0 B9R1.35 CC(=O)N1CCC(I)C1 Q57221 [0,0,0,0,0,0|4,0,0]=4 1 B9R1.35 CC(=O)N1CCC(N)C1 L14137 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.35 CC(=O)N1CC[C@@H](N)C1 P43139 [0,0,0,0,0,0|4,0,0]=4 3 B9R1.35 CC(=O)N1CC[C@@H](O)C1 G-5907 [0,0,0,0,0,0|3,0,0]=3 4 B9R1.35 CC(=O)N1CC[C@H](N)C1 P43073 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.35 CN1CCC(C(=O)O)C1 O28273 [0,0,0,0,0,0|3,0,0]=3 6 B9R1.35 CN1CCC(C(=O)O)C1 O30600 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.35 CN1CC[C@@H](C(=O)O)C1 G-6130 [0,0,0,0,0,0|3,0,0]=3 8 B9R1.35 CN1CC[C@@H](C(=O)O)C1 G-6130-01 [0,0,0,0,0,0|3,0,0]=3 9 B9R1.35 CN1CC[C@H](C(=O)O)C1 G-6129 [0,0,0,0,0,0|3,0,0]=3 10 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 O32949 [0,0,0,0,0,0|3,0,0]=3 11 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 Q53020 [0,0,0,0,0,0|3,0,0]=3 12 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Q53019 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Q52436 [0,0,0,0,0,0|3,0,0]=3 14 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Q52437 [0,0,0,0,0,0|3,0,0]=3 15 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 O32956 [0,0,0,0,0,0|3,0,0]=3 16 B9R1.35 C[C@H]1CN[C@H](C(=O)O)C1 Q52337 [0,0,0,0,0,0|1,0,0]=1 17 B9R1.35 NC(=O)N1CCC(N)C1 Q59176 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.35 NC1CCC(C(=O)O)C1 G-7403 [0,0,0,0,0,0|2,0,0]=2 19 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 10009 [0,0,0,0,0,0|2,0,0]=2 20 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 F-4734 [0,0,0,0,0,0|2,0,0]=2 21 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 L21283 [0,0,0,0,0,0|2,0,0]=2 22 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 P39234 [0,0,0,0,0,0|1,0,0]=1 23 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 P40794 [0,0,0,0,0,0|1,0,0]=1 24 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 10164 [0,0,0,0,0,0|2,0,0]=2 25 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 P44640 [0,0,0,0,0,0|2,0,0]=2 26 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 L21252 [0,0,0,0,0,0|2,0,0]=2 27 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Q52275 [0,0,0,0,0,0|2,0,0]=2 28 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 A-335 [0,0,0,0,0,0|1,0,0]=1 29 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Q61690 [0,0,0,0,0,0|1,0,0]=1 30 B9R1.35 O=C(O)C1CC(Br)=NO1 O32382 [0,0,0,0,0,0|3,0,1]=4 31 B9R1.35 O=C(O)C1CCC(F)C1 Q54410 [0,0,0,0,0,0|2,0,0]=2 32 B9R1.35 O=C(O)C1C[C@H](O)CN1 A-345 [0,0,0,0,0,0|0,0,0]=0 33 B9R1.35 O=C(O)[C@@H]1CC[C@@H](F)C1 Q61734 [0,0,0,0,0,0|2,0,0]=2 34 B9R1.35 O=C(O)[C@@H]1CC[C@@H](F)C1 Q63412 [0,0,0,0,0,0|2,0,0]=2 35 B9R1.35 O=C(O)[C@@H]1CC[C@@H](O)C1 Q63408 [0,0,0,0,0,0|1,0,0]=1 36 B9R1.35 O=C(O)[C@@H]1CC[C@H](F)C1 Q61733 [0,0,0,0,0,0|2,0,0]=2 37 B9R1.35 O=C(O)[C@@H]1CC[C@H](F)C1 Q63414 [0,0,0,0,0,0|2,0,0]=2 38 B9R1.35 O=C(O)[C@@H]1CC[C@H](O)C1 Q63410 [0,0,0,0,0,0|1,0,0]=1 39 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 A-341 [0,0,0,0,0,0|1,0,0]=1 40 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 G-6984 [0,0,0,0,0,0|1,0,0]=1 41 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CN1 A-344 [0,0,0,0,0,0|0,0,0]=0 42 B9R1.35 O=C(O)[C@@H]1C[C@@H](S)CN1 L21815 [0,0,0,0,0,0|0,1,0]=1 43 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 O30697 [0,0,0,0,0,0|0,0,0]=0 44 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 L22413 [0,0,0,0,0,0|0,1,0]=1 45 B9R1.35 O=C(O)[C@H]1CC[C@@H](F)C1 Q63413 [0,0,0,0,0,0|2,0,0]=2 46 B9R1.35 O=C(O)[C@H]1CC[C@@H](O)C1 Q63409 [0,0,0,0,0,0|1,0,0]=1 47 B9R1.35 O=C(O)[C@H]1CC[C@H](F)C1 Q63411 [0,0,0,0,0,0|2,0,0]=2 48 B9R1.35 O=C(O)[C@H]1CC[C@H](O)C1 Q63407 [0,0,0,0,0,0|1,0,0]=1 49 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 H-8063 [0,0,0,0,0,0|1,0,0]=1 50 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 H-8063-01 [0,0,0,0,0,0|1,0,0]=1 51 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 L13532 [0,0,0,0,0,0|0,0,0]=0 52 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 G-7739 [0,0,0,0,0,0|1,0,0]=1 53 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 P41300 [0,0,0,0,0,0|0,0,0]=0 54 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 P44659 [0,0,0,0,0,0|0,0,0]=0 55 B9R1.35 O=C1CC(C(=O)O)CN1 L13527 [0,0,0,0,0,0|2,0,2]=4 56 B9R1.35 O=C1CCC(C(=O)O)C1 G-6041 [0,0,0,0,0,0|1,0,2]=3 57 B9R1.35 O=C1CCC(C(=O)O)S1 I-9617 [0,0,0,0,0,0|2,0,2]=4 58 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 L13054 [0,0,0,0,0,0|1,0,2]=3 59 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 G-7802 [0,0,0,0,0,0|2,0,2]=4 60 B9R1.35 O=C1CC[C@H](C(=O)O)C1 L13053 [0,0,0,0,0,0|1,0,2]=3 61 B9R1.35 O=C1CNC(C(=O)O)C1 L14145 [0,0,0,0,0,0|0,0,2]=2 62 B9R1.35 O=C1C[C@H](C(=O)O)CN1 L14979 [0,0,0,0,0,0|2,0,2]=4 63 B9R1.35 O[C@@H]1CN[C@H](C(F)F)C1 Q64936 [0,0,0,0,0,0|2,0,1]=3 64 B8R1.1 COC1CCC(O)C1 Q57014 [1,0,0,0,0,0|3,0,0]=4 65 B8R1.1 CO[C@@H]1CC[C@@H](O)C1 Q56989 [1,0,0,0,0,0|3,0,0]=4 66 B8R1.1 CO[C@@H]1CC[C@H](O)C1 Q57013 [1,0,0,0,0,0|3,0,0]=4 67 B8R1.1 C[C@@H]1CN[C@H](CO)C1 Q64749 [1,0,0,0,0,0|1,0,1]=3 68 B8R1.1 N#C[C@@H]1C[C@@H](F)CN1 Q63522 [1,0,0,0,0,0|2,0,1]=4 69 B8R1.1 N#C[C@@H]1C[C@H](F)CN1 P45626 [1,0,0,0,0,0|2,0,1]=4 70 B8R1.1 N#C[C@@H]1C[C@H](F)CN1 Q54492 [1,0,0,0,0,0|2,0,1]=4 71 B8R1.1 N#C[C@H]1C[C@@H](F)CN1 Q63523 [1,0,0,0,0,0|2,0,1]=4 72 B8R1.1 N#C[C@H]1C[C@H](F)CN1 Q63524 [1,0,0,0,0,0|2,0,1]=4 73 B8R1.1 N#C[C@H]1C[C@H](O)CN1 Q64935 [1,0,0,0,0,0|1,0,1]=3 74 B8R1.1 NCC1CC(O)CN1 Q59300 [1,0,0,0,0,0|1,0,1]=3 75 B8R1.1 NC[C@@H]1CC[C@@H](O)C1 Q57119 [1,0,0,0,0,0|2,0,1]=4 76 B8R1.1 NC[C@@H]1CC[C@H](O)C1 Q57118 [1,0,0,0,0,0|2,0,1]=4 77 B8R1.1 NC[C@H]1CC[C@@H](O)C1 Q57121 [1,0,0,0,0,0|2,0,1]=4 78 B8R1.1 NC[C@H]1CC[C@H](O)C1 Q57120 [1,0,0,0,0,0|2,0,1]=4 79 B8R1.1 O=CC1CCC(O)C1 Q56985 [1,0,0,0,0,0|1,0,0]=2 80 B8R1.1 OCC1CC(O)CN1 Q59342 [1,0,0,0,0,0|0,0,1]=2 81 B8R1.1 OCC1CCC(F)C1 Q52910 [1,0,0,0,0,0|2,0,1]=4 82 B8R1.1 OC[C@@H]1CC[C@@H](F)C1 Q52912 [1,0,0,0,0,0|2,0,1]=4 83 B8R1.1 OC[C@@H]1C[C@@H](F)CN1 Q61815 [1,0,0,0,0,0|1,0,1]=3 84 B8R1.1 OC[C@@H]1C[C@@H](O)CN1 H-8224 [1,0,0,0,0,0|0,0,1]=2 85 B8R1.1 OC[C@@H]1C[C@@H](O)CN1 L13519 [1,0,0,0,0,0|0,0,1]=2 86 B8R1.1 OC[C@@H]1C[C@H](F)CN1 H-8865 [1,0,0,0,0,0|1,0,1]=3 87 B8R1.1 OC[C@@H]1C[C@H](O)CN1 P48680 [1,0,0,0,0,0|0,0,1]=2 88 B8R1.1 OC[C@H]1CC[C@@H](F)C1 Q52911 [1,0,0,0,0,0|2,0,1]=4 89 B8R1.1 OC[C@H]1C[C@@H](F)CN1 Q61817 [1,0,0,0,0,0|1,0,1]=3 90 B8R1.1 OC[C@H]1C[C@H](F)CN1 Q61816 [1,0,0,0,0,0|1,0,1]=3 91 B8R1.1 OC[C@H]1C[C@H](O)CN1 Q61647 [1,0,0,0,0,0|0,0,1]=2 92 B8R1.7 CC(=O)C1CCCN1 P37169 [1,0,0,0,0,0|1,0,0]=2 93 B8R1.7 CC(=O)C1CCCN1 Q61985 [1,0,0,0,0,0|1,0,0]=2 94 B8R1.7 CC(=O)C1CCNC1 O31491 [1,0,0,0,0,0|3,0,0]=4 95 B8R1.7 CC(=O)C1NCCS1 M15825 [1,0,0,0,0,0|2,0,0]=3 96 B8R1.7 CC(=O)[C@@H]1CCCN1 Q61986 [1,0,0,0,0,0|1,0,0]=2 97 B8R1.7 CC(=O)[C@@H]1CCCN1 Q62844 [1,0,0,0,0,0|1,0,0]=2 98 B8R1.7 CC(=O)[C@H]1CCCN1 Q62845 [1,0,0,0,0,0|1,0,0]=2 99 B8R1.7 CC(C)[C@@H]1CCCN1 L22352 [1,0,0,0,0,0|2,0,1]=4 100 B8R1.7 CC(C)[C@H]1CCCN1 Q55562 [1,0,0,0,0,0|2,0,1]=4 101 B8R1.7 C[C@H](O)C1CCCC1 Q59154 [1,0,0,0,0,0|2,0,1]=4 102 B8R1.7 FC(F)C1CCCN1 L13243 [1,0,0,0,0,0|2,0,1]=4 103 B8R1.7 FC(F)[C@@H]1CCCN1 L13410 [1,0,0,0,0,0|2,0,1]=4 104 B8R1.7 FC(F)[C@@H]1CCCN1 Q59180 [1,0,0,0,0,0|2,0,1]=4 105 B8R1.7 FC(F)[C@H]1CCCN1 Q52280 [1,0,0,0,0,0|2,0,1]=4 106 B8R1.7 NC(=O)C1CCCC1 P38833 [1,0,0,0,0,0|2,0,0]=3 107 B8R1.7 NC(=O)C1CCCN1 P39079 [1,0,0,0,0,0|1,0,0]=2 108 B8R1.7 NC(=O)C1CCCN1 P42514 [1,0,0,0,0,0|1,0,0]=2 109 B8R1.7 NC(=O)C1CCNC1 G-5260 [1,0,0,0,0,0|3,0,0]=4 110 B8R1.7 NC(=O)C1CCOC1 G-6625 [1,0,0,0,0,0|3,0,0]=4 111 B8R1.7 NC(=O)[C@@H]1CCCN1 I-9393 [1,0,0,0,0,0|1,0,0]=2 112 B8R1.7 NC(=O)[C@@H]1CCCN1 P45231 [1,0,0,0,0,0|1,0,0]=2 113 B8R1.7 NC(=O)[C@@H]1CCNC1 G-5262 [1,0,0,0,0,0|3,0,0]=4 114 B8R1.7 NC(=O)[C@@H]1CCNC1 G-7539 [1,0,0,0,0,0|3,0,0]=4 115 B8R1.7 NC(=O)[C@H]1CCNC1 G-5261 [1,0,0,0,0,0|3,0,0]=4 116 B8R1.7 NC(=O)[C@H]1CCNC1 Q51836 [1,0,0,0,0,0|3,0,0]=4 117 B8R1.7 O=C(O)C1=COCC1 C-2964 [1,0,0,0,0,0|2,0,1]=4 118 B8R1.7 O=C(O)C1CC=CC1 G-6381 [1,0,0,0,0,0|1,0,2]=4 119 B8R1.7 O=C(O)C1CCNC1 G-5249 [1,0,0,0,0,0|2,0,0]=3 120 B8R1.7 O=C(O)C1CCOC1 C-3386 [1,0,0,0,0,0|2,0,0]=3 121 B8R1.7 O=C(O)C1SCCS1 L19481 [1,0,0,0,0,0|2,0,0]=3 122 B8R1.7 O=C(O)[C@@H]1C=CCN1 P39990 [1,0,0,0,0,0|0,0,2]=3 123 B8R1.7 O=C(O)[C@@H]1CCCN1 L13796 [1,0,0,0,0,0|0,0,0]=1 124 B8R1.7 O=C(O)[C@@H]1CCNC1 L18435 [1,0,0,0,0,0|2,0,0]=3 125 B8R1.7 O=C(O)[C@@H]1CCNC1 Q51834 [1,0,0,0,0,0|2,0,0]=3 126 B8R1.7 O=C(O)[C@@H]1CCOC1 C-2786 [1,0,0,0,0,0|2,0,0]=3 127 B8R1.7 O=C(O)[C@H]1C=CCN1 M22943 [1,0,0,0,0,0|0,0,2]=3 128 B8R1.7 O=C(O)[C@H]1CCNC1 G-5250 [1,0,0,0,0,0|2,0,0]=3 129 B8R1.7 O=C(O)[C@H]1CCNC1 P45277 [1,0,0,0,0,0|2,0,0]=3 130 B8R1.7 O=C(O)[C@H]1CCOC1 C-2785 [1,0,0,0,0,0|2,0,0]=3 131 B10R1.14 CCC(=O)N1CCC(O)C1 Q59265 [0,1,0,0,0,0|3,0,0]=4 132 B10R1.14 CNC(=O)[C@@H]1CC[C@@H](N)C1 K13472 [0,1,0,0,0,0|3,0,0]=4 133 B10R1.14 COC(=O)C1CC(O)CN1 Q59355 [0,1,0,0,0,0|0,0,0]=1 134 B10R1.14 COC(=O)C1CCC(=O)C1 G-6549 [0,1,0,0,0,0|1,0,2]=4 135 B10R1.14 COC(=O)C1CCC(Br)C1 Q57113 [0,1,0,0,0,0|2,0,0]=3 136 B10R1.14 COC(=O)C1CCC(F)C1 Q56994 [0,1,0,0,0,0|2,0,0]=3 137 B10R1.14 COC(=O)C1CCC(N)C1 Q52413 [0,1,0,0,0,0|2,0,0]=3 138 B10R1.14 COC(=O)C1CCC(O)C1 Q52112 [0,1,0,0,0,0|1,0,0]=2 139 B10R1.14 COC(=O)C1CCN(C)C1 P38659 [0,1,0,0,0,0|3,0,0]=4 140 B10R1.14 COC(=O)N1CCC(N)C1 Q59181 [0,1,0,0,0,0|3,0,0]=4 141 B10R1.14 COC(=O)[C@@H]1CCC(=O)C1 L13047 [0,1,0,0,0,0|1,0,2]=4 142 B10R1.14 COC(=O)[C@@H]1CC[C@@H](F)C1 Q52909 [0,1,0,0,0,0|2,0,0]=3 143 B10R1.14 COC(=O)[C@@H]1CC[C@@H](N)C1 L18149 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.14 COC(=O)[C@@H]1CC[C@@H](O)C1 L22418 [0,1,0,0,0,0|1,0,0]=2 145 B10R1.14 COC(=O)[C@@H]1CC[C@H](N)C1 L13341 [0,1,0,0,0,0|2,0,0]=3 146 B10R1.14 COC(=O)[C@@H]1CC[C@H](O)C1 I-9853 [0,1,0,0,0,0|1,0,0]=2 147 