0 B7R0.2 NCC(N)CC(=O)O CP05401 [0,0,0,0,0,0|2,0,0]=2 1 B7R0.2 NC[C@@H](N)CC(=O)O CP05403 [0,0,0,0,0,0|2,0,0]=2 2 B7R0.2 NC[C@H](N)CC(=O)O CP05402 [0,0,0,0,0,0|2,0,0]=2 3 B7R0.2 N[C@@H](CO)CC(=O)O CP25431 [0,0,0,0,0,0|2,0,0]=2 4 B7R0.2 N[C@H](CO)CC(=O)O CP25432 [0,0,0,0,0,0|2,0,0]=2 5 B6R0.2 CC(N)CC(=O)O CP03001 [1,0,0,0,0,0|1,0,0]=2 6 B6R0.2 C[C@@H](N)CC(=O)O CP03002 [1,0,0,0,0,0|1,0,0]=2 7 B6R0.2 C[C@@H](N)CC(=O)O CP27666 [1,0,0,0,0,0|1,0,0]=2 8 B6R0.2 C[C@H](N)CC(=O)O CP25916 [1,0,0,0,0,0|1,0,0]=2 9 B8R0.2 CCC(O)[C@H](N)C(=O)O CP07401 [0,1,0,0,0,0|1,0,0]=2 10 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O CP01204 [0,1,0,0,0,0|0,0,0]=1 11 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O CP01202 [0,1,0,0,0,0|0,0,0]=1 12 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O CP01201 [0,1,0,0,0,0|0,0,0]=1 13 B8R0.2 CC[C@H](C)[C@@H](O)C(=O)O AAD-094 [0,1,0,0,0,0|0,0,0]=1 14 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O CP01205 [0,1,0,0,0,0|0,0,0]=1 15 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O CP01206 [0,1,0,0,0,0|0,0,0]=1 16 B8R0.2 CC[C@H](C)[C@H](N)C(N)=O CP26155 [0,1,0,0,0,0|1,0,0]=2 17 B8R0.5 C=CC[C@H](N)CC(=O)O CP25693 [0,1,0,0,0,0|1,0,1]=3 18 B8R0.23 CC(C)[C@@H](N)CC(=O)O CP27724 [0,1,0,0,0,0|1,0,0]=2 19 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O CP27728 [0,1,0,0,0,0|1,0,0]=2 20 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O CP25514 [0,1,0,0,0,0|1,0,0]=2 21 B8R0.23 NC(=O)[C@@H](N)CC(=O)O CP26946 [0,1,0,0,0,0|2,0,1]=4 22 B8R0.23 NC(=O)[C@H](N)CC(=O)O CP26638 [0,1,0,0,0,0|2,0,1]=4 23 B8R0.23 N[C@@H](CC(=O)O)C(=O)O CP00403 [0,1,0,0,0,0|2,0,1]=4 24 B8R0.23 N[C@H](CC(=O)O)C(=O)O CP00401 [0,1,0,0,0,0|2,0,1]=4 25 B6R0.3 CC(CN)C(=O)O CP04001 [0,0,0,0,1,0|1,0,0]=2 26 B6R0.3 CCC(N)C(=O)O CP25922 [0,0,0,0,1,0|1,0,0]=2 27 B6R0.3 CCC(N)C(N)=O CP27406 [0,0,0,0,1,0|2,0,0]=3 28 B6R0.3 CCC(N)C(N)=O CP27452 [0,0,0,0,1,0|2,0,0]=3 29 B6R0.3 CC[C@@H](N)C(=O)O CP02901 [0,0,0,0,1,0|1,0,0]=2 30 B6R0.3 CC[C@H](N)C(=O)O CP02902 [0,0,0,0,1,0|1,0,0]=2 31 B6R0.3 CNC(C)C(=O)O CP27258 [0,0,0,0,1,0|1,0,0]=2 32 B6R0.3 CN[C@@H](C)C(=O)O CP00136 [0,0,0,0,1,0|1,0,0]=2 33 B6R0.3 CN[C@H](C)C(=O)O CP25724 [0,0,0,0,1,0|1,0,0]=2 34 B6R0.3 NC(=O)[C@@H](N)CO CP01835 [0,0,0,0,1,0|3,0,0]=4 35 B6R0.3 NC(CCl)C(=O)O CP27043 [0,0,0,0,1,0|2,0,0]=3 36 B6R0.3 NC(CF)C(=O)O CP26472 [0,0,0,0,1,0|2,0,0]=3 37 B6R0.3 NC(CO)C(=O)O CP01803 [0,0,0,0,1,0|2,0,0]=3 38 B6R0.3 NC(CS)C(=O)O CP00603 [0,0,0,0,1,0|2,0,0]=3 39 B6R0.3 NC(CS)C(=O)O CP00606 [0,0,0,0,1,0|2,0,0]=3 40 B6R0.3 NCC(N)C(=O)O CP05805 [0,0,0,0,1,0|2,0,0]=3 41 B6R0.3 NCC(N)C(=O)O CP25891 [0,0,0,0,1,0|2,0,0]=3 42 B6R0.3 NCC(O)C(=O)O CP07701 [0,0,0,0,1,0|2,0,0]=3 43 B6R0.3 NCC(O)C(=O)O CP25957 [0,0,0,0,1,0|2,0,0]=3 44 B6R0.3 NC[C@@H](N)C(=O)O CP05804 [0,0,0,0,1,0|2,0,0]=3 45 B6R0.3 N[C@@H](CCl)C(=O)O CP26931 [0,0,0,0,1,0|2,0,0]=3 46 B6R0.3 N[C@@H](CCl)C(=O)O CP27167 [0,0,0,0,1,0|2,0,0]=3 47 B6R0.3 N[C@@H](CO)C(=O)O CP01802 [0,0,0,0,1,0|2,0,0]=3 48 B6R0.3 N[C@@H](CS)C(=O)O CP00601 [0,0,0,0,1,0|2,0,0]=3 49 B6R0.3 N[C@H](CCl)C(=O)O AAD-009 [0,0,0,0,1,0|2,0,0]=3 50 B6R0.3 N[C@H](CCl)C(=O)O CP27166 [0,0,0,0,1,0|2,0,0]=3 51 B6R0.3 N[C@H](CO)C(=O)O CP01801 [0,0,0,0,1,0|2,0,0]=3 52 B6R0.3 N[C@H](CS)C(=O)O CP00602 [0,0,0,0,1,0|2,0,0]=3 53 B6R0.3 N[C@H](CS)C(=O)O CP00605 [0,0,0,0,1,0|2,0,0]=3 54 B6R0.3 N[C@H](CS)C(=O)O CP26755 [0,0,0,0,1,0|2,0,0]=3 55 B8R0.9 NCC(=O)NCC(=O)O CPC1660 [0,0,0,0,0,1|2,0,1]=4 56 B8R0.9 O=C(O)CNC(=O)CCl CP27298 [0,0,0,0,0,1|2,0,1]=4 57 B5R0.1 CNCC(=O)O CP09001 [2,0,0,0,0,0|1,0,0]=3 58 B5R0.1 CNCC(N)=O CP09005 [2,0,0,0,0,0|2,0,0]=4 59 B5R0.1 NCCC(=O)O CP02301 [2,0,0,0,0,0|1,0,0]=3 60 B5R0.1 NCCC(N)=O CP25964 [2,0,0,0,0,0|2,0,0]=4 61 B5R0.1 O=C(O)CCS CP25144 [2,0,0,0,0,0|1,0,0]=3 62 B7R0.10 CC[C@H](C)[C@H](N)CO CP26323 [1,1,0,0,0,0|0,0,1]=3 63 B7R0.16 CC(C)C(N)C(=O)O CP02203 [1,1,0,0,0,0|0,0,0]=2 64 B7R0.16 CC(C)C(O)C(=O)O CP26523 [1,1,0,0,0,0|0,0,0]=2 65 B7R0.16 CC(C)[C@@H](N)C(=O)O CP02201 [1,1,0,0,0,0|0,0,0]=2 66 B7R0.16 CC(C)[C@@H](O)C(=O)O CP26522 [1,1,0,0,0,0|0,0,0]=2 67 B7R0.16 CC(C)[C@H](N)C(=O)O CP02202 [1,1,0,0,0,0|0,0,0]=2 68 B7R0.16 CC(C)[C@H](N)C(N)=O CP27016 [1,1,0,0,0,0|1,0,0]=3 69 B7R0.16 CC(C)[C@H]([15NH2])C(=O)O CP27255 [1,1,0,0,0,0|0,0,0]=2 70 B7R0.16 