0 B7R0.6 CC(=O)NCC(=O)O CP00902 [0,0,0,0,0,0|1,0,0]=1 1 B8R0.9 CNC(=O)CNC(C)=O CP27436 [0,1,0,0,0,0|2,0,0]=3 2 B8R0.9 NCC(=O)NCC(=O)O CPC1660 [0,1,0,0,0,0|1,0,0]=2 3 B8R0.9 O=C(O)CNC(=O)CCl CP27298 [0,1,0,0,0,0|1,0,0]=2 4 B8R0.23 C=C(C)C[C@H](N)C(=O)O CP27551 [0,1,0,0,0,0|1,0,0]=2 5 B8R0.23 CC(=O)NC(C)C(=O)O CP26194 [0,1,0,0,0,0|1,0,0]=2 6 B8R0.23 CC(=O)N[C@@H](C)C(=O)O CP00104 [0,1,0,0,0,0|1,0,0]=2 7 B8R0.23 CC(=O)N[C@@H](C)C(N)=O CP25410 [0,1,0,0,0,0|2,0,0]=3 8 B8R0.23 CC(=O)N[C@H](C)C(=O)O CP25527 [0,1,0,0,0,0|1,0,0]=2 9 B8R0.23 CC(=O)O[C@@H](C)C(=O)O OPO-051 [0,1,0,0,0,0|1,0,0]=2 10 B8R0.23 CC(=O)O[C@H](C)C(=O)O OPO-052 [0,1,0,0,0,0|1,0,0]=2 11 B8R0.23 CC(C)CC(N)C(=O)O CP01303 [0,1,0,0,0,0|1,0,1]=3 12 B8R0.23 CC(C)CC(N)C(N)=O CP26156 [0,1,0,0,0,0|2,0,1]=4 13 B8R0.23 CC(C)C[C@@H](N)C(=O)O CP01301 [0,1,0,0,0,0|1,0,1]=3 14 B8R0.23 CC(C)C[C@@H](N)C(N)=O CP26058 [0,1,0,0,0,0|2,0,1]=4 15 B8R0.23 CC(C)C[C@@H](N)C(N)=O CP26436 [0,1,0,0,0,0|2,0,1]=4 16 B8R0.23 CC(C)C[C@@H](O)C(=O)O CP26746 [0,1,0,0,0,0|1,0,1]=3 17 B8R0.23 CC(C)C[C@H](N)C(=O)O CP01302 [0,1,0,0,0,0|1,0,1]=3 18 B8R0.23 CC(C)C[C@H](N)C(N)=O CP01322 [0,1,0,0,0,0|2,0,1]=4 19 B8R0.23 CC(C)C[C@H](N)C(N)=O CP27361 [0,1,0,0,0,0|2,0,1]=4 20 B8R0.23 CC(C)C[C@H](O)C(=O)O CP26351 [0,1,0,0,0,0|1,0,1]=3 21 B8R0.23 CC(C)C[C@H]([15NH2])C(=O)O CP27256 [0,1,0,0,0,0|1,0,1]=3 22 B8R0.23 CC(C)[C@@H](N)CC(=O)O CP27724 [0,1,0,0,0,0|1,0,1]=3 23 B8R0.23 CC(NC(N)=O)C(=O)O CP27459 [0,1,0,0,0,0|2,0,0]=3 24 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O CP27728 [0,1,0,0,0,0|0,0,2]=3 25 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O CP25514 [0,1,0,0,0,0|0,0,2]=3 26 B8R0.23 NC(=O)CC(N)C(=O)O CP00305 [0,1,0,0,0,0|1,0,0]=2 27 B8R0.23 NC(=O)C[C@@H](N)C(=O)O CP00301 [0,1,0,0,0,0|1,0,0]=2 28 B8R0.23 NC(=O)C[C@@H](N)C(=O)O CP00302 [0,1,0,0,0,0|1,0,0]=2 29 B8R0.23 NC(=O)C[C@H](N)C(=O)O CP00303 [0,1,0,0,0,0|1,0,0]=2 30 B8R0.23 NC(=O)C[C@H](N)C(=O)O CP00304 [0,1,0,0,0,0|1,0,0]=2 31 B8R0.23 NC(=O)C[C@H](N)C(N)=O CP25912 [0,1,0,0,0,0|2,0,0]=3 32 B8R0.23 NC(=O)[C@@H](N)CC(=O)O CP26946 [0,1,0,0,0,0|1,0,0]=2 33 B8R0.23 NC(=O)[C@H](N)CC(=O)O CP26638 [0,1,0,0,0,0|1,0,0]=2 34 B8R0.23 N[C@@H](CC(=O)O)C(=O)O