B10R1.14 COC(=O)[C@@H]1CC[C@H](O)C1 Q56974 [0,1,0,0,0,0|1,0,0]=2 148 B10R1.14 COC(=O)[C@@H]1C[C@@H](S)CN1 P50858 [0,1,0,0,0,0|0,1,0]=2 149 B10R1.14 COC(=O)[C@@H]1C[C@H](F)CN1 G-7740 [0,1,0,0,0,0|1,0,0]=2 150 B10R1.14 COC(=O)[C@@H]1C[C@H](O)CN1 P38268 [0,1,0,0,0,0|0,0,0]=1 151 B10R1.14 COC(=O)[C@H]1C=C[C@@H](N)C1 L14980 [0,1,0,0,0,0|2,0,1]=4 152 B10R1.14 COC(=O)[C@H]1CCC(=O)C1 L13046 [0,1,0,0,0,0|1,0,2]=4 153 B10R1.14 COC(=O)[C@H]1CC[C@@H](Br)C1 Q56993 [0,1,0,0,0,0|2,0,0]=3 154 B10R1.14 COC(=O)[C@H]1CC[C@@H](F)C1 Q52908 [0,1,0,0,0,0|2,0,0]=3 155 B10R1.14 COC(=O)[C@H]1CC[C@@H](N)C1 K12005 [0,1,0,0,0,0|2,0,0]=3 156 B10R1.14 COC(=O)[C@H]1CC[C@@H](O)C1 Q56975 [0,1,0,0,0,0|1,0,0]=2 157 B10R1.14 COC(=O)[C@H]1CC[C@H](Br)C1 L21293 [0,1,0,0,0,0|2,0,0]=3 158 B10R1.14 COC(=O)[C@H]1CC[C@H](N)C1 L21260 [0,1,0,0,0,0|2,0,0]=3 159 B10R1.14 COC(=O)[C@H]1C[C@@H](F)CN1 L13088 [0,1,0,0,0,0|1,0,0]=2 160 B10R1.14 COC(=O)[C@H]1C[C@@H](O)CN1 G-7666 [0,1,0,0,0,0|0,0,0]=1 161 B10R1.14 COC(=O)[C@H]1C[C@H](O)CN1 O31897 [0,1,0,0,0,0|0,0,0]=1 162 B10R1.14 COC(=O)[C@H]1C[C@H](S)CN1 Q53263 [0,1,0,0,0,0|0,1,0]=2 163 B10R1.31 CC(=O)N1CCC(CO)C1 L19225 [0,1,0,0,0,0|3,0,0]=4 164 B10R1.31 CC(=O)N1CC[C@@H](CO)C1 Q62795 [0,1,0,0,0,0|3,0,0]=4 165 B10R1.31 CC(=O)N1CC[C@H](CO)C1 Q62796 [0,1,0,0,0,0|3,0,0]=4 166 B10R1.31 COC1CCC(C(=O)O)C1 Q56979 [0,1,0,0,0,0|1,0,0]=2 167 B10R1.31 COC1CNC(C(=O)O)C1 Q59289 [0,1,0,0,0,0|0,0,0]=1 168 B10R1.31 COC1CNC(C(N)=O)C1 Q59305 [0,1,0,0,0,0|1,0,0]=2 169 B10R1.31 CO[C@@H]1CC[C@@H](C(=O)O)C1 Q56980 [0,1,0,0,0,0|1,0,0]=2 170 B10R1.31 CO[C@@H]1CC[C@@H](C(=O)O)C1 Q63416 [0,1,0,0,0,0|1,0,0]=2 171 B10R1.31 CO[C@@H]1CC[C@H](C(=O)O)C1 Q56978 [0,1,0,0,0,0|1,0,0]=2 172 B10R1.31 CO[C@@H]1CC[C@H](C(=O)O)C1 Q63417 [0,1,0,0,0,0|1,0,0]=2 173 B10R1.31 CO[C@@H]1CN[C@H](C(=O)O)C1 Q66169 [0,1,0,0,0,0|0,0,0]=1 174 B10R1.31 CO[C@H]1CC[C@@H](C(=O)O)C1 Q63418 [0,1,0,0,0,0|1,0,0]=2 175 B10R1.31 CO[C@H]1CC[C@H](C(=O)O)C1 Q63415 [0,1,0,0,0,0|1,0,0]=2 176 B10R1.58 CN1C[C@@H](C(=O)O)NC1=O L20543 [0,1,0,0,0,0|2,0,1]=4 177 B10R1.58 O=C(O)C1C[C@H](F)[C@@H](F)C1 Q63419 [0,1,0,0,0,0|2,0,0]=3 178 B10R1.58 O=C(O)C1C[C@H](F)[C@H](F)C1 Q63404 [0,1,0,0,0,0|2,0,0]=3 179 B10R1.58 O=C(O)[C@@H]1C[C@@H](F)C(=O)N1 Q64028 [0,1,0,0,0,0|1,0,1]=3 180 B10R1.58 O=C(O)[C@@H]1C[C@@H](F)C(=O)N1 Q64034 [0,1,0,0,0,0|1,0,1]=3 181 B10R1.58 O=C(O)[C@@H]1C[C@@H](O)[C@H](F)C1 Q60866 [0,1,0,0,0,0|1,0,0]=2 182 B10R1.58 O=C1N[C@@H](C(=O)O)C[C@@H]1F Q64040 [0,1,0,0,0,0|1,0,1]=3 183 B10R1.58 O=C1N[C@@H](C(=O)O)C[C@H]1F Q64039 [0,1,0,0,0,0|1,0,1]=3 184 B10R1.58 O=C1N[C@H](C(=O)O)C[C@@H]1F P45752 [0,1,0,0,0,0|1,0,1]=3 185 B10R1.58 O=C1N[C@H](C(=O)O)C[C@@H]1F Q64041 [0,1,0,0,0,0|1,0,1]=3 186 B10R1.59 CN1C[C@@H](O)C[C@H]1C(=O)O Q60759 [0,1,0,0,0,0|0,0,0]=1 187 B10R1.59 CN1C[C@H](O)C[C@H]1C(=O)O Q60702 [0,1,0,0,0,0|0,0,0]=1 188 B10R1.59 C[C@@H]1C[C@@H](C(=O)O)N(C)C1 L14488 [0,1,0,0,0,0|1,0,0]=2 189 B10R1.59 C[C@H]1C[C@@H](C(=O)O)N(C)C1 L14434 [0,1,0,0,0,0|1,0,0]=2 190 B10R1.59 C[C@H]1C[C@@H](C(=O)O)N(C)C1 Q61617 [0,1,0,0,0,0|1,0,0]=2 191 B10R1.59 O=C(O)N1CC(O)CC1=O M15560 [0,1,0,0,0,0|2,0,0]=3 192 B10R1.194 CC1CC[C@@H](C(=O)O)N1C Q61630 [0,1,0,0,0,0|3,0,0]=4 193 B10R1.194 C[C@@H]1CC[C@@H](C(=O)O)N1C L14511 [0,1,0,0,0,0|3,0,0]=4 194 B10R1.194 C[C@H]1CC[C@@H](C(=O)O)N1C L14374 [0,1,0,0,0,0|3,0,0]=4 195 B10R1.194 C[C@H]1CC[C@@H](C(=O)O)N1C Q61618 [0,1,0,0,0,0|3,0,0]=4 196 B10R1.359 CC(=O)C1CCC(F)(F)C1 L21266 [0,1,0,0,0,0|3,0,0]=4 197 B10R1.359 CC1(C)CCC(C(=O)O)C1 Q60842 [0,1,0,0,0,0|2,0,0]=3 198 B10R1.359 CC1(C)CCC(C(=O)O)N1 Q61613 [0,1,0,0,0,0|3,0,0]=4 199 B10R1.359 CC1(C)CCC(C(=O)O)N1 Q61614 [0,1,0,0,0,0|3,0,0]=4 200 B10R1.359 CC1(C)CN[C@@H](C(=O)O)C1 O33472 [0,1,0,0,0,0|1,0,0]=2 201 B10R1.359 CC1(C)CN[C@@H](C(=O)O)C1 Q55538 [0,1,0,0,0,0|1,0,0]=2 202 B10R1.359 CC1(C)CN[C@H](C(=O)O)C1 A-976 [0,1,0,0,0,0|1,0,0]=2 203 B10R1.359 C[C@@]1(O)CN[C@H](C(=O)O)C1 Q62067 [0,1,0,0,0,0|0,0,0]=1 204 B10R1.359 C[C@]1(O)CN[C@H](C(=O)O)C1 Q62068 [0,1,0,0,0,0|0,0,0]=1 205 B10R1.359 O=C(O)C1CC(F)(F)CN1 Q57355 [0,1,0,0,0,0|1,0,0]=2 206 B10R1.359 O=C(O)C1CC(F)(F)CN1 Q57356 [0,1,0,0,0,0|1,0,0]=2 207 B10R1.359 O=C(O)C1CCC(F)(F)C1 G-6412 [0,1,0,0,0,0|2,0,0]=3 208 B10R1.359 O=C(O)[C@@H]1CC(F)(F)CN1 I-9843 [0,1,0,0,0,0|1,0,0]=2 209 B10R1.359 O=C(O)[C@@H]1CCC(F)(F)C1 L13404 [0,1,0,0,0,0|2,0,0]=3 210 B10R1.359 O=C(O)[C@H]1CC(F)(F)CN1 L18162 [0,1,0,0,0,0|1,0,0]=2 211 B10R1.359 O=C(O)[C@H]1CCC(F)(F)C1 L13405 [0,1,0,0,0,0|2,0,0]=3 212 B10R1.470 CC1(C(=O)O)CCC(=O)C1 Q56977 [0,1,0,0,0,0|1,0,2]=4 213 B10R1.470 CN1CCC(C)(C(=O)O)C1 O30288 [0,1,0,0,0,0|3,0,0]=4 214 B10R1.470 CN1CCC(F)(C(=O)O)C1 Q63434 [0,1,0,0,0,0|3,0,0]=4 215 B10R1.470 C[C@@]1(C(N)=O)C[C@@H](O)CN1 Q55847 [0,1,0,0,0,0|1,0,0]=2 216 B10R1.470 C[C@]1(C(=O)O)CC[C@H](N)C1 Q57021 [0,1,0,0,0,0|2,0,0]=3 217 B8R0.8 C#CCOC(C)C(=O)O O29907 [0,0,1,0,0,0|2,0,1]=4 218 B8R0.8 N[C@H](CCCO)C(=O)O P37057 [0,0,1,0,0,0|2,0,0]=3 