0 B12R0.54 CC(C)CCNC(=O)[C@H](C)NC=O WXVL_AK0068SB5176 [0,0,1,0,0,0|0,0,0]=1 1 B12R0.54 CC(C)CCNC(=O)[C@H](C)NC=O WXVL_AK0068SB5176 [0,0,1,0,0,0|0,0,0]=1 2 B12R0.54 CCCC(C)C(=O)NCCC(C)C WXVL_AK0068SB0352 [0,0,1,0,0,0|2,0,1]=4 3 B12R0.54 CCCC(C)C(=O)NCCC(C)C WXVL_AK0068SB0352 [0,0,1,0,0,0|2,0,1]=4 4 B12R0.54 C[C@H](NC=O)C(=O)NCCC(=O)N WXVL_AK00443SB5176 [0,0,1,0,0,0|2,0,1]=4 5 B12R0.54 C[C@H](NC=O)C(=O)NCCC(=O)N WXVL_AK00443SB5176 [0,0,1,0,0,0|2,0,1]=4 6 B12R0.54 C[C@H](NC=O)C(=O)NCCN(C)C WXVL_AK0058SB5176 [0,0,1,0,0,0|1,0,0]=2 7 B12R0.54 C[C@H](NC=O)C(=O)NCCN(C)C WXVL_AK0058SB5176 [0,0,1,0,0,0|1,0,0]=2 8 B12R0.139 CC(=O)CCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0072 [0,0,1,0,0,0|1,0,1]=3 9 B12R0.139 CC(=O)CCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0072 [0,0,1,0,0,0|1,0,1]=3 10 B12R0.139 CC(=O)NCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0357 [0,0,1,0,0,0|2,0,1]=4 11 B12R0.139 CC(=O)NCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0357 [0,0,1,0,0,0|2,0,1]=4 12 B12R0.139 CC(=O)OCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB2824 [0,0,1,0,0,0|2,0,1]=4 13 B12R0.139 CC(=O)OCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB2824 [0,0,1,0,0,0|2,0,1]=4 14 B12R0.139 CC(=O)SCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB3992 [0,0,1,0,0,0|2,0,1]=4 15 B12R0.139 CC(=O)SCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB3992 [0,0,1,0,0,0|2,0,1]=4 16 B12R0.139 CC(C)/C=C/C(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0036 [0,0,1,0,0,0|0,0,2]=3 17 B12R0.139 CC(C)/C=C/C(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0036 [0,0,1,0,0,0|0,0,2]=3 18 B12R0.139 CC(C)CCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0354 [0,0,1,0,0,0|0,0,0]=1 19 B12R0.139 CC(C)CCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0354 [0,0,1,0,0,0|0,0,0]=1 20 B12R0.139 CC(C)OCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0213 [0,0,1,0,0,0|1,0,0]=2 21 B12R0.139 CC(C)OCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0213 [0,0,1,0,0,0|1,0,0]=2 22 B12R0.139 C[C@@H](NC(=O)CCC(=O)N)C(=O)N WXVL_AK6986SB0358 [0,0,1,0,0,0|2,0,1]=4 23 B12R0.139 C[C@@H](NC(=O)CCC(=O)N)C(=O)N WXVL_AK6986SB0358 [0,0,1,0,0,0|2,0,1]=4 24 B12R0.139 C[C@@H](NC(=O)CCN(C)C)C(=O)N WXVL_AK6986SB00052 [0,0,1,0,0,0|1,0,0]=2 25 B12R0.139 C[C@@H](NC(=O)CCN(C)C)C(=O)N WXVL_AK6986SB00052 [0,0,1,0,0,0|1,0,0]=2 26 B12R0.235 C#C[C@@H](C)NC(=O)C(O)CC(C)C WXVL_AK00735SB4281 [0,0,1,0,0,0|2,0,1]=4 27 B12R0.235 C#C[C@@H](C)NC(=O)C(O)CC(C)C WXVL_AK00735SB4281 [0,0,1,0,0,0|2,0,1]=4 28 B12R0.235 C=CC(C)NC(=O)C(O)CC(C)C WXVL_AK00769SB4281 [0,0,1,0,0,0|2,0,0]=3 29 B12R0.235 C=CC(C)NC(=O)C(O)CC(C)C WXVL_AK00769SB4281 [0,0,1,0,0,0|2,0,0]=3 30 B12R0.235 CC(C)CC(O)C(=O)NC(C)C#N WXVL_AK00810SB4281 [0,0,1,0,0,0|2,0,1]=4 31 B12R0.235 CC(C)CC(O)C(=O)NC(C)C#N WXVL_AK00810SB4281 [0,0,1,0,0,0|2,0,1]=4 