CP00403 [0,1,0,0,0,0|1,0,0]=2 35 B8R0.23 N[C@H](CC(=O)O)C(=O)O CP00401 [0,1,0,0,0,0|1,0,0]=2 36 B8R1.3 O=C1CNC(=O)CN1 CP25141 [0,0,0,1,0,0|2,0,0]=3 37 B6R0.2 CC(N)CC(=O)O CP03001 [0,0,0,0,1,0|1,0,1]=3 38 B6R0.2 C[C@@H](N)CC(=O)O CP03002 [0,0,0,0,1,0|1,0,1]=3 39 B6R0.2 C[C@@H](N)CC(=O)O CP27666 [0,0,0,0,1,0|1,0,1]=3 40 B6R0.2 C[C@H](N)CC(=O)O CP25916 [0,0,0,0,1,0|1,0,1]=3 41 B8R0.28 CC(=O)NCCC(=O)O CP25731 [0,0,0,0,0,1|0,0,0]=1 42 B8R0.28 NC(=O)NCCC(=O)O CP27137 [0,0,0,0,0,1|1,0,0]=2 43 B5R0.1 CNCC(=O)O CP09001 [2,0,0,0,0,0|1,0,0]=3 44 B5R0.1 CNCC(N)=O CP09005 [2,0,0,0,0,0|2,0,0]=4 45 B5R0.1 NCCC(=O)O CP02301 [2,0,0,0,0,0|1,0,0]=3 46 B5R0.1 NCCC(N)=O CP25964 [2,0,0,0,0,0|2,0,0]=4 47 B5R0.1 O=C(O)CCS CP25144 [2,0,0,0,0,0|0,1,0]=3 48 B7R0.2 NCC(N)CC(=O)O CP05401 [1,1,0,0,0,0|1,0,1]=4 49 B7R0.2 NC[C@@H](N)CC(=O)O CP05403 [1,1,0,0,0,0|1,0,1]=4 50 B7R0.2 NC[C@H](N)CC(=O)O CP05402 [1,1,0,0,0,0|1,0,1]=4 51 B7R0.2 N[C@@H](CO)CC(=O)O CP25431 [1,1,0,0,0,0|0,0,2]=4 52 B7R0.2 N[C@H](CO)CC(=O)O CP25432 [1,1,0,0,0,0|0,0,2]=4 53 B7R0.4 C#CCNCC(=O)O CP25644 [1,1,0,0,0,0|0,0,2]=4 54 B7R0.4 C=CCNCC(=O)O CP25888 [1,1,0,0,0,0|0,0,1]=3 55 B7R0.4 NCCCCC(=O)O CP04601 [1,1,0,0,0,0|0,0,1]=3 56 B7R0.4 NCCNCC(=O)O CP26849 [1,1,0,0,0,0|1,0,1]=4 57 B7R0.5 C#CCC(N)C(=O)O CP08903 [1,1,0,0,0,0|0,0,2]=4 58 B7R0.5 C#CC[C@@H](N)C(=O)O CP08902 [1,1,0,0,0,0|0,0,2]=4 59 B7R0.5 C#CC[C@H](N)C(=O)O CP08901 [1,1,0,0,0,0|0,0,2]=4 60 B7R0.5 C#CC[C@H](N)C(=O)O CP25643 [1,1,0,0,0,0|0,0,2]=4 61 B7R0.5 C=CCC(N)C(=O)O CP02601 [1,1,0,0,0,0|0,0,1]=3 62 B7R0.5 C=CC[C@@H](N)C(=O)O CP02603 [1,1,0,0,0,0|0,0,1]=3 63 B7R0.5 C=CC[C@H](N)C(=O)O CP02602 [1,1,0,0,0,0|0,0,1]=3 64 B7R0.5 C=CC[C@H](N)C(=O)O CP25426 [1,1,0,0,0,0|0,0,1]=3 65 B7R0.5 CCC[C@@H](N)C(=O)O CP25568 [1,1,0,0,0,0|0,0,1]=3 66 B7R0.5 CCC[C@H](N)C(=O)O CP08602 [1,1,0,0,0,0|0,0,1]=3 67 B7R0.5 CCC[C@H](N)C(N)=O CP26135 [1,1,0,0,0,0|1,0,1]=4 68 B7R0.5 CSC[C@H](N)C(=O)O CP08101 [1,1,0,0,0,0|1,0,0]=3 69 B7R0.5 N#CC[C@H](N)C(=O)O CP25947 [1,1,0,0,0,0|1,0,1]=4 70 B7R0.5 NC(CCO)C(=O)O CP06601 [1,1,0,0,0,0|0,0,2]=4 71 B7R0.5 NCCC(N)C(=O)O CP05302 [1,1,0,0,0,0|1,0,1]=4 72 B7R0.5 NCC[C@@H](N)C(=O)O CP05301 [1,1,0,0,0,0|1,0,1]=4 73 B7R0.5 