219 B8R0.9 C=CC(N)CCC(=O)O M15322 [0,0,1,0,0,0|2,0,1]=4 220 B8R0.9 CCC(C)OCC(=O)O P34749 [0,0,1,0,0,0|3,0,0]=4 221 B8R0.9 NCC(=O)CCC(=O)O P37517 [0,0,1,0,0,0|0,0,2]=3 222 B8R0.15 C=CCC(CC)C(=O)O Q69583 [0,0,1,0,0,0|2,0,1]=4 223 B8R0.15 CCC[C@@H](NC)C(=O)O P36548 [0,0,1,0,0,0|1,0,0]=2 224 B8R0.15 CCC[C@H](NC)C(=O)O P40204 [0,0,1,0,0,0|1,0,0]=2 225 B8R0.23 C=C(C)CC(N)C(=O)O P39089 [0,0,1,0,0,0|1,0,1]=3 226 B8R0.23 C=C(C)C[C@@H](N)C(=O)O O28738 [0,0,1,0,0,0|1,0,1]=3 227 B8R0.23 C=C(C)C[C@H](N)C(=O)O O28733 [0,0,1,0,0,0|1,0,1]=3 228 B8R0.23 CC(C)C[C@@H](O)C(=O)O P39959 [0,0,1,0,0,0|2,0,0]=3 229 B8R0.23 CN(C)C[C@H](N)C(=O)O P43074 [0,0,1,0,0,0|2,0,0]=3 230 B8R0.23 C[C@@H](CC(=O)O)C(=O)O P39685 [0,0,1,0,0,0|2,0,1]=4 231 B8R0.28 CC(C)CNCC(=O)O P38861 [0,0,1,0,0,0|1,0,0]=2 232 B10R2.346 O=C(O)C1NC2CC1C2 P47911 [0,0,0,1,0,0|3,0,0]=4 233 B10R2.346 O=C(O)[C@@H]1NC2CC1C2 P46134 [0,0,0,1,0,0|3,0,0]=4 234 B10R2.346 O=C(O)[C@H]1NC2CC1C2 P44786 [0,0,0,1,0,0|3,0,0]=4 235 B10R2.348 O=C(O)C12CC(CN1)C2 P45265 [0,0,0,1,0,0|1,0,0]=2 236 B10R2.348 O=C(O)C12CC(CN1)C2 P49695 [0,0,0,1,0,0|1,0,0]=2 237 B10R2.348 O=C(O)C12CCC(C1)C2 P45365 [0,0,0,1,0,0|2,0,0]=3 238 B10R2.355 O=C(O)C1NCC2CC21 L14641 [0,0,0,1,0,0|1,0,0]=2 239 B10R2.355 O=C(O)[C@H]1NC[C@@H]2C[C@H]12 L18192 [0,0,0,1,0,0|1,0,0]=2 240 B10R2.355 O=C(O)[C@H]1NC[C@@H]2C[C@H]12 Q52830 [0,0,0,1,0,0|1,0,0]=2 241 B10R2.355 O=C(O)[C@H]1NC[C@@H]2C[C@H]12 Q56647 [0,0,0,1,0,0|1,0,0]=2 242 B10R2.355 [C@@H]12CN[C@H](C(=O)O)[C@@H]1C2 L18089 [0,0,0,1,0,0|1,0,0]=2 243 B10R2.355 [C@@H]12CN[C@H](C(=O)O)[C@@H]1C2 Q56348 [0,0,0,1,0,0|1,0,0]=2 244 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Q56917 [0,0,0,1,0,0|2,0,0]=3 245 B10R2.357 NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1 Q56918 [0,0,0,1,0,0|2,0,0]=3 246 B10R2.357 O=C(O)C1CC2CC2C1 G-7814 [0,0,0,1,0,0|2,0,0]=3 247 B10R2.357 O=C(O)[C@@H]1CC2C[C@@H]2N1 G-7862 [0,0,0,1,0,0|1,0,0]=2 248 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 Q56285 [0,0,0,1,0,0|1,0,0]=2 249 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 Q54451 [0,0,0,1,0,0|1,0,0]=2 250 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 Q54452 [0,0,0,1,0,0|1,0,0]=2 251 B10R2.357 O=C(O)[C@H]1C[C@@H]2C[C@@H]2N1 Q57363 [0,0,0,1,0,0|1,0,0]=2 252 B10R2.357 [C@@H]12C[C@@H](C(N)=O)N[C@@H]1C2 Q52271 [0,0,0,1,0,0|2,0,0]=3 253 B10R2.357 [C@@H]12C[C@H](C(=O)O)N[C@@H]1C2 L21898 [0,0,0,1,0,0|1,0,0]=2 254 B10R2.357 [C@@H]12C[C@H](C(=O)O)N[C@@H]1C2 Q52195 [0,0,0,1,0,0|1,0,0]=2 255 B10R2.357 [C@H]12C[C@H]1C[C@@H](C(N)=O)N2 Q69750 [0,0,0,1,0,0|2,0,0]=3 256 B8R1.23 C=C1CC(C(=O)O)C1 D-2502 [0,0,0,0,1,0|1,0,1]=3 257 B8R1.23 CC(=O)C1CC(O)C1 H-8191 [0,0,0,0,1,0|1,0,0]=2 258 B8R1.23 CC(=O)N1CC(N)C1 G-6033 [0,0,0,0,1,0|3,0,0]=4 259 B8R1.23 CC(=O)N1CC(N)C1 P44093 [0,0,0,0,1,0|3,0,0]=4 260 B8R1.23 CC(=O)N1CC(O)C1 L21515 [0,0,0,0,1,0|2,0,0]=3 261 B8R1.23 CC(N)C1CC(O)C1 P47214 [0,0,0,0,1,0|2,0,1]=4 262 B8R1.23 CC1CC(C(=O)O)C1 L14063 [0,0,0,0,1,0|1,0,0]=2 263 B8R1.23 CN(C)C1CC(O)C1 L14827 [0,0,0,0,1,0|3,0,0]=4 264 B8R1.23 CN(C)[C@H]1C[C@@H](O)C1 P44896 [0,0,0,0,1,0|3,0,0]=4 265 B8R1.23 CN(C)[C@H]1C[C@H](O)C1 P44898 [0,0,0,0,1,0|3,0,0]=4 266 B8R1.23 CN1CC(C(=O)O)C1 C-2243 [0,0,0,0,1,0|2,0,0]=3 267 B8R1.23 C[C@@H](N)C1CC(O)C1 K10848 [0,0,0,0,1,0|2,0,1]=4 268 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 G-6829 [0,0,0,0,1,0|1,0,0]=2 269 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 G-6830 [0,0,0,0,1,0|1,0,0]=2 270 B8R1.23 NC(=O)C1CC(N)C1 P48836 [0,0,0,0,1,0|2,0,0]=3 271 B8R1.23 NC1CC(C(=O)O)C1 G-7780 [0,0,0,0,1,0|1,0,0]=2 272 B8R1.23 NC1CC(C(=O)O)C1 P47808 [0,0,0,0,1,0|1,0,0]=2 273 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 C-2277 [0,0,0,0,1,0|1,0,0]=2 274 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 C-2277-1 [0,0,0,0,1,0|1,0,0]=2 275 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 C-2278 [0,0,0,0,1,0|1,0,0]=2 276 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 P44571 [0,0,0,0,1,0|1,0,0]=2 277 B8R1.23 O=C(O)C1CC(Cl)C1 F-4598 [0,0,0,0,1,0|1,0,0]=2 278 B8R1.23 O=C(O)C1CC(F)C1 D-2564 [0,0,0,0,1,0|1,0,0]=2 279 B8R1.23 O=C(O)C1CC(O)C1 A-876 [0,0,0,0,1,0|0,0,0]=1 280 B8R1.23 O=C(O)C1CC(O)C1 F-4100 [0,0,0,0,1,0|0,0,0]=1 281 B8R1.23 O=C(O)C1CC(O)C1 F-4101 [0,0,0,0,1,0|0,0,0]=1 282 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 L21925 [0,0,0,0,1,0|1,0,0]=2 283 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 L14175 [0,0,0,0,1,0|1,0,0]=2 284 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 L21353 [0,0,0,0,1,0|1,0,0]=2 285 B8R1.23 O=C1CC(C(=O)O)C1 D-2503 [0,0,0,0,1,0|0,0,2]=3 286 B8R1.23 O=C1CC(C(=O)O)N1 P34768 [0,0,0,0,1,0|0,0,2]=3 287 B8R1.23 O=C1CC(C(=O)O)O1 P44894 [0,0,0,0,1,0|1,0,2]=4 288 B8R1.23 O=C1C[C@@H](C(=O)O)N1 I-9933 [0,0,0,0,1,0|0,0,2]=3 289 B8R1.23 O=C1C[C@H](C(=O)O)N1 I-9634 [0,0,0,0,1,0|0,0,2]=3 290 B8R1.23 OC1CC(C(F)F)C1 P47125 [0,0,0,0,1,0|2,0,1]=4 