CC(N)C(N)C(=O)O CP05201 [1,1,0,0,0,0|1,0,0]=3 71 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O CP05202 [1,1,0,0,0,0|1,0,0]=3 72 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O CP01904 [1,1,0,0,0,0|1,0,0]=3 73 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O CP01906 [1,1,0,0,0,0|1,0,0]=3 74 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O CP01902 [1,1,0,0,0,0|1,0,0]=3 75 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O CP01903 [1,1,0,0,0,0|1,0,0]=3 76 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O CP01935 [1,1,0,0,0,0|2,0,0]=4 77 B7R0.16 C[C@H](N)[C@@H](N)C(=O)O CP05203 [1,1,0,0,0,0|1,0,0]=3 78 B7R0.16 C[C@H](N)[C@H](N)C(=O)O CP05204 [1,1,0,0,0,0|1,0,0]=3 79 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O CP01901 [1,1,0,0,0,0|1,0,0]=3 80 B7R0.16 C[C@H](O)[C@H](N)C(=O)O CP01905 [1,1,0,0,0,0|1,0,0]=3 81 B7R0.4 C#CCNCC(=O)O CP25644 [1,1,0,0,0,0|0,0,2]=4 82 B7R0.4 C=CCNCC(=O)O CP25888 [1,1,0,0,0,0|0,0,2]=4 83 B7R0.4 NCCCCC(=O)O CP04601 [1,1,0,0,0,0|0,0,0]=2 84 B7R0.4 NCCNCC(=O)O CP26849 [1,1,0,0,0,0|1,0,0]=3 85 B7R0.6 CC(=O)NCC(=O)O CP00902 [1,1,0,0,0,0|1,0,1]=4 86 B7R0.13 CC(N)(CO)C(=O)O CP08401 [0,1,0,0,1,0|1,0,0]=3 87 B7R0.13 CC[C@@](C)(N)C(=O)O CP25733 [0,1,0,0,1,0|0,0,0]=2 88 B7R0.13 CC[C@](C)(N)C(=O)O CP25921 [0,1,0,0,1,0|0,0,0]=2 89 B7R0.13 CNC(C)(C)C(=O)O CP26896 [0,1,0,0,1,0|1,0,0]=3 90 B7R0.13 C[C@@](N)(CS)C(=O)O CP25649 [0,1,0,0,1,0|1,0,0]=3 91 B7R0.13 C[C@@](N)(CS)C(=O)O CP27633 [0,1,0,0,1,0|1,0,0]=3 92 B7R0.13 C[C@](N)(CS)C(=O)O CP25374 [0,1,0,0,1,0|1,0,0]=3 93 B7R0.15 CN[C@@H](CO)C(=O)O CP25655 [0,1,0,0,1,0|1,0,0]=3 94 B7R0.15 NC[C@@H](CO)C(=O)O CP02273 [0,1,0,0,1,0|1,0,0]=3 95 B7R0.15 NC[C@H](CO)C(=O)O CP02274 [0,1,0,0,1,0|1,0,0]=3 96 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O CP25627 [0,1,0,0,0,1|0,0,0]=2 97 B9R0.27 CC[C@H](C)[C@H](N)C(=O)NO CP26991 [0,2,0,0,0,0|0,0,0]=2 98 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC CP01227 [0,2,0,0,0,0|0,0,0]=2 99 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O CP01229 [0,2,0,0,0,0|0,0,0]=2 100 B9R0.79 CC(C(=O)O)C(N)C(=O)O CP08001 [0,2,0,0,0,0|1,0,1]=4 