32 B12R0.235 CC(C)CC(O)C(=O)N[C@@H](C)CF WXVL_AK00558SB4281 [0,0,1,0,0,0|2,0,1]=4 33 B12R0.235 CC(C)CC(O)C(=O)N[C@@H](C)CF WXVL_AK00558SB4281 [0,0,1,0,0,0|2,0,1]=4 34 B12R0.235 CC(C)CC(O)C(=O)N[C@@H](C)CO WXVL_AK0109SB4281 [0,0,1,0,0,0|1,0,2]=4 35 B12R0.235 CC(C)CC(O)C(=O)N[C@@H](C)CO WXVL_AK0109SB4281 [0,0,1,0,0,0|1,0,2]=4 36 B12R0.235 CC[C@H](C)NC(=O)C(O)CC(C)C WXVL_AK00678SB4281 [0,0,1,0,0,0|2,0,1]=4 37 B12R0.235 CC[C@H](C)NC(=O)C(O)CC(C)C WXVL_AK00678SB4281 [0,0,1,0,0,0|2,0,1]=4 38 B12R0.631 CC(C)C[C@@H](CO)NC(=O)C(C)C WXVL_AK00511SB0052 [0,0,1,0,0,0|1,0,2]=4 39 B12R0.631 CC(C)C[C@@H](CO)NC(=O)C(C)C WXVL_AK00511SB0052 [0,0,1,0,0,0|1,0,2]=4 40 B12R0.631 CC(C)C[C@@H](CO)NC(=O)C(C)S WXVL_AK00511SB2708 [0,0,1,0,0,0|1,0,2]=4 41 B12R0.631 CC(C)C[C@@H](CO)NC(=O)C(C)S WXVL_AK00511SB2708 [0,0,1,0,0,0|1,0,2]=4 42 B12R0.631 CC(C)C[C@@H](CO)NC(=O)[C@@H](C)O WXVL_AK00511SB1085 [0,0,1,0,0,0|1,0,2]=4 43 B12R0.631 CC(C)C[C@@H](CO)NC(=O)[C@@H](C)O WXVL_AK00511SB1085 [0,0,1,0,0,0|1,0,2]=4 44 B12R0.631 CC(C)C[C@H](CO)NC(=O)C(C)C WXVL_AK0366SB0052 [0,0,1,0,0,0|1,0,2]=4 45 B12R0.631 CC(C)C[C@H](CO)NC(=O)C(C)C WXVL_AK0366SB0052 [0,0,1,0,0,0|1,0,2]=4 46 B12R0.631 CC(C)C[C@H](CO)NC(=O)C(C)S WXVL_AK0366SB2708 [0,0,1,0,0,0|1,0,2]=4 47 B12R0.631 CC(C)C[C@H](CO)NC(=O)C(C)S WXVL_AK0366SB2708 [0,0,1,0,0,0|1,0,2]=4 48 B12R0.631 CC(C)C[C@H](CO)NC(=O)[C@@H](C)O WXVL_AK0366SB1085 [0,0,1,0,0,0|1,0,2]=4 49 B12R0.631 CC(C)C[C@H](CO)NC(=O)[C@@H](C)O WXVL_AK0366SB1085 [0,0,1,0,0,0|1,0,2]=4 50 B11R0.145 C/C=C(\C)/C(=O)NCCC(C)C WXVL_AK0068SB0343 [1,0,1,0,0,0|1,0,1]=4 51 B11R0.145 C/C=C(\C)/C(=O)NCCC(C)C WXVL_AK0068SB0343 [1,0,1,0,0,0|1,0,1]=4 52 B11R0.145 CCC(C)C(=O)NCCC(C)C WXVL_AK0068SB0054 [1,0,1,0,0,0|1,0,1]=4 53 B11R0.145 CCC(C)C(=O)NCCC(C)C WXVL_AK0068SB0054 [1,0,1,0,0,0|1,0,1]=4 54 B11R0.145 CC[C@@H](C)C(=O)NCCC(C)C WXVL_AK0068SB00054 [1,0,1,0,0,0|1,0,1]=4 55 B11R0.145 CC[C@@H](C)C(=O)NCCC(C)C WXVL_AK0068SB00054 [1,0,1,0,0,0|1,0,1]=4 56 B11R0.145 CO[C@H](C)C(=O)NCCC(C)C WXVL_AK0068SB2926 [1,0,1,0,0,0|1,0,1]=4 57 B11R0.145 CO[C@H](C)C(=O)NCCC(C)C WXVL_AK0068SB2926 [1,0,1,0,0,0|1,0,1]=4 58 B11R0.147 C=CCCC(=O)NCCC(C)C WXVL_AK0068SB1035 [1,0,1,0,0,0|2,0,0]=4 59 B11R0.147 C=CCCC(=O)NCCC(C)C WXVL_AK0068SB1035 [1,0,1,0,0,0|2,0,0]=4 60 B11R0.155 C#CCCNC(=O)[C@H](C)NC=O WXVL_AK3109SB5176 [1,0,1,0,0,0|0,0,2]=4 61 B11R0.155 C#CCCNC(=O)[C@H](C)NC=O WXVL_AK3109SB5176 [1,0,1,0,0,0|0,0,2]=4 62 B11R0.155 C=CCCNC(=O)[C@H](C)NC=O WXVL_AK00138SB5176 [1,0,1,0,0,0|0,0,2]=4 63 B11R0.155 C=CCCNC(=O)[C@H](C)NC=O WXVL_AK00138SB5176 [1,0,1,0,0,0|0,0,2]=4 64 B11R0.155 CCCCNC(=O)[C@H](C)NC=O WXVL_AK00588SB5176 [1,0,1,0,0,0|0,0,0]=2 65 B11R0.155 CCCCNC(=O)[C@H](C)NC=O WXVL_AK00588SB5176 [1,0,1,0,0,0|0,0,0]=2 66 B11R0.155 CSCCNC(=O)[C@H](C)NC=O WXVL_AK00440SB5176 [1,0,1,0,0,0|1,0,0]=3 67 B11R0.155 CSCCNC(=O)[C@H](C)NC=O WXVL_AK00440SB5176 [1,0,1,0,0,0|1,0,0]=3 68 B11R0.155 C[C@H](NC=O)C(=O)NCCC#N WXVL_AK0087SB5176 [1,0,1,0,0,0|1,0,1]=4 69 B11R0.155 C[C@H](NC=O)C(=O)NCCC#N WXVL_AK0087SB5176 [1,0,1,0,0,0|1,0,1]=4 70 B11R0.155 C[C@H](NC=O)C(=O)NCCCO WXVL_AK0073SB5176 [1,0,1,0,0,0|1,0,0]=3 71 B11R0.155 C[C@H](NC=O)C(=O)NCCCO WXVL_AK0073SB5176 [1,0,1,0,0,0|1,0,0]=3 72 B11R0.85 C=C(C)CNC(=O)CCC(C)C WXVL_AK0761SB0354 [1,0,1,0,0,0|2,0,0]=4 73 B11R0.85 C=C(C)CNC(=O)CCC(C)C WXVL_AK0761SB0354 [1,0,1,0,0,0|2,0,0]=4 74 B11R0.85 CC(=O)CCC(=O)NCC(=O)N WXVL_AK0147SB0072 [1,0,1,0,0,0|1,0,1]=4 75 B11R0.85 CC(=O)CCC(=O)NCC(=O)N WXVL_AK0147SB0072 [1,0,1,0,0,0|1,0,1]=4 76 B11R0.85 CC(C)/C=C/C(=O)NCC(=O)N WXVL_AK0147SB0036 [1,0,1,0,0,0|0,0,2]=4 77 B11R0.85 CC(C)/C=C/C(=O)NCC(=O)N WXVL_AK0147SB0036 [1,0,1,0,0,0|0,0,2]=4 78 B11R0.85 CC(C)CCC(=O)NCC(=O)N WXVL_AK0147SB0354 [1,0,1,0,0,0|0,0,0]=2 79 B11R0.85 CC(C)CCC(=O)NCC(=O)N WXVL_AK0147SB0354 [1,0,1,0,0,0|0,0,0]=2 80 B11R0.85 CC(C)CNC(=O)CCC(=O)N WXVL_AK00544SB0358 [1,0,1,0,0,0|2,0,0]=4 81 B11R0.85 CC(C)CNC(=O)CCC(=O)N WXVL_AK00544SB0358 [1,0,1,0,0,0|2,0,0]=4 82 B11R0.85 CC(C)OCC(=O)NCC(=O)N WXVL_AK0147SB0213 [1,0,1,0,0,0|1,0,0]=3 83 B11R0.85 CC(C)OCC(=O)NCC(=O)N WXVL_AK0147SB0213 [1,0,1,0,0,0|1,0,0]=3 84 B11R0.85 CN(C)CCC(=O)NCC(=O)N WXVL_AK0147SB00052 [1,0,1,0,0,0|1,0,0]=3 85 B11R0.85 CN(C)CCC(=O)NCC(=O)N WXVL_AK0147SB00052 [1,0,1,0,0,0|1,0,0]=3 86 B11R0.93 C#C[C@@H](C)NC(=O)CCC(C)C WXVL_AK00735SB0354 [1,0,1,0,0,0|1,0,1]=4 87 B11R0.93 C#C[C@@H](C)NC(=O)CCC(C)C WXVL_AK00735SB0354 [1,0,1,0,0,0|1,0,1]=4 88 B11R0.93 C=CC(C)NC(=O)CCC(C)C WXVL_AK00769SB0354 [1,0,1,0,0,0|1,0,0]=3 89 B11R0.93 C=CC(C)NC(=O)CCC(C)C WXVL_AK00769SB0354 [1,0,1,0,0,0|1,0,0]=3 90 B11R0.93 C=CC(C)NC(=O)CCN(C)C WXVL_AK00769SB00052 [1,0,1,0,0,0|2,0,0]=4 91 B11R0.93 C=CC(C)NC(=O)CCN(C)C WXVL_AK00769SB00052 [1,0,1,0,0,0|2,0,0]=4 92 B11R0.93 C=CC(C)NC(=O)COC(C)C WXVL_AK00769SB0213 [1,0,1,0,0,0|2,0,0]=4 93 B11R0.93 C=CC(C)NC(=O)COC(C)C WXVL_AK00769SB0213 [1,0,1,0,0,0|2,0,0]=4 94 B11R0.93 CC(C)CCC(=O)NC(C)C#N WXVL_AK00810SB0354 [1,0,1,0,0,0|0,0,2]=4 95 B11R0.93 CC(C)CCC(=O)NC(C)C#N WXVL_AK00810SB0354 [1,0,1,0,0,0|0,0,2]=4 96 B11R0.93 CC(C)CCC(=O)N[C@@H](C)CF WXVL_AK00558SB0354 [1,0,1,0,0,0|1,0,1]=4 97 B11R0.93 CC(C)CCC(=O)N[C@@H](C)CF WXVL_AK00558SB0354 [1,0,1,0,0,0|1,0,1]=4 98 B11R0.93 CC(C)CCC(=O)N[C@@H](C)CO WXVL_AK0109SB0354 [1,0,1,0,0,0|0,0,2]=4 99 B11R0.93 CC(C)CCC(=O)N[C@@H](C)CO WXVL_AK0109SB0354 [1,0,1,0,0,0|0,0,2]=4 100 B11R0.93 CC[C@H](C)NC(=O)CCC(C)C WXVL_AK00678SB0354 [1,0,1,0,0,0|1,0,1]=4 101 B11R0.93 CC[C@H](C)NC(=O)CCC(C)C WXVL_AK00678SB0354 [1,0,1,0,0,0|1,0,1]=4 102 B11R0.163 C#CCCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB2189 [1,0,1,0,0,0|0,0,2]=4 103 B11R0.163 C#CCCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB2189 [1,0,1,0,0,0|0,0,2]=4 104 B11R0.163 C=CCCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB1035 [1,0,1,0,0,0|0,0,2]=4 105 B11R0.163 C=CCCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB1035 [1,0,1,0,0,0|0,0,2]=4 106 B11R0.163 CCOCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0091 [1,0,1,0,0,0|1,0,0]=3 107 B11R0.163 CCOCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0091 [1,0,1,0,0,0|1,0,0]=3 108 B11R0.163 CCSCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0002 [1,0,1,0,0,0|1,0,0]=3 109 B11R0.163 CCSCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0002 [1,0,1,0,0,0|1,0,0]=3 110 B11R0.163 COCCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0156 [1,0,1,0,0,0|1,0,0]=3 111 B11R0.163 COCCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0156 [1,0,1,0,0,0|1,0,0]=3 112 B11R0.163 CSCCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0361 [1,0,1,0,0,0|1,0,0]=3 113 B11R0.163 CSCCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0361 [1,0,1,0,0,0|1,0,0]=3 114 B11R0.163 C[C@@H](NC(=O)NCCCl)C(=O)N WXVL_AK6986YV0092 [1,0,1,0,0,0|2,0,0]=4 115 B11R0.163 C[C@@H](NC(=O)NCCCl)C(=O)N WXVL_AK6986YV0092 [1,0,1,0,0,0|2,0,0]=4 116 B11R0.32 CC(=O)NC(CC(C)C)C(=O)N WXVL_AK0084SB0170 [1,0,1,0,0,0|0,0,0]=2 117 B11R0.32 CC(=O)NC(CC(C)C)C(=O)N WXVL_AK0084SB0170 [1,0,1,0,0,0|0,0,0]=2 118 B11R0.91 CCC(=O)N[C@@H](CO)CC(C)C WXVL_AK0366SB0064 [1,0,1,0,0,0|0,0,2]=4 119 B11R0.91 CCC(=O)N[C@@H](CO)CC(C)C WXVL_AK0366SB0064 [1,0,1,0,0,0|0,0,2]=4 120 B11R0.91 CCC(=O)N[C@H](CO)CC(C)C WXVL_AK00511SB0064 [1,0,1,0,0,0|0,0,2]=4 121 B11R0.91 CCC(=O)N[C@H](CO)CC(C)C WXVL_AK00511SB0064 [1,0,1,0,0,0|0,0,2]=4 122 B11R0.43 C=CC(C)NC(=O)C(C)CCC WXVL_AK00769SB0352 [1,0,1,0,0,0|2,0,0]=4 123 B11R0.43 C=CC(C)NC(=O)C(C)CCC WXVL_AK00769SB0352 [1,0,1,0,0,0|2,0,0]=4 124 B11R0.43 C=CC(C)NC(=O)[C@@H](O)CCC WXVL_AK00769SB3627 [1,0,1,0,0,0|2,0,0]=4 125 B11R0.43 C=CC(C)NC(=O)[C@@H](O)CCC WXVL_AK00769SB3627 [1,0,1,0,0,0|2,0,0]=4 126 B11R0.68 C=CCNC(=O)C(O)CC(C)C WXVL_AK00561SB4281 [1,0,1,0,0,0|2,0,0]=4 127 B11R0.68 C=CCNC(=O)C(O)CC(C)C WXVL_AK00561SB4281 [1,0,1,0,0,0|2,0,0]=4 128 B11R0.149 CC(C)CC(O)C(=O)NC(C)C WXVL_AK0030SB4281 [1,0,1,0,0,0|1,0,1]=4 129 B11R0.149 CC(C)CC(O)C(=O)NC(C)C WXVL_AK0030SB4281 [1,0,1,0,0,0|1,0,1]=4 130 B13R0.56 C[C@H](NC=O)C(=O)NCC(=O)N(C)C WXVL_AK00415SB5176 [0,1,1,0,0,0|1,0,1]=4 131 B13R0.56 C[C@H](NC=O)C(=O)NCC(=O)N(C)C WXVL_AK00415SB5176 [0,1,1,0,0,0|1,0,1]=4 132 B13R0.243 CC(CN(C)C)NC(=O)[C@H](C)NC=O WXVL_AK0938SB5176 [0,1,1,0,0,0|1,0,0]=3 133 B13R0.243 CC(CN(C)C)NC(=O)[C@H](C)NC=O WXVL_AK0938SB5176 [0,1,1,0,0,0|1,0,0]=3 134 B13R0.264 C[C@H](NC=O)C(=O)N(C)CCN(C)C WXVL_AN0052SB5176 [0,1,1,0,0,0|1,0,0]=3 135 B13R0.264 C[C@H](NC=O)C(=O)N(C)CCN(C)C WXVL_AN0052SB5176 [0,1,1,0,0,0|1,0,0]=3 136 B13R0.267 CC(CO)CCNC(=O)[C@H](C)NC=O WXVL_AK4143SB5176 [0,1,1,0,0,0|0,0,0]=2 137 B13R0.267 CC(CO)CCNC(=O)[C@H](C)NC=O WXVL_AK4143SB5176 [0,1,1,0,0,0|0,0,0]=2 138 B13R0.268 