291 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C P50610 [0,0,0,0,1,0|3,0,0]=4 292 B8R1.31 CC(=O)[C@H]1CC[C@H]1C P45662 [0,0,0,0,1,0|3,0,0]=4 293 B8R1.31 CC1CCC1C(=O)O P45629 [0,0,0,0,1,0|2,0,0]=3 294 B8R1.31 CC1NCC1C(=O)O L22133 [0,0,0,0,1,0|3,0,0]=4 295 B8R1.31 CN1CCC1C(=O)O P49637 [0,0,0,0,1,0|3,0,0]=4 296 B8R1.31 CN1CC[C@@H]1C(=O)O H-8820 [0,0,0,0,1,0|3,0,0]=4 297 B8R1.31 CN1CC[C@H]1C(=O)O H-8821 [0,0,0,0,1,0|3,0,0]=4 298 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O L14485 [0,0,0,0,1,0|1,0,0]=2 299 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O P50093 [0,0,0,0,1,0|3,0,0]=4 300 B8R1.31 C[C@H]1NC[C@@H]1C(=O)O K13449 [0,0,0,0,1,0|3,0,0]=4 301 B8R1.31 NC(=O)C1CCC1N F-4228 [0,0,0,0,1,0|3,0,0]=4 302 B8R1.31 NC1CCC1C(=O)O P47809 [0,0,0,0,1,0|2,0,0]=3 303 B8R1.31 NC1COC1C(=O)O Q56135 [0,0,0,0,1,0|2,0,0]=3 304 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O P45363 [0,0,0,0,1,0|2,0,0]=3 305 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O L13901 [0,0,0,0,1,0|2,0,0]=3 306 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O P44744 [0,0,0,0,1,0|2,0,0]=3 307 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O P45102 [0,0,0,0,1,0|2,0,0]=3 308 B8R1.31 N[C@@H]1CO[C@@H]1C(=O)O Q52861 [0,0,0,0,1,0|2,0,0]=3 309 B8R1.31 N[C@@H]1CO[C@H]1C(=O)O Q52863 [0,0,0,0,1,0|2,0,0]=3 310 B8R1.31 N[C@@H]1CO[C@H]1C(=O)O Q54778 [0,0,0,0,1,0|2,0,0]=3 311 B8R1.31 N[C@H]1CC[C@H]1C(=O)O L21391 [0,0,0,0,1,0|2,0,0]=3 312 B8R1.31 N[C@H]1CC[C@H]1C(=O)O P45103 [0,0,0,0,1,0|2,0,0]=3 313 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Q53487 [0,0,0,0,1,0|2,0,0]=3 314 B8R1.31 N[C@H]1CO[C@@H]1C(=O)O Q52864 [0,0,0,0,1,0|2,0,0]=3 315 B8R1.31 N[C@H]1CO[C@H]1C(=O)O Q52862 [0,0,0,0,1,0|2,0,0]=3 316 B8R1.31 N[C@H]1CO[C@H]1C(=O)O Q54777 [0,0,0,0,1,0|2,0,0]=3 317 B8R1.31 O=C(O)C1CCC1F P47126 [0,0,0,0,1,0|2,0,0]=3 318 B8R1.31 O=C(O)C1CCC1O P49194 [0,0,0,0,1,0|1,0,0]=2 319 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O P48368 [0,0,0,0,1,0|1,0,0]=2 320 B10R1.13 CC(=O)C1CCC(C)CC1 P46802 [0,0,0,0,0,1|3,0,0]=4 321 B10R1.13 CC(=O)N1CCC(O)CC1 G-5903 [0,0,0,0,0,1|3,0,0]=4 322 B10R1.13 CC1=CC[C@H](C(=O)O)CC1 P49327 [0,0,0,0,0,1|2,0,1]=4 323 B10R1.13 CC1CCC(C(=O)O)CC1 Q65983 [0,0,0,0,0,1|2,0,0]=3 324 B10R1.13 CC1CCC(C(=O)O)NC1 Q61273 [0,0,0,0,0,1|1,0,0]=2 325 B10R1.13 CN1CCC(C(=O)O)CC1 P36469 [0,0,0,0,0,1|3,0,0]=4 326 B10R1.13 C[C@@H]1CC[C@@H](C(=O)O)NC1 Q61275 [0,0,0,0,0,1|1,0,0]=2 327 B10R1.13 C[C@H]1CC[C@@H](C(=O)O)CC1 P44802 [0,0,0,0,0,1|2,0,0]=3 328 B10R1.13 C[C@H]1CC[C@@H](C(=O)O)NC1 Q61274 [0,0,0,0,0,1|1,0,0]=2 329 B10R1.13 C[C@H]1CC[C@H](C(=O)O)CC1 P48880 [0,0,0,0,0,1|2,0,0]=3 330 B10R1.13 NC(=O)C1CCC(N)CC1 L19769 [0,0,0,0,0,1|3,0,0]=4 331 B10R1.13 NC(=O)[C@@H]1CC[C@@H](N)CO1 Q62832 [0,0,0,0,0,1|3,0,0]=4 332 B10R1.13 NC(=O)[C@@H]1CC[C@@H](N)CO1 Q62833 [0,0,0,0,0,1|3,0,0]=4 333 B10R1.13 NC(=O)[C@H]1CC[C@@H](N)CC1 P45227 [0,0,0,0,0,1|3,0,0]=4 334 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 G-6712 [0,0,0,0,0,1|2,0,0]=3 335 B10R1.13 N[C@H]1CC[C@@H](C(=O)O)CC1 I-9648 [0,0,0,0,0,1|2,0,0]=3 336 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 P44642 [0,0,0,0,0,1|2,0,0]=3 337 B10R1.13 N[C@H]1CC[C@H](C(=O)O)CC1 Q65361 [0,0,0,0,0,1|2,0,0]=3 338 B10R1.13 O=C(O)C1CC=C(Br)CC1 P43988 [0,0,0,0,0,1|2,0,1]=4 339 B10R1.13 O=C(O)C1CCC(Br)CC1 P44914 [0,0,0,0,0,1|2,0,0]=3 340 B10R1.13 O=C(O)C1CCC(F)CC1 L14338 [0,0,0,0,0,1|2,0,0]=3 341 B10R1.13 O=C(O)C1CCC(O)CC1 P44657 [0,0,0,0,0,1|1,0,0]=2 342 B10R1.13 O=C(O)[C@@H]1CC[C@@H](O)CN1 Q61202 [0,0,0,0,0,1|0,0,0]=1 343 B10R1.13 O=C(O)[C@@H]1CC[C@@H](O)CN1 Q61203 [0,0,0,0,0,1|0,0,0]=1 344 B10R1.13 O=C(O)[C@@H]1CC[C@H](O)CN1 H-8229 [0,0,0,0,0,1|0,0,0]=1 345 B10R1.13 O=C(O)[C@@H]1CC[C@H](O)CN1 I-9385 [0,0,0,0,0,1|0,0,0]=1 346 B10R1.13 O=C(O)[C@@H]1CC[C@H](O)CN1 L13648 [0,0,0,0,0,1|0,0,0]=1 347 B10R1.13 O=C(O)[C@H]1CC[C@@H](F)CC1 L21280 [0,0,0,0,0,1|2,0,0]=3 348 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CC1 I-9653 [0,0,0,0,0,1|1,0,0]=2 349 B10R1.13 O=C(O)[C@H]1CC[C@@H](O)CN1 Q65016 [0,0,0,0,0,1|0,0,0]=1 350 B10R1.13 O=C(O)[C@H]1CC[C@H](F)CC1 L21286 [0,0,0,0,0,1|2,0,0]=3 351 B10R1.13 O=C(O)[C@H]1CC[C@H](O)CC1 F-4662 [0,0,0,0,0,1|1,0,0]=2 352 B10R1.13 O=C(O)[C@H]1CC[C@H](O)CN1 Q52585 [0,0,0,0,0,1|0,0,0]=1 353 B10R1.13 O=C1CCC(C(=O)O)CC1 F-4452 [0,0,0,0,0,1|1,0,2]=4 354 B10R1.13 O=C1CCC(C(=O)O)CN1 C-3651 [0,0,0,0,0,1|1,0,2]=4 355 B10R1.13 O=C1CCC(C(=O)O)NC1 F-4380 [0,0,0,0,0,1|0,0,2]=3 356 B10R1.13 O=C1CCC(C(=O)O)NC1 M23652 [0,0,0,0,0,1|0,0,2]=3 357 B10R1.13 O=C1CC[C@@H](C(=O)O)CN1 Q55736 [0,0,0,0,0,1|1,0,2]=4 358 B10R1.13 O=C1CC[C@@H](C(=O)O)NC1 Q55039 [0,0,0,0,0,1|0,0,2]=3 359 B10R1.13 O=C1CC[C@@H](C(=O)O)NC1 Q55040 [0,0,0,0,0,1|0,0,2]=3 360 B10R1.13 O=C1CC[C@H](C(=O)O)CN1 Q55737 [0,0,0,0,0,1|1,0,2]=4 361 B10R1.13 O=C1CC[C@H](C(=O)O)NC1 Q55041 [0,0,0,0,0,1|0,0,2]=3 362 B10R1.13 O=C1CC[C@H](C(=O)O)NC1 