NCC[C@@H](N)C(=O)O CP05304 [1,1,0,0,0,0|1,0,1]=4 74 B7R0.5 N[C@@H](CCO)C(=O)O CP06602 [1,1,0,0,0,0|0,0,2]=4 75 B7R0.5 N[C@@H](CCS)C(=O)O CP06302 [1,1,0,0,0,0|0,1,1]=4 76 B7R0.5 N[C@H](CCO)C(=O)O CP25926 [1,1,0,0,0,0|0,0,2]=4 77 B7R0.16 CC(C)C(N)C(=O)O CP02203 [0,1,0,0,1,0|1,0,1]=4 78 B7R0.16 CC(C)C(O)C(=O)O CP26523 [0,1,0,0,1,0|1,0,1]=4 79 B7R0.16 CC(C)[C@@H](N)C(=O)O CP02201 [0,1,0,0,1,0|1,0,1]=4 80 B7R0.16 CC(C)[C@@H](O)C(=O)O CP26522 [0,1,0,0,1,0|1,0,1]=4 81 B7R0.16 CC(C)[C@H](N)C(=O)O CP02202 [0,1,0,0,1,0|1,0,1]=4 82 B7R0.16 CC(C)[C@H]([15NH2])C(=O)O CP27255 [0,1,0,0,1,0|1,0,1]=4 83 B7R0.16 CC(N)C(N)C(=O)O CP05201 [0,1,0,0,1,0|1,0,1]=4 84 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O CP05202 [0,1,0,0,1,0|1,0,1]=4 85 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O CP01904 [0,1,0,0,1,0|0,0,2]=4 86 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O CP01906 [0,1,0,0,1,0|0,0,2]=4 87 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O CP01902 [0,1,0,0,1,0|0,0,2]=4 88 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O CP01903 [0,1,0,0,1,0|0,0,2]=4 89 B7R0.16 C[C@H](N)[C@@H](N)C(=O)O CP05203 [0,1,0,0,1,0|1,0,1]=4 90 B7R0.16 C[C@H](N)[C@H](N)C(=O)O CP05204 [0,1,0,0,1,0|1,0,1]=4 91 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O CP01901 [0,1,0,0,1,0|0,0,2]=4 92 B7R0.16 C[C@H](O)[C@H](N)C(=O)O CP01905 [0,1,0,0,1,0|0,0,2]=4 93 B7R0.16 NC(C(=O)O)C(=O)O CP04101 [0,1,0,0,1,0|1,0,0]=3 94 B9R0.1 COC(=O)CCNC(C)=O CP25740 [0,1,0,0,0,1|0,0,0]=2 95 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O CP26697 [0,1,0,0,0,1|0,0,0]=2 96 B9R0.7 CC(=O)OC[C@H](N)C(=O)O CP27345 [0,1,0,0,0,1|0,0,0]=2 97 B9R0.7 CS(=O)CC[C@H](N)C(=O)O CP26995 [0,1,0,0,0,1|1,0,0]=3 98 B9R0.7 NC(=O)CCC(N)C(=O)O CP00803 [0,1,0,0,0,1|1,0,0]=3 99 B9R0.7 NC(=O)CC[C@@H](N)C(=O)O CP00801 [0,1,0,0,0,1|1,0,0]=3 100 B9R0.7 NC(=O)CC[C@@H](N)C(N)=O CP26661 [0,1,0,0,0,1|2,0,0]=4 101 B9R0.7 NC(=O)CC[C@H](N)C(=O)O CP00802 [0,1,0,0,0,1|1,0,0]=3 102 B9R0.7 NC(=O)CC[C@H](N)C(=O)O CPC1661 [0,1,0,0,0,1|1,0,0]=3 103 B9R0.7 NC(=O)CC[C@H](N)C(N)=O CP26796 [0,1,0,0,0,1|2,0,0]=4 104 B9R0.7 NC(=O)NC[C@H](N)C(=O)O CP25373 [0,1,0,0,0,1|1,0,0]=3 105 B9R0.7 NC(=O)SC[C@H](N)C(=O)O