C[C@H](NC=O)C(=O)NCCC(C)(C)O WXVL_AK1558SB5176 [0,1,1,0,0,0|0,0,0]=2 139 B13R0.268 C[C@H](NC=O)C(=O)NCCC(C)(C)O WXVL_AK1558SB5176 [0,1,1,0,0,0|0,0,0]=2 140 B13R0.268 C[C@H](NC=O)C(=O)NCCC(F)(F)F WXVL_AK0145SB5176 [0,1,1,0,0,0|2,0,0]=4 141 B13R0.268 C[C@H](NC=O)C(=O)NCCC(F)(F)F WXVL_AK0145SB5176 [0,1,1,0,0,0|2,0,0]=4 142 B13R0.268 C[C@H](NC=O)C(=O)NCCS(=O)(=O)C WXVL_AK0333SB5176 [0,1,1,0,0,0|2,0,0]=4 143 B13R0.268 C[C@H](NC=O)C(=O)NCCS(=O)(=O)C WXVL_AK0333SB5176 [0,1,1,0,0,0|2,0,0]=4 144 B13R0.345 C=CCOC(C)C(=O)NCCC(C)C WXVL_AK0068SBD933 [0,1,1,0,0,0|2,0,0]=4 145 B13R0.345 C=CCOC(C)C(=O)NCCC(C)C WXVL_AK0068SBD933 [0,1,1,0,0,0|2,0,0]=4 146 B13R0.374 C=CCC(C)(C)C(=O)NCCC(C)C WXVL_AK0068SB0363 [0,1,1,0,0,0|2,0,0]=4 147 B13R0.374 C=CCC(C)(C)C(=O)NCCC(C)C WXVL_AK0068SB0363 [0,1,1,0,0,0|2,0,0]=4 148 B13R0.1403 CC(=O)NC(C)C(=O)NCCC(C)C WXVL_AK0068SB0373 [0,1,1,0,0,0|0,0,0]=2 149 B13R0.1403 CC(=O)NC(C)C(=O)NCCC(C)C WXVL_AK0068SB0373 [0,1,1,0,0,0|0,0,0]=2 150 B13R0.1403 CC(=O)NC(C)C(=O)NCCN(C)C WXVL_AK0058SB0373 [0,1,1,0,0,0|1,0,0]=3 151 B13R0.1403 CC(=O)NC(C)C(=O)NCCN(C)C WXVL_AK0058SB0373 [0,1,1,0,0,0|1,0,0]=3 152 B13R0.81 CC(C)CC(O)C(=O)N[C@H](C)C(=O)N WXVL_AK6986SB4281 [0,1,1,0,0,0|0,0,0]=2 153 B13R0.81 CC(C)CC(O)C(=O)N[C@H](C)C(=O)N WXVL_AK6986SB4281 [0,1,1,0,0,0|0,0,0]=2 154 B13R0.355 CC(C)N(C)CC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0019 [0,1,1,0,0,0|1,0,0]=3 155 B13R0.355 CC(C)N(C)CC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0019 [0,1,1,0,0,0|1,0,0]=3 156 B13R0.365 CC(C)CCC(=O)NC(C#N)C(=O)N WXVL_AK3381SB0354 [0,1,1,0,0,0|0,0,1]=3 157 B13R0.365 CC(C)CCC(=O)NC(C#N)C(=O)N WXVL_AK3381SB0354 [0,1,1,0,0,0|0,0,1]=3 158 B13R0.365 CC(C)OCC(=O)NC(C#N)C(=O)N WXVL_AK3381SB0213 [0,1,1,0,0,0|1,0,1]=4 159 B13R0.365 CC(C)OCC(=O)NC(C#N)C(=O)N WXVL_AK3381SB0213 [0,1,1,0,0,0|1,0,1]=4 160 B13R0.365 CN(C)CCC(=O)NC(C#N)C(=O)N WXVL_AK3381SB00052 [0,1,1,0,0,0|1,0,1]=4 161 B13R0.365 CN(C)CCC(=O)NC(C#N)C(=O)N WXVL_AK3381SB00052 [0,1,1,0,0,0|1,0,1]=4 162 B13R0.434 COC(=O)CCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0069 [0,1,1,0,0,0|1,0,1]=4 163 B13R0.434 COC(=O)CCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0069 [0,1,1,0,0,0|1,0,1]=4 164 B13R0.1107 CNC(=O)[C@H](C)NC(=O)/C=C/C(C)C WXVL_AK2993SB0036 [0,1,1,0,0,0|0,0,2]=4 165 B13R0.1107 CNC(=O)[C@H](C)NC(=O)/C=C/C(C)C WXVL_AK2993SB0036 [0,1,1,0,0,0|0,0,2]=4 166 B13R0.1107 CNC(=O)[C@H](C)NC(=O)CCC(=O)C WXVL_AK2993SB0072 [0,1,1,0,0,0|1,0,1]=4 167 B13R0.1107 CNC(=O)[C@H](C)NC(=O)CCC(=O)C WXVL_AK2993SB0072 [0,1,1,0,0,0|1,0,1]=4 168 B13R0.1107 CNC(=O)[C@H](C)NC(=O)CCC(C)C WXVL_AK2993SB0354 [0,1,1,0,0,0|0,0,0]=2 169 B13R0.1107 CNC(=O)[C@H](C)NC(=O)CCC(C)C WXVL_AK2993SB0354 [0,1,1,0,0,0|0,0,0]=2 170 B13R0.1107 CNC(=O)[C@H](C)NC(=O)CCN(C)C WXVL_AK2993SB00052 [0,1,1,0,0,0|1,0,0]=3 171 B13R0.1107 CNC(=O)[C@H](C)NC(=O)CCN(C)C WXVL_AK2993SB00052 [0,1,1,0,0,0|1,0,0]=3 172 B13R0.1107 CNC(=O)[C@H](C)NC(=O)COC(C)C WXVL_AK2993SB0213 [0,1,1,0,0,0|1,0,0]=3 173 B13R0.1107 CNC(=O)[C@H](C)NC(=O)COC(C)C WXVL_AK2993SB0213 [0,1,1,0,0,0|1,0,0]=3 174 B13R0.1107 COC(=O)[C@H](C)NC(=O)NCC(C)C WXVL_AK00544YV0164 [0,1,1,0,0,0|2,0,0]=4 175 B13R0.1107 COC(=O)[C@H](C)NC(=O)NCC(C)C WXVL_AK00544YV0164 [0,1,1,0,0,0|2,0,0]=4 176 B13R0.1263 C[C@@H](NC(=O)CCC(F)(F)F)C(=O)N WXVL_AK6986SB0174 [0,1,1,0,0,0|2,0,0]=4 177 B13R0.1263 C[C@@H](NC(=O)CCC(F)(F)F)C(=O)N WXVL_AK6986SB0174 [0,1,1,0,0,0|2,0,0]=4 178 B13R0.1263 C[C@@H](NC(=O)CCS(=O)(=O)C)C(=O)N WXVL_AK6986SB0009 [0,1,1,0,0,0|2,0,0]=4 179 B13R0.1263 C[C@@H](NC(=O)CCS(=O)(=O)C)C(=O)N WXVL_AK6986SB0009 [0,1,1,0,0,0|2,0,0]=4 180 B13R0.1263 C[C@@H](NC(=O)COC(C)(C)C)C(=O)N WXVL_AK6986SB1440 [0,1,1,0,0,0|1,0,0]=3 181 B13R0.1263 C[C@@H](NC(=O)COC(C)(C)C)C(=O)N WXVL_AK6986SB1440 [0,1,1,0,0,0|1,0,0]=3 182 B13R0.1067 C=C[C@@H](CO)NC(=O)C(O)CC(C)C WXVL_AK00581SB4281 [0,1,1,0,0,0|2,0,0]=4 183 B13R0.1067 C=C[C@@H](CO)NC(=O)C(O)CC(C)C WXVL_AK00581SB4281 [0,1,1,0,0,0|2,0,0]=4 184 B13R0.83 CCNC(=O)C(CC(C)C)NC(=O)C WXVL_AK00476SB0170 [0,1,1,0,0,0|0,0,0]=2 185 B13R0.83 CCNC(=O)C(CC(C)C)NC(=O)C WXVL_AK00476SB0170 [0,1,1,0,0,0|0,0,0]=2 186 B13R1.46 CC1CCN(C1)C(=O)[C@H](C)NC=O WXVL_AN0556SB5176 [0,0,1,1,0,0|0,0,0]=2 187 B13R1.46 CC1CCN(C1)C(=O)[C@H](C)NC=O WXVL_AN0556SB5176 [0,0,1,1,0,0|0,0,0]=2 188 B13R1.46 C[C@H](NC=O)C(=O)N1CCC(C1)Br WXVL_AN00715SB5176 [0,0,1,1,0,0|1,0,0]=3 189 B13R1.46 C[C@H](NC=O)C(=O)N1CCC(C1)F WXVL_AN00338SB5176 [0,0,1,1,0,0|1,0,0]=3 190 B13R1.46 C[C@H](NC=O)C(=O)N1CCC(C1)F WXVL_AN00338SB5176 [0,0,1,1,0,0|1,0,0]=3 191 B13R1.46 C[C@H](NC=O)C(=O)N1CCC(C1)O WXVL_AN0158SB5176 [0,0,1,1,0,0|1,0,0]=3 192 B13R1.46 C[C@H](NC=O)C(=O)N1CCC(C1)O WXVL_AN0158SB5176 [0,0,1,1,0,0|1,0,0]=3 193 B13R1.46 C[C@H](NC=O)C(=O)N1CC[C@@H](C1)O WXVL_AN00391SB5176 [0,0,1,1,0,0|1,0,0]=3 194 B13R1.46 C[C@H](NC=O)C(=O)N1CC[C@@H](C1)O WXVL_AN00391SB5176 [0,0,1,1,0,0|1,0,0]=3 195 B13R1.46 C[C@H](NC=O)C(=O)N1CC[C@H](C1)C WXVL_AN00488SB5176 [0,0,1,1,0,0|0,0,0]=2 196 B13R1.46 C[C@H](NC=O)C(=O)N1CC[C@H](C1)C WXVL_AN00488SB5176 [0,0,1,1,0,0|0,0,0]=2 197 B13R1.46 C[C@H](NC=O)C(=O)N1CC[C@H](C1)F WXVL_AN00035SB5176 [0,0,1,1,0,0|1,0,0]=3 198 B13R1.46 C[C@H](NC=O)C(=O)N1CC[C@H](C1)F WXVL_AN00035SB5176 [0,0,1,1,0,0|1,0,0]=3 199 B13R1.46 C[C@H](NC=O)C(=O)N1CC[C@H](C1)O WXVL_AN00543SB5176 [0,0,1,1,0,0|1,0,0]=3 200 B13R1.46 C[C@H]1CCN(C1)C(=O)[C@H](C)NC=O WXVL_AN00094SB5176 [0,0,1,1,0,0|0,0,0]=2 201 B13R1.46 C[C@H]1CCN(C1)C(=O)[C@H](C)NC=O WXVL_AN00094SB5176 [0,0,1,1,0,0|0,0,0]=2 202 B13R1.2911 CC1CC(C1)NC(=O)[C@H](C)NC=O WXVL_AK0309SB5176 [0,0,1,1,0,0|0,0,0]=2 203 B13R1.2911 CC1CC(C1)NC(=O)[C@H](C)NC=O WXVL_AK0309SB5176 [0,0,1,1,0,0|0,0,0]=2 204 B13R1.2911 C[C@H](NC=O)C(=O)NC1CC(C1)F WXVL_AK0307SB5176 [0,0,1,1,0,0|1,0,0]=3 205 B13R1.2911 C[C@H](NC=O)C(=O)NC1CC(C1)F