101 B9R0.4 CSCC[C@H](N)CC(=O)O CP26034 [0,2,0,0,0,0|1,0,0]=3 102 B9R0.4 CSCC[C@H](N)CC(=O)O CP27721 [0,2,0,0,0,0|1,0,0]=3 103 B9R0.53 CC(C)C[C@H](N)CC(=O)O CP26114 [0,2,0,0,0,0|1,0,0]=3 104 B9R0.53 NC(CC(=O)O)CC(=O)O CP25765 [0,2,0,0,0,0|1,0,1]=4 105 B9R0.39 CN[C@@H](CC(=O)O)C(=O)O CP27105 [0,2,0,0,0,0|1,0,1]=4 106 B9R0.39 CN[C@H](CC(=O)O)C(=O)O CP27313 [0,2,0,0,0,0|1,0,1]=4 107 B9R0.10 CC(C)(C)C(N)CC(=O)O CP02254 [0,2,0,0,0,0|1,0,0]=3 108 B9R0.11 C[C@@](N)(CC(=O)O)C(=O)O CP25360 [0,2,0,0,0,0|1,0,1]=4 109 B9R0.11 C[C@](N)(CC(=O)O)C(=O)O CP25749 [0,2,0,0,0,0|1,0,1]=4 110 B7R1.18 O=C(O)C1CNC1 CP20401 [1,0,0,1,0,0|1,0,0]=3 111 B7R1.18 O=C(O)[C@@H]1CCN1 CP20301 [1,0,0,1,0,0|1,0,0]=3 112 B7R1.19 NC1(C(=O)O)CC1 CP20101 [0,0,0,1,1,0|1,0,0]=3 113 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 CP26865 [0,0,0,1,0,1|2,0,0]=4 114 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 CP26850 [0,0,0,1,0,1|2,0,0]=4 115 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 CP01101 [0,0,0,1,0,1|2,0,0]=4 116 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 CP01104 [0,0,0,1,0,1|2,0,0]=4 117 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 CP01105 [0,0,0,1,0,1|2,0,0]=4 118 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 CP01102 [0,0,0,1,0,1|2,0,0]=4 119 B9R1.35 O=C1CC[C@@H](C(=O)O)N1 CP23101 [0,0,0,1,0,1|1,0,1]=4 120 B9R1.35 O=C1CC[C@H](C(=O)O)N1 CP25835 [0,0,0,1,0,1|1,0,1]=4 121 B9R1.41 CN1CCC[C@H]1C(=O)O CP27145 [0,1,0,1,0,0|1,0,0]=3 122 B9R1.13 O=C(O)C[C@@H]1CCCN1 CP25884 [0,1,0,1,0,0|0,0,0]=2 123 B9R1.13 O=C(O)C[C@H]1CCCN1 CP25847 [0,1,0,1,0,0|0,0,0]=2 124 B5R0.5 CC(N)C(=O)O CP00102 [1,0,0,0,1,0|1,0,0]=3 125 B5R0.5 C[C@@H](N)C(=O)O CP00101 [1,0,0,0,1,0|1,0,0]=3 126 B5R0.5 C[C@@H](N)C(N)=O CP00122 [1,0,0,0,1,0|2,0,0]=4 127 B5R0.5 C[C@@H](O)C(=O)O CP26143 [1,0,0,0,1,0|1,0,0]=3 128 B5R0.5 C[C@H](N)C(=O)O CP00103 [1,0,0,0,1,0|1,0,0]=3 129 B5R0.5 C[C@H](N)C(N)=O CP00123 [1,0,0,0,1,0|2,0,0]=4 130 B5R0.5 C[C@H](N)C(N)=O CP26136 [1,0,0,0,1,0|2,0,0]=4 131 B5R0.5 C[C@H](N)C(N)=O CP26240 [1,0,0,0,1,0|2,0,0]=4 132 B5R0.5 C[C@H]([15NH2])C(=O)O CP26898 [1,0,0,0,1,0|1,0,0]=3