CP26756 [0,1,0,0,0,1|1,0,0]=3 106 B9R0.7 NC(=O)[C@@H](N)CCC(=O)O CP27307 [0,1,0,0,0,1|1,0,0]=3 107 B9R0.7 NC(=O)[C@H](N)CCC(=O)O CP26595 [0,1,0,0,0,1|1,0,0]=3 108 B9R0.7 N[C@@H](CCC(=O)O)C(=O)O CP00702 [0,1,0,0,0,1|1,0,0]=3 109 B9R0.7 N[C@H](CCC(=O)O)C(=O)O CP00701 [0,1,0,0,0,1|1,0,0]=3 110 B9R0.53 CC(C)C[C@H](N)CC(=O)O CP26114 [0,1,0,0,0,1|1,0,1]=4 111 B9R0.53 NC(CC(=O)O)CC(=O)O CP25765 [0,1,0,0,0,1|1,0,0]=3 112 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O CP25627 [0,2,0,0,0,0|1,0,1]=4 113 B9R0.23 CNC(=O)[C@H](C)NC(C)=O CP26601 [0,2,0,0,0,0|2,0,0]=4 114 B9R0.23 COC(=O)C(N)CC(=O)O CP27329 [0,2,0,0,0,0|0,0,0]=2 115 B9R0.23 COC(=O)C(N)CC(C)C CP27299 [0,2,0,0,0,0|1,0,1]=4 116 B9R0.23 COC(=O)[C@@H](C)NC(C)=O CP25548 [0,2,0,0,0,0|1,0,0]=3 117 B9R0.23 COC(=O)[C@@H](N)CC(=O)O CP26541 [0,2,0,0,0,0|0,0,0]=2 118 B9R0.23 COC(=O)[C@@H](N)CC(C)C CP01331 [0,2,0,0,0,0|1,0,1]=4 119 B9R0.23 COC(=O)[C@@H](N)CC(N)=O CP27227 [0,2,0,0,0,0|1,0,0]=3 120 B9R0.23 COC(=O)[C@H](N)CC(=O)O CP27330 [0,2,0,0,0,0|0,0,0]=2 121 B9R0.23 COC(=O)[C@H](N)CC(C)C CP01330 [0,2,0,0,0,0|1,0,1]=4 122 B9R0.42 COC(=O)CC(N)C(=O)O CP26555 [0,2,0,0,0,0|0,0,0]=2 123 B9R0.42 COC(=O)C[C@@H](N)C(=O)O CP26775 [0,2,0,0,0,0|0,0,0]=2 124 B9R0.42 COC(=O)C[C@H](N)C(=O)O CP00445 [0,2,0,0,0,0|0,0,0]=2 125 B9R0.10 CC(C)(C)C(N)CC(=O)O CP02254 [0,2,0,0,0,0|1,0,1]=4 126 B9R0.11 CC(C)CC(C)(N)C(=O)O CP26383 [0,2,0,0,0,0|1,0,1]=4 127 B9R0.11 CC(C)C[C@@](C)(N)C(=O)O CP27713 [0,2,0,0,0,0|1,0,1]=4 128 B9R0.11 CC(C)C[C@](C)(N)C(=O)O CP25139 [0,2,0,0,0,0|1,0,1]=4 129 B9R0.11 C[C@@](N)(CC(=O)O)C(=O)O CP25360 [0,2,0,0,0,0|1,0,0]=3 130 B9R0.11 C[C@](N)(CC(=O)O)C(=O)O CP25749 [0,2,0,0,0,0|1,0,0]=3 131 B9R0.39 CC(=O)N[C@@H](CS)C(=O)O 10-101-106 [0,2,0,0,0,0|1,0,0]=3 132 B9R0.39 CC[C@@H](NC(C)=O)C(=O)O CP02903 [0,2,0,0,0,0|1,0,0]=3 133 B9R0.39 CNC(CC(C)C)C(=O)O CP26895 [0,2,0,0,0,0|1,0,1]=4 134 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O CP27105 [0,2,0,0,0,0|1,0,0]=3 135 B9R0.39 CN[C@@H](CC(C)C)C(=O)O CP25734 [0,2,0,0,0,0|1,0,1]=4 136 B9R0.39 CN[C@H](CC(=O)O)C(=O)O CP27313 [0,2,0,0,0,0|1,0,0]=3 137 B9R0.57 CC(C)(C)CC(N)C(=O)O CP26166 [0,2,0,0,0,0|1,0,1]=4 138 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O