WXVL_AK0307SB5176 [0,0,1,1,0,0|1,0,0]=3 206 B13R1.2911 C[C@H](NC=O)C(=O)NC1CC(C1)O WXVL_AK0306SB5176 [0,0,1,1,0,0|1,0,0]=3 207 B13R1.2911 C[C@H](NC=O)C(=O)NC1CC(C1)O WXVL_AK0306SB5176 [0,0,1,1,0,0|1,0,0]=3 208 B13R1.2911 C[C@H](NC=O)C(=O)NC1CN(C1)C WXVL_AK1377SB5176 [0,0,1,1,0,0|1,0,0]=3 209 B13R1.2911 C[C@H](NC=O)C(=O)NC1CN(C1)C WXVL_AK1377SB5176 [0,0,1,1,0,0|1,0,0]=3 210 B13R1.2911 C[C@H](NC=O)C(=O)N[C@H]1C[C@H](C1)O WXVL_AK1397SB5176 [0,0,1,1,0,0|1,0,0]=3 211 B13R1.2911 C[C@H](NC=O)C(=O)N[C@H]1C[C@H](C1)O WXVL_AK1397SB5176 [0,0,1,1,0,0|1,0,0]=3 212 B13R1.2967 C[C@H](NC=O)C(=O)NCCC1CC1 WXVL_AK00594SB5176 [0,0,1,1,0,0|0,0,0]=2 213 B13R1.2967 C[C@H](NC=O)C(=O)NCCC1CC1 WXVL_AK00594SB5176 [0,0,1,1,0,0|0,0,0]=2 214 B13R1.3835 C=C1CC(C1)C(=O)NCCC(C)C WXVL_AK0068SB0804 [0,0,1,1,0,0|2,0,0]=4 215 B13R1.3835 C=C1CC(C1)C(=O)NCCC(C)C WXVL_AK0068SB0804 [0,0,1,1,0,0|2,0,0]=4 216 B13R1.3835 CC(C)CCNC(=O)C1CC(=O)N1 WXVL_AK0068SB3574 [0,0,1,1,0,0|0,0,0]=2 217 B13R1.3835 CC(C)CCNC(=O)C1CC(=O)N1 WXVL_AK0068SB3574 [0,0,1,1,0,0|0,0,0]=2 218 B13R1.3835 CN(C)CCNC(=O)C1CC(=O)N1 WXVL_AK0058SB3574 [0,0,1,1,0,0|1,0,0]=3 219 B13R1.3835 CN(C)CCNC(=O)C1CC(=O)N1 WXVL_AK0058SB3574 [0,0,1,1,0,0|1,0,0]=3 220 B13R1.6324 C[C@H](NC=O)C(=O)NC1CC1(F)F WXVL_AK0397SB5176 [0,0,1,1,0,0|2,0,0]=4 221 B13R1.6324 C[C@H](NC=O)C(=O)NC1CC1(F)F WXVL_AK0397SB5176 [0,0,1,1,0,0|2,0,0]=4 222 B13R1.1038 C[C@@H](NC(=O)C=CC1CC1)C(=O)N WXVL_AK6986SB4216 [0,0,1,1,0,0|0,0,2]=4 223 B13R1.1038 C[C@@H](NC(=O)C=CC1CC1)C(=O)N WXVL_AK6986SB4216 [0,0,1,1,0,0|0,0,2]=4 224 B13R1.1038 C[C@@H](NC(=O)CCC1CC1)C(=O)N WXVL_AK6986SB5360 [0,0,1,1,0,0|0,0,0]=2 225 B13R1.1038 C[C@@H](NC(=O)CCC1CC1)C(=O)N WXVL_AK6986SB5360 [0,0,1,1,0,0|0,0,0]=2 226 B13R1.3834 C=C1CC(C1)C(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0804 [0,0,1,1,0,0|0,0,2]=4 227 B13R1.3834 C=C1CC(C1)C(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0804 [0,0,1,1,0,0|0,0,2]=4 228 B13R1.3834 C[C@@H](NC(=O)C1CN(C1)C)C(=O)N WXVL_AK6986SB0021 [0,0,1,1,0,0|1,0,0]=3 229 B13R1.3834 C[C@@H](NC(=O)C1CN(C1)C)C(=O)N WXVL_AK6986SB0021 [0,0,1,1,0,0|1,0,0]=3 230 B13R1.3834 C[C@@H](NC(=O)[C@H]1C[C@@H](C1)O)C(=O)N WXVL_AK6986SB3648 [0,0,1,1,0,0|1,0,0]=3 231 B13R1.3834 C[C@@H](NC(=O)[C@H]1C[C@@H](C1)O)C(=O)N WXVL_AK6986SB3648 [0,0,1,1,0,0|1,0,0]=3 232 B13R1.3834 C[C@@H](NC(=O)[C@H]1C[C@H](C1)O)C(=O)N WXVL_AK6986SB0837 [0,0,1,1,0,0|1,0,0]=3 233 B13R1.3834 C[C@@H](NC(=O)[C@H]1C[C@H](C1)O)C(=O)N WXVL_AK6986SB0837 [0,0,1,1,0,0|1,0,0]=3 234 B13R1.8711 C[C@@H](NC(=O)C1CC1(C)C)C(=O)N WXVL_AK6986SB0012 [0,0,1,1,0,0|0,0,0]=2 235 B13R1.8711 C[C@@H](NC(=O)C1CC1(C)C)C(=O)N WXVL_AK6986SB0012 [0,0,1,1,0,0|0,0,0]=2 236 B13R1.8711 C[C@@H](NC(=O)C1CC1(F)F)C(=O)N WXVL_AK6986SB0843 [0,0,1,1,0,0|2,0,0]=4 237 B13R1.8711 C[C@@H](NC(=O)C1CC1(F)F)C(=O)N WXVL_AK6986SB0843 [0,0,1,1,0,0|2,0,0]=4 238 B13R1.541 