C(=O)NC WXVL_AK00442SB0352 [0,2,0,0,0,0|1,0,1]=4 65 B8R0.3 CCCC(C)C(=O)NC WXVL_AK00442SB0352 [0,2,0,0,0,0|1,0,1]=4 66 B8R0.3 CCNC(=O)C(C)CC WXVL_AK00476SB0054 [0,2,0,0,0,0|1,0,1]=4 67 B8R0.3 CCNC(=O)C(C)CC WXVL_AK00476SB0054 [0,2,0,0,0,0|1,0,1]=4 68 B8R0.3 CCNC(=O)[C@H](C)CC WXVL_AK00476SB00054 [0,2,0,0,0,0|1,0,1]=4 69 B8R0.3 CCNC(=O)[C@H](C)CC WXVL_AK00476SB00054 [0,2,0,0,0,0|1,0,1]=4 70 B8R0.3 CN(CCO)C(=O)CO WXVL_AN2670SB2706 [0,2,0,0,0,0|1,0,1]=4 71 B8R0.3 CN(CCO)C(=O)CO WXVL_AN2670SB2706 [0,2,0,0,0,0|1,0,1]=4 72 B8R0.6 CCC(=O)NCCCO WXVL_AK0073SB0064 [0,2,0,0,0,0|1,0,1]=4 73 B8R0.6 CCC(=O)NCCCO WXVL_AK0073SB0064 [0,2,0,0,0,0|1,0,1]=4 74 B8R0.8 COCCN(C)C(=O)C WXVL_AN0085SB0150 [0,2,0,0,0,0|1,0,1]=4 75 B8R0.8 COCCN(C)C(=O)C WXVL_AN0085SB0150 [0,2,0,0,0,0|1,0,1]=4 76 B8R0.9 CCC(=O)NCC(C)O WXVL_AK0052SB0064 [0,2,0,0,0,0|1,0,1]=4 77 B8R0.9 CCC(=O)NCC(C)O WXVL_AK0052SB0064 [0,2,0,0,0,0|1,0,1]=4 78 B8R0.9 CCC(=O)NC[C@H](C)O WXVL_AK0113SB0064 [0,2,0,0,0,0|1,0,1]=4 79 B8R0.9 CCC(=O)NC[C@H](C)O WXVL_AK0113SB0064 [0,2,0,0,0,0|1,0,1]=4 80 B8R0.15 CCN(CCO)C(=O)C WXVL_AN3174SB0150 [0,2,0,0,0,0|1,0,0]=3 81 B8R0.20 CCN(CC)C(=O)CO WXVL_AN0042SB2706 [0,2,0,0,0,0|1,0,1]=4 82 B8R0.20 CCN(CC)C(=O)CO WXVL_AN0042SB2706 [0,2,0,0,0,0|1,0,1]=4 83 B8R1.34 NC(=O)CC1CCC1 WXVL_AK0084SB2207 [0,1,0,1,0,0|0,0,2]=4 84 B8R1.34 NC(=O)CC1CCC1 WXVL_AK0084SB2207 [0,1,0,1,0,0|0,0,2]=4 85 B8R1.23 CC(=O)N1CC(C1)O WXVL_AN0284SB0150 [0,1,0,1,0,0|1,0,1]=4 86 B8R1.23 CC(=O)N1CC(C1)O WXVL_AN0284SB0150 [0,1,0,1,0,0|1,0,1]=4 87 B8R1.23 NC(=O)[C@H]1C[C@@H](C1)O WXVL_AK0084SB3648 [0,1,0,1,0,0|1,0,1]=4 88 B8R1.23 NC(=O)[C@H]1C[C@@H](C1)O WXVL_AK0084SB3648 [0,1,0,1,0,0|1,0,1]=4 89 B8R1.23 NC(=O)[C@H]1C[C@H](C1)O WXVL_AK0084SB0837 [0,1,0,1,0,0|1,0,1]=4 90 B8R1.23 NC(=O)[C@H]1C[C@H](C1)O WXVL_AK0084SB0837 [0,1,0,1,0,0|1,0,1]=4