Q55042 [0,0,0,0,0,1|0,0,2]=3 363 B10R1.54 CC(=O)OC1C=CC(O)C1 Q56907 [0,0,0,0,0,1|2,0,1]=4 364 B10R1.54 CC(=O)O[C@@H]1C=C[C@H](O)C1 Q55836 [0,0,0,0,0,1|2,0,1]=4 365 B10R1.54 CC(=O)O[C@@H]1CC[C@H](O)C1 Q62079 [0,0,0,0,0,1|2,0,0]=3 366 B10R1.54 CC(=O)O[C@H]1C=C[C@@H](O)C1 L13608 [0,0,0,0,0,1|2,0,1]=4 367 B10R1.54 CC(=O)O[C@H]1C=C[C@H](O)C1 Q52819 [0,0,0,0,0,1|2,0,1]=4 368 B10R1.54 CC(=O)O[C@H]1CC[C@@H](O)C1 Q56986 [0,0,0,0,0,1|2,0,0]=3 369 B10R1.54 CC1CCN(CC(=O)O)C1 Q59408 [0,0,0,0,0,1|3,0,0]=4 370 B10R1.54 CN1CCC(CC(=O)O)C1 O28286 [0,0,0,0,0,1|3,0,0]=4 371 B10R1.54 CN1CCC(CC(=O)O)C1 Q60498 [0,0,0,0,0,1|3,0,0]=4 372 B10R1.54 O=C(O)CN1CCC(O)C1 P39294 [0,0,0,0,0,1|2,0,0]=3 373 B10R1.54 O=C(O)C[C@@H]1CC[C@@H](O)C1 Q57018 [0,0,0,0,0,1|1,0,0]=2 374 B10R1.54 O=C(O)C[C@@H]1CC[C@H](O)C1 Q57015 [0,0,0,0,0,1|1,0,0]=2 375 B10R1.113 CC1CC(C(=O)O)CCN1 Q55487 [0,0,0,0,0,1|2,0,0]=3 376 B10R1.113 CC1CC(C(=O)O)CCO1 Q61449 [0,0,0,0,0,1|2,0,0]=3 377 B10R1.113 CC1CCNC(C(=O)O)C1 Q61262 [0,0,0,0,0,1|1,0,0]=2 378 B10R1.113 CC1CCNC(C(=O)O)C1 Q61263 [0,0,0,0,0,1|1,0,0]=2 379 B10R1.113 CN1CCCC(C(=O)O)C1 L13505 [0,0,0,0,0,1|3,0,0]=4 380 B10R1.113 CN1CCC[C@@H](C(=O)O)C1 L14828 [0,0,0,0,0,1|3,0,0]=4 381 B10R1.113 CN1CCC[C@H](C(=O)O)C1 L14829 [0,0,0,0,0,1|3,0,0]=4 382 B10R1.113 CN1CCOC(C(=O)O)C1 P35866 [0,0,0,0,0,1|3,0,0]=4 383 B10R1.113 C[C@@H]1CCC[C@H](C(=O)O)C1 P46944 [0,0,0,0,0,1|2,0,0]=3 384 B10R1.113 C[C@@H]1CCN[C@H](C(=O)O)C1 Q61267 [0,0,0,0,0,1|1,0,0]=2 385 B10R1.113 C[C@@H]1CNC[C@@H](C(=O)O)C1 Q52365 [0,0,0,0,0,1|1,0,0]=2 386 B10R1.113 C[C@@H]1CNC[C@H](C(=O)O)C1 Q52364 [0,0,0,0,0,1|1,0,0]=2 387 B10R1.113 C[C@H]1CCN[C@@H](C(=O)O)C1 Q61264 [0,0,0,0,0,1|1,0,0]=2 388 B10R1.113 C[C@H]1CCN[C@@H](C(=O)O)C1 Q61266 [0,0,0,0,0,1|1,0,0]=2 389 B10R1.113 C[C@H]1CCN[C@H](C(=O)O)C1 Q61265 [0,0,0,0,0,1|1,0,0]=2 390 B10R1.113 C[C@H]1CCOC(C(=O)O)C1 Q57859 [0,0,0,0,0,1|2,0,0]=3 391 B10R1.113 C[C@H]1CCO[C@H](C(=O)O)C1 Q57865 [0,0,0,0,0,1|2,0,0]=3 392 B10R1.113 C[C@H]1CNC[C@@H](C(=O)O)C1 Q52367 [0,0,0,0,0,1|1,0,0]=2 393 B10R1.113 C[C@H]1CNC[C@H](C(=O)O)C1 Q52366 [0,0,0,0,0,1|1,0,0]=2 394 B10R1.113 NC1CCCC(C(=O)O)C1 P44660 [0,0,0,0,0,1|2,0,0]=3 395 B10R1.113 NC1COCC(C(=O)O)C1 Q61512 [0,0,0,0,0,1|2,0,0]=3 396 B10R1.113 N[C@@H]1CCC[C@@H](C(=O)O)C1 10035 [0,0,0,0,0,1|2,0,0]=3 397 B10R1.113 N[C@@H]1CCC[C@@H](C(=O)O)C1 I-9369 [0,0,0,0,0,1|2,0,0]=3 398 B10R1.113 N[C@@H]1CCC[C@@H](C(=O)O)C1 P44816 [0,0,0,0,0,1|2,0,0]=3 399 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 L13283 [0,0,0,0,0,1|2,0,0]=3 400 B10R1.113 N[C@@H]1CCC[C@H](C(=O)O)C1 P44485 [0,0,0,0,0,1|2,0,0]=3 401 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 10033 [0,0,0,0,0,1|2,0,0]=3 402 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 I-9281 [0,0,0,0,0,1|2,0,0]=3 403 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 I-9805 [0,0,0,0,0,1|2,0,0]=3 404 B10R1.113 N[C@H]1CCC[C@@H](C(=O)O)C1 P44486 [0,0,0,0,0,1|2,0,0]=3 405 B10R1.113 N[C@H]1CCC[C@H](C(=O)O)C1 I-9245 [0,0,0,0,0,1|2,0,0]=3 406 B10R1.113 N[C@H]1CCC[C@H](C(=O)O)C1 P44237 [0,0,0,0,0,1|2,0,0]=3 407 B10R1.113 O=C(O)C1CC(F)CCN1 Q54386 [0,0,0,0,0,1|1,0,0]=2 408 B10R1.113 O=C(O)C1CC(F)CCO1 Q64671 [0,0,0,0,0,1|2,0,0]=3 409 B10R1.113 O=C(O)C1CNCC(F)C1 Q61298 [0,0,0,0,0,1|1,0,0]=2 410 B10R1.113 O=C(O)C1COCC(O)C1 Q54620 [0,0,0,0,0,1|1,0,0]=2 411 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](O)C1 P46948 [0,0,0,0,0,1|1,0,0]=2 412 B10R1.113 O=C(O)[C@@H]1CCC[C@H](O)C1 O33392 [0,0,0,0,0,1|1,0,0]=2 413 B10R1.113 O=C(O)[C@@H]1CNC[C@H](F)C1 Q61299 [0,0,0,0,0,1|1,0,0]=2 414 B10R1.113 O=C(O)[C@@H]1CNC[C@H](F)C1 Q61300 [0,0,0,0,0,1|1,0,0]=2 415 B10R1.113 O=C(O)[C@H]1CCC[C@@H](O)C1 O33391 [0,0,0,0,0,1|1,0,0]=2 416 B10R1.113 O=C(O)[C@H]1CCC[C@H](O)C1 P49269 [0,0,0,0,0,1|1,0,0]=2 417 B10R1.113 O=C(O)[C@H]1CNC[C@@H](F)C1 Q61301 [0,0,0,0,0,1|1,0,0]=2 418 B10R1.113 O=C(O)[C@H]1C[C@H](O)CCN1 Q65170 [0,0,0,0,0,1|0,0,0]=1 419 B10R1.113 O=C1CC(C(=O)O)CCN1 G-5564 [0,0,0,0,0,1|1,0,2]=4 420 B10R1.113 O=C1CCCC(C(=O)O)C1 P47766 [0,0,0,0,0,1|1,0,2]=4 421 B10R1.113 O=C1CCC[C@@H](C(=O)O)C1 P46177 [0,0,0,0,0,1|1,0,2]=4 422 B10R1.113 O=C1CCC[C@H](C(=O)O)C1 P46176 [0,0,0,0,0,1|1,0,2]=4 423 B10R1.113 O=C1CCNC(C(=O)O)C1 Q55043 [0,0,0,0,0,1|0,0,2]=3 424 B10R1.113 O=C1CCNC(C(=O)O)C1 S72456 [0,0,0,0,0,1|0,0,2]=3 425 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 M23516 [0,0,0,0,0,1|0,0,2]=3 426 B10R1.113 O=C1CCN[C@H](C(=O)O)C1 M23534 [0,0,0,0,0,1|0,0,2]=3 427 B10R1.113 O=C1CCOC(C(=O)O)C1 Q61442 [0,0,0,0,0,1|1,0,2]=4 428 B7R0.4 C#CCNCC(=O)O L20673 [1,0,1,0,0,0|0,0,2]=4 429 B7R0.4 CC(=O)NCCCN P38199 [1,0,1,0,0,0|2,0,0]=4 430 B7R0.4 COCCCC(=O)O P39031 [1,0,1,0,0,0|2,0,0]=4 431 B7R0.4 NCCNCC(=O)O O28634 [1,0,1,0,0,0|1,0,0]=3 432 B7R0.4 NCCOCC(=O)O P35961 [1,0,1,0,0,0|1,0,0]=3 433 B7R0.5 C#CCC(N)C(=O)O P37796 [1,0,1,0,0,0|0,0,2]=4 434 B7R0.5 C#CC[C@@H](N)C(=O)O P39505 [1,0,1,0,0,0|0,0,2]=4 435 