CCC(=O)N1C[C@@H](C[C@H]1C(=O)N)O WXVL_AN00779SB0064 [0,0,1,1,0,0|1,0,0]=3 239 B13R1.541 CCC(=O)N1C[C@H](C[C@H]1C(=O)N)F WXVL_AN2819SB0064 [0,0,1,1,0,0|1,0,0]=3 240 B13R1.541 CCC(=O)N1C[C@H](C[C@H]1C(=O)N)F WXVL_AN2819SB0064 [0,0,1,1,0,0|1,0,0]=3 241 B13R1.541 NC(=O)[C@@H]1C[C@@H](CN1C(=O)CO)F WXVL_AN2819SB2706 [0,0,1,1,0,0|2,0,0]=4 242 B13R1.541 NC(=O)[C@@H]1C[C@@H](CN1C(=O)CO)F WXVL_AN2819SB2706 [0,0,1,1,0,0|2,0,0]=4 243 B13R1.541 NC(=O)[C@@H]1C[C@H](CN1C(=O)CO)O WXVL_AN00779SB2706 [0,0,1,1,0,0|2,0,0]=4 244 B13R1.10 C=CC(C)NC(=O)[C@@H]1C[C@@H](CN1)O WXVL_AK00769SB00007 [0,0,1,1,0,0|2,0,0]=4 245 B13R1.10 C=CC(C)NC(=O)[C@@H]1C[C@@H](CN1)O WXVL_AK00769SB00007 [0,0,1,1,0,0|2,0,0]=4 246 B13R1.1433 C=CC(C)NC(=O)C1CC(C1)(C)C WXVL_AK00769SB2977 [0,0,1,1,0,0|2,0,0]=4 247 B13R1.1433 C=CC(C)NC(=O)C1CC(C1)(C)C WXVL_AK00769SB2977 [0,0,1,1,0,0|2,0,0]=4 248 B11R0.59 C=C(C)CNC(=O)[C@H](C)NC=O WXVL_AK0761SB5176 [0,0,1,0,1,0|0,0,2]=4 249 B11R0.59 C=C(C)CNC(=O)[C@H](C)NC=O WXVL_AK0761SB5176 [0,0,1,0,1,0|0,0,2]=4 250 B11R0.59 CC(C)CNC(=O)[C@H](C)NC=O WXVL_AK00544SB5176 [0,0,1,0,1,0|0,0,0]=2 251 B11R0.59 CC(C)CNC(=O)[C@H](C)NC=O WXVL_AK00544SB5176 [0,0,1,0,1,0|0,0,0]=2 252 B11R0.59 CC(O)CNC(=O)[C@H](C)NC=O WXVL_AK0052SB5176 [0,0,1,0,1,0|1,0,0]=3 253 B11R0.59 CC(O)CNC(=O)[C@H](C)NC=O WXVL_AK0052SB5176 [0,0,1,0,1,0|1,0,0]=3 254 B11R0.59 C[C@H](NC=O)C(=O)NCC(F)F WXVL_AK0136SB5176 [0,0,1,0,1,0|2,0,0]=4 255 B11R0.59 C[C@H](NC=O)C(=O)NCC(F)F WXVL_AK0136SB5176 [0,0,1,0,1,0|2,0,0]=4 256 B11R0.59 C[C@H](O)CNC(=O)[C@H](C)NC=O WXVL_AK0113SB5176 [0,0,1,0,1,0|1,0,0]=3 257 B11R0.59 C[C@H](O)CNC(=O)[C@H](C)NC=O WXVL_AK0113SB5176 [0,0,1,0,1,0|1,0,0]=3 258 B11R0.92 C=CC(C)NC(=O)C(O)C(C)C WXVL_AK00769SB1147 [0,0,1,0,1,0|2,0,0]=4 259 B11R0.92 C=CC(C)NC(=O)C(O)C(C)C WXVL_AK00769SB1147 [0,0,1,0,1,0|2,0,0]=4 260 B13R0.261 CC(=O)NCCNC(=O)[C@H](C)NC=O WXVL_AK0057SB5176 [0,0,1,0,0,1|1,0,1]=4 261 B13R0.261 CC(=O)NCCNC(=O)[C@H](C)NC=O WXVL_AK0057SB5176 [0,0,1,0,0,1|1,0,1]=4 262 B13R0.261 CC(C)OCCNC(=O)[C@H](C)NC=O WXVL_AK0128SB5176 [0,0,1,0,0,1|0,0,0]=2 263 B13R0.261 CC(C)OCCNC(=O)[C@H](C)NC=O WXVL_AK0128SB5176 [0,0,1,0,0,1|0,0,0]=2 264 B13R0.444 CC(=CCCC(=O)N[C@H](C)C(=O)N)C WXVL_AK6986SB00030 [0,0,1,0,0,1|0,0,1]=3 265 B13R0.444 CC(=CCCC(=O)N[C@H](C)C(=O)N)C WXVL_AK6986SB00030 [0,0,1,0,0,1|0,0,1]=3 266 B13R0.444 CC(=O)NCCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0374 [0,0,1,0,0,1|1,0,1]=4 267 B13R0.444 CC(=O)NCCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB0374 [0,0,1,0,0,1|1,0,1]=4 268 B13R0.444 CC(C)CCCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB1301 [0,0,1,0,0,1|0,0,0]=2 269 B13R0.444 CC(C)CCCC(=O)N[C@H](C)C(=O)N WXVL_AK6986SB1301 [0,0,1,0,0,1|0,0,0]=2 270 B13R0.444 C[C@@H](NC(=O)CCCN(C)C)C(=O)N WXVL_AK6986SB00055 [0,0,1,0,0,1|1,0,0]=3 271 B13R0.444 C[C@@H](NC(=O)CCCN(C)C)C(=O)N WXVL_AK6986SB00055 [0,0,1,0,0,1|1,0,0]=3