CP26087 [0,2,0,0,0,0|1,0,1]=4 139 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O CP25910 [0,2,0,0,0,0|1,0,1]=4 140 B9R0.57 N[C@@H](CS(=O)(=O)O)C(=O)O CP00610 [0,2,0,0,0,0|2,0,0]=4 141 B9R0.79 CC(C(=O)O)C(N)C(=O)O CP08001 [0,2,0,0,0,0|1,0,0]=3 142 B9R0.79 NC(C(=O)O)C(N)C(=O)O CP05901 [0,2,0,0,0,0|1,0,0]=3 143 B9R0.79 NC(C(=O)O)C(N)C(=O)O CP05903 [0,2,0,0,0,0|1,0,0]=3 144 B9R0.79 N[C@@H](C(=O)O)[C@@H](O)C(=O)O CP06704 [0,2,0,0,0,0|1,0,0]=3 145 B9R0.79 N[C@@H](C(=O)O)[C@@H](O)C(=O)O CP06705 [0,2,0,0,0,0|1,0,0]=3 146 B9R0.79 N[C@@H](C(=O)O)[C@H](O)C(=O)O CP06703 [0,2,0,0,0,0|1,0,0]=3 147 B9R0.79 N[C@H](C(=O)O)[C@@H](N)C(=O)O CP05902 [0,2,0,0,0,0|1,0,0]=3 148 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(=O)O CP06702 [0,2,0,0,0,0|1,0,0]=3 149 B7R1.3 O=C1CCSCC1 HB00136 [1,0,0,1,0,0|2,0,0]=4 150 B7R1.18 O=C(O)C1CNC1 CP20401 [1,0,0,1,0,0|1,0,0]=3 151 B7R1.18 O=C(O)[C@@H]1CCN1 CP20301 [1,0,0,1,0,0|1,0,1]=4 152 B9R1.35 NC1=NC(C(=O)O)CS1 CP25616 [0,0,0,1,0,1|2,0,0]=4 153 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 CP26865 [0,0,0,1,0,1|1,0,1]=4 154 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 CP26850 [0,0,0,1,0,1|1,0,1]=4 155 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 CP01101 [0,0,0,1,0,1|0,0,2]=4 156 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 CP01104 [0,0,0,1,0,1|0,0,2]=4 157 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 CP01105 [0,0,0,1,0,1|0,0,2]=4 158 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 CP01102 [0,0,0,1,0,1|0,0,2]=4 159 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 CP23101 [0,0,0,1,0,1|1,0,0]=3 160 B9R1.35 O=C1CC[C@H](C(=O)O)N1 CP25835 [0,0,0,1,0,1|1,0,0]=3 161 B9R1.35 O=C1N[C@H](C(=O)O)CS1 CP26611 [0,0,0,1,0,1|1,0,0]=3 162 B9R1.112 N[C@@H](CC1CC1)C(=O)O CP21301 [0,1,0,1,0,0|1,0,1]=4 163 B9R1.112 N[C@H](CC1CC1)C(=O)O CP21302 [0,1,0,1,0,0|1,0,1]=4 164 B5R0.5 CC(N)C(=O)O CP00102 [0,0,0,0,2,0|1,0,1]=4 165 B5R0.5 C[C@@H](N)C(=O)O CP00101 [0,0,0,0,2,0|1,0,1]=4 166 B5R0.5 C[C@@H](O)C(=O)O CP26143 [0,0,0,0,2,0|0,0,2]=4 167 B5R0.5 C[C@H](N)C(=O)O CP00103 [0,0,0,0,2,0|1,0,1]=4 168 B5R0.5 C[C@H]([15NH2])C(=O)O CP26898 [0,0,0,0,2,0|1,0,1]=4