B7R0.5 C#CC[C@H](N)C(=O)O P39506 [1,0,1,0,0,0|0,0,2]=4 436 B7R0.5 C=CC[C@@H](N)C(=O)O P37509 [1,0,1,0,0,0|0,0,2]=4 437 B7R0.5 C=CC[C@H](N)C(=O)O O28653 [1,0,1,0,0,0|0,0,2]=4 438 B7R0.5 C=CC[C@H](N)C(=O)O P40769 [1,0,1,0,0,0|0,0,2]=4 439 B7R0.5 CCC[C@H](O)C(=O)O P51274 [1,0,1,0,0,0|1,0,0]=3 440 B7R0.5 CCNC(C)C(=O)O P36832 [1,0,1,0,0,0|0,0,0]=2 441 B7R0.5 CCN[C@@H](C)C(=O)O P36816 [1,0,1,0,0,0|0,0,0]=2 442 B7R0.5 CCN[C@H](C)C(=O)O P35138 [1,0,1,0,0,0|0,0,0]=2 443 B7R0.5 COC[C@@H](N)C(=O)O P35719 [1,0,1,0,0,0|1,0,0]=3 444 B7R0.5 COC[C@H](N)C(=O)O P38808 [1,0,1,0,0,0|1,0,0]=3 445 B7R0.5 N[C@@H](CCBr)C(=O)O P41033 [1,0,1,0,0,0|1,0,0]=3 446 B7R0.5 N[C@@H](CCS)C(=O)O A-694 [1,0,1,0,0,0|0,1,0]=3 447 B7R0.6 CC(=O)OCC(C)O P36972 [1,0,1,0,0,0|2,0,0]=4 448 B7R0.6 CC(C)OCC(=O)O P38749 [1,0,1,0,0,0|2,0,0]=4 449 B7R0.6 O=C(O)CCC(F)F S72753 [1,0,1,0,0,0|2,0,0]=4 450 B7R0.15 CCC(NC)C(=O)O P42253 [1,0,1,0,0,0|0,0,0]=2 451 B7R0.15 NC[C@@H](CO)C(=O)O Q69031 [1,0,1,0,0,0|2,0,0]=4 452 B7R0.15 NC[C@@H](CO)C(=O)O Q69034 [1,0,1,0,0,0|2,0,0]=4 453 B7R0.15 NC[C@H](CO)C(=O)O Q69035 [1,0,1,0,0,0|2,0,0]=4 454 B7R0.15 NC[C@H](CO)C(=O)O Q69038 [1,0,1,0,0,0|2,0,0]=4 455 B7R1.1 C#CC1CCCN1 L14925 [2,0,0,0,0,0|1,0,1]=4 456 B7R1.1 C#CC1CCCN1 Q55558 [2,0,0,0,0,0|1,0,1]=4 457 B7R1.1 C#C[C@@H]1CCCN1 Q55560 [2,0,0,0,0,0|1,0,1]=4 458 B7R1.1 C#C[C@H]1CCCN1 Q55559 [2,0,0,0,0,0|1,0,1]=4 459 B7R1.1 FCC1CCCN1 Q52409 [2,0,0,0,0,0|1,0,1]=4 460 B7R1.1 FC[C@@H]1CCCN1 G-5688 [2,0,0,0,0,0|1,0,1]=4 461 B7R1.1 FC[C@@H]1CCCN1 Q61799 [2,0,0,0,0,0|1,0,1]=4 462 B7R1.1 FC[C@H]1CCCN1 I-9901 [2,0,0,0,0,0|1,0,1]=4 463 B7R1.1 FC[C@H]1CCCN1 Q51944 [2,0,0,0,0,0|1,0,1]=4 464 B7R1.1 N#CC1CCCN1 G-6826 [2,0,0,0,0,0|1,0,1]=4 465 B7R1.1 N#CC1CCCN1 Q51936 [2,0,0,0,0,0|1,0,1]=4 466 B7R1.1 N#C[C@@H]1CCCN1 A-367 [2,0,0,0,0,0|1,0,1]=4 467 B7R1.1 N#C[C@@H]1CCCN1 G-5682 [2,0,0,0,0,0|1,0,1]=4 468 B7R1.1 N#C[C@H]1CCCN1 G-5683 [2,0,0,0,0,0|1,0,1]=4 469 B7R1.1 N#C[C@H]1CCCN1 O28475 [2,0,0,0,0,0|1,0,1]=4 470 B7R1.1 NCC1CCCN1 P37060 [2,0,0,0,0,0|1,0,1]=4 471 B7R1.1 NC[C@@H]1CCCN1 G-5891 [2,0,0,0,0,0|1,0,1]=4 472 B7R1.1 NC[C@H]1CCCN1 P42386 [2,0,0,0,0,0|1,0,1]=4 473 B7R1.1 O=CC1=CCCC1 O33977 [2,0,0,0,0,0|1,0,1]=4 474 B7R1.1 OC[C@@H]1CCCO1 O32723 [2,0,0,0,0,0|1,0,1]=4 475 B7R1.2 CC1CC(O)CN1 Q59204 [2,0,0,0,0,0|0,0,1]=3 476 B7R1.2 CC1CC(O)CN1 Q59205 [2,0,0,0,0,0|0,0,1]=3 477 B7R1.2 CC1CNC(=O)C1 L13710 [2,0,0,0,0,0|1,0,1]=4 478 B7R1.2 C[C@@H]1CNC(=O)C1 L22301 [2,0,0,0,0,0|1,0,1]=4 479 B7R1.2 C[C@@H]1CN[C@@H](C)C1 Q61627 [2,0,0,0,0,0|1,0,1]=4 480 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Q56025 [2,0,0,0,0,0|0,0,1]=3 481 B7R1.2 C[C@@H]1C[C@H](F)CN1 Q54433 [2,0,0,0,0,0|1,0,1]=4 482 B7R1.2 C[C@@H]1C[C@H](O)CN1 L14502 [2,0,0,0,0,0|0,0,1]=3 483 B7R1.2 C[C@H]1CNC(=O)C1 L18264 [2,0,0,0,0,0|1,0,1]=4 484 B7R1.2 C[C@H]1C[C@@H](O)CN1 Q56026 [2,0,0,0,0,0|0,0,1]=3 485 B7R1.2 C[C@H]1C[C@H](O)CN1 L13861 [2,0,0,0,0,0|0,0,1]=3 486 B7R1.2 NC1CCC(O)C1 G-5810 [2,0,0,0,0,0|2,0,0]=4 487 B7R1.2 NC1CNC(=O)C1 G-6478 [2,0,0,0,0,0|1,0,1]=4 488 B7R1.2 NC1CNC(=O)C1 L13560 [2,0,0,0,0,0|1,0,1]=4 489 B7R1.2 N[C@@H]1CC[C@@H](O)C1 G-6580 [2,0,0,0,0,0|2,0,0]=4 490 B7R1.2 N[C@@H]1CC[C@@H](O)C1 L13346 [2,0,0,0,0,0|2,0,0]=4 491 B7R1.2 N[C@@H]1CC[C@@H](O)C1 Q57092 [2,0,0,0,0,0|2,0,0]=4 492 B7R1.2 N[C@@H]1CC[C@H](O)C1 L13208 [2,0,0,0,0,0|2,0,0]=4 493 B7R1.2 N[C@@H]1CC[C@H](O)C1 Q57094 [2,0,0,0,0,0|2,0,0]=4 494 B7R1.2 N[C@@H]1CNC(=O)C1 L13184 [2,0,0,0,0,0|1,0,1]=4 495 B7R1.2 N[C@@H]1CNC(=O)C1 P44245 [2,0,0,0,0,0|1,0,1]=4 496 B7R1.2 N[C@H]1CC[C@@H](O)C1 G-6579 [2,0,0,0,0,0|2,0,0]=4 497 B7R1.2 N[C@H]1CC[C@@H](O)C1 K10902 [2,0,0,0,0,0|2,0,0]=4 498 B7R1.2 N[C@H]1CC[C@@H](O)C1 L21276 [2,0,0,0,0,0|2,0,0]=4 499 B7R1.2 N[C@H]1CC[C@H](O)C1 I-9981 [2,0,0,0,0,0|2,0,0]=4 500 B7R1.2 N[C@H]1CC[C@H](O)C1 Q57093 [2,0,0,0,0,0|2,0,0]=4 501 B7R1.2 N[C@H]1CNC(=O)C1 L13183 [2,0,0,0,0,0|1,0,1]=4 502 B7R1.2 O=C1CC(O)CN1 P39299 [2,0,0,0,0,0|0,0,1]=3 503 B7R1.2 O=C1CCC(O)C1 H-8145 [2,0,0,0,0,0|1,0,1]=4 504 B7R1.2 O=C1C[C@@H](O)CN1 M22799 [2,0,0,0,0,0|0,0,1]=3 505 B7R1.2 O=C1C[C@@H](S)CN1 I-9138 [2,0,0,0,0,0|0,1,1]=4 506 B7R1.2 OC1CCC(F)C1 Q55723 [2,0,0,0,0,0|2,0,0]=4 507 B7R1.2 OC1CCC(O)C1 L14091 [2,0,0,0,0,0|1,0,0]=3 508 B7R1.2 O[C@@H]1C=C[C@H](O)C1 Q54369 [2,0,0,0,0,0|1,0,1]=4 509 B7R1.2 O[C@@H]1CC[C@@H](O)C1 O33251 [2,0,0,0,0,0|1,0,0]=3 510 B7R1.2 O[C@H]1CC[C@@H](O)C1 L14976 [2,0,0,0,0,0|1,0,0]=3 511 B7R1.2 O[C@H]1CC[C@H](O)C1 Q57036 [2,0,0,0,0,0|1,0,0]=3 512 B9R0.42 CC(NC(=O)CN)C(=O)O P35057 [0,1,1,0,0,0|1,0,1]=4 513 B9R0.47 N[C@@H](CCCCO)C(=O)O P37153 [0,1,1,0,0,0|2,0,0]=4 514 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Q68967 [0,1,1,0,0,0|2,0,0]=4 515 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Q68970 [0,1,1,0,0,0|2,0,0]=4 516 B9R0.39 CN[C@@H](CC(C)C)C(=O)O P36732 [0,1,1,0,0,0|1,0,0]=3 517 B9R0.39 CN[C@H](CC(C)C)C(=O)O F-4647 [0,1,1,0,0,0|1,0,0]=3 518 B9R0.11 CC(C)CC(C)(N)C(=O)O P41237 [0,1,1,0,0,0|1,0,0]=3 519 B9R0.11 CC(C)C[C@](C)(N)C(=O)O Q66110 [0,1,1,0,0,0|1,0,0]=3 520 B9R0.57 CC(C)(C)CC(N)C(=O)O P42786 [0,1,1,0,0,0|1,0,0]=3 521 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O P35494 [0,1,1,0,0,0|1,0,0]=3 522 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O P37339 [0,1,1,0,0,0|1,0,0]=3 523 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O Q68917 [0,1,1,0,0,0|1,0,0]=3 524 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O Q68920 [0,1,1,0,0,0|1,0,0]=3 525 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O Q68921 [0,1,1,0,0,0|1,0,0]=3 526 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Q68973 [0,1,1,0,0,0|2,0,0]=4 527 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Q68975 [0,1,1,0,0,0|2,0,0]=4 528 B9R0.53 CC(C)C[C@H](N)CC(=O)O P39532 [0,1,1,0,0,0|2,0,0]=4 529 B9R0.53 CC(C)C[C@H](N)CC(=O)O Q68972 [0,1,1,0,0,0|2,0,0]=4 530 B9R0.53 CN(CC(=O)O)CC(=O)O M22809 [0,1,1,0,0,0|1,0,1]=4 531 B9R0.56 O=C(O)CNCC(F)(F)F P36117 [0,1,1,0,0,0|2,0,0]=4 532 B9R1.7 COC[C@@H]1C[C@H](F)CN1 Q61823 [1,1,0,0,0,0|1,0,1]=4 533 B9R1.7 COC[C@H]1C[C@H](F)CN1 Q61824 [1,1,0,0,0,0|1,0,1]=4 534 B9R1.21 CO[C@@H]1CN[C@@H](CO)C1 Q64382 [1,1,0,0,0,0|0,0,1]=3 535 B9R1.21 CO[C@@H]1CN[C@H](CO)C1 Q64381 [1,1,0,0,0,0|0,0,1]=3 536 B9R1.21 CO[C@H]1CN[C@@H](CO)C1 Q64380 [1,1,0,0,0,0|0,0,1]=3 537 B9R1.21 CO[C@H]1CN[C@H](CO)C1 Q64383 [1,1,0,0,0,0|0,0,1]=3 538 B9R1.133 C(=O)C1CCC(F)(F)C1 Q62553 [1,1,0,0,0,0|2,0,0]=4 539 B9R1.133 CC1(C)CN[C@@H](CO)C1 Q61915 [1,1,0,0,0,0|1,0,1]=4 540 B9R1.133 CC1(C)CN[C@H](CO)C1 Q61917 [1,1,0,0,0,0|1,0,1]=4 541 B9R1.133 OC[C@@H]1CC(F)(F)CN1 L13717 [1,1,0,0,0,0|1,0,1]=4 542 B9R1.133 OC[C@@H]1CC(F)(F)CN1 Q56435 [1,1,0,0,0,0|1,0,1]=4 543 B9R1.133 OC[C@H]1CC(F)(F)CN1 L13203 [1,1,0,0,0,0|1,0,1]=4 544 B9R1.11 CNC(=O)C1CCCN1 O28788 [1,1,0,0,0,0|1,0,0]=3 545 B9R1.11 CNC(=O)[C@@H]1CCCN1 P38764 [1,1,0,0,0,0|1,0,0]=3 546 B9R1.11 CNC(=O)[C@H]1CCCN1 O28766 [1,1,0,0,0,0|1,0,0]=3 547 B9R1.11 COC(=O)C1CCNC1 G-5251 [1,1,0,0,0,0|2,0,0]=4 548 B9R1.11 COC(=O)C1CCOC1 G-5350 [1,1,0,0,0,0|2,0,0]=4 549 B9R1.11 COC(=O)[C@@H]1CCNC1 G-5253 [1,1,0,0,0,0|2,0,0]=4 550 B9R1.11 COC(=O)[C@@H]1CCNC1 L13624 [1,1,0,0,0,0|2,0,0]=4 551 B9R1.11 COC(=O)[C@@H]1CCOC1 I-9185 [1,1,0,0,0,0|2,0,0]=4 552 B9R1.11 COC(=O)[C@H]1CCNC1 G-5252 [1,1,0,0,0,0|2,0,0]=4 553 B9R1.11 COC(=O)[C@H]1CCNC1 G-6750 [1,1,0,0,0,0|2,0,0]=4 554 B9R1.11 COC(=O)[C@H]1CCOC1 L18447 [1,1,0,0,0,0|2,0,0]=4 555 B9R1.11 NCC(=O)C1CCCC1 L19802 [1,1,0,0,0,0|2,0,0]=4 556 B9R1.11 O=C(NO)C1CCCN1 Q59359 [1,1,0,0,0,0|0,0,0]=2 557 B9R1.19 CC(C)(O)[C@@H]1CCCN1 I-9091 [1,1,0,0,0,0|1,0,1]=4 558 B9R1.19 O=S(=O)(O)C1CCCC1 L14360 [1,1,0,0,0,0|2,0,0]=4 559 B9R1.41 CC1CCNC1C(=O)O Q57359 [1,1,0,0,0,0|0,0,0]=2 560 B9R1.41 CC1CCNC1C(=O)O Q57360 [1,1,0,0,0,0|0,0,0]=2 561 B9R1.41 CC1CNCC1C(=O)O Q59247 [1,1,0,0,0,0|2,0,0]=4 562 B9R1.41 CN1CCCC1C(=O)O M22685 [1,1,0,0,0,0|0,0,0]=2 563 B9R1.41 CN1CCC[C@@H]1C(=O)O P36536 [1,1,0,0,0,0|0,0,0]=2 564 B9R1.41 CN1CCC[C@@H]1C(=O)O P37259 [1,1,0,0,0,0|0,0,0]=2 565 B9R1.41 CN1CCC[C@H]1C(=O)O I-9166 [1,1,0,0,0,0|0,0,0]=2 566 B9R1.41 CN1CCC[C@H]1C(=O)O O28625 [1,1,0,0,0,0|0,0,0]=2 567 B9R1.41 CN1CCC[C@H]1C(=O)O P37937 [1,1,0,0,0,0|0,0,0]=2 568 B9R1.41 C[C@H]1CNC[C@@H]1C(=O)O Q62191 [1,1,0,0,0,0|2,0,0]=4 569 B9R1.41 NC(=O)C1CCCC1N Q59162 [1,1,0,0,0,0|2,0,0]=4 570 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O O32797 [1,1,0,0,0,0|1,0,0]=3 571 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O Q61718 [1,1,0,0,0,0|1,0,0]=3 572 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O H-8160 [1,1,0,0,0,0|1,0,0]=3 573 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Q61730 [1,1,0,0,0,0|1,0,0]=3 574 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O Q61731 [1,1,0,0,0,0|1,0,0]=3 575 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O H-8161 [1,1,0,0,0,0|1,0,0]=3 576 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O F-4802 [1,1,0,0,0,0|1,0,0]=3 577 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O Q52546 [1,1,0,0,0,0|1,0,0]=3 578 B9R1.41 O=C(O)C1CCCC1O Q59153 [1,1,0,0,0,0|1,0,0]=3 579 B9R1.41 O=C(O)C1CCNC1=O F-4855 [1,1,0,0,0,0|2,0,0]=4 580 B9R1.41 O=C(O)C1CNCC1O H-8825 [1,1,0,0,0,0|2,0,0]=4 581 B9R1.41 O=C(O)C1NCCC1F Q59330 [1,1,0,0,0,0|0,0,0]=2 582 B9R1.41 O=C(O)C1NCC[C@@H]1O F-4332 [1,1,0,0,0,0|0,0,0]=2 583 B9R1.41 O=C(O)[C@@H]1CCC[C@@H]1F Q63425 [1,1,0,0,0,0|1,0,0]=3 584 B9R1.41 O=C(O)[C@@H]1CCC[C@@H]1O Q63421 [1,1,0,0,0,0|1,0,0]=3 585 B9R1.41 O=C(O)[C@@H]1CCC[C@H]1F Q63426 [1,1,0,0,0,0|1,0,0]=3 586 B9R1.41 O=C(O)[C@@H]1CCC[C@H]1O Q63422 [1,1,0,0,0,0|1,0,0]=3 587 B9R1.41 O=C(O)[C@@H]1CCNC1=O Q55035 [1,1,0,0,0,0|2,0,0]=4 588 B9R1.41 O=C(O)[C@@H]1CNC[C@@H]1O H-8824 [1,1,0,0,0,0|2,0,0]=4 589 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F Q64264 [1,1,0,0,0,0|0,0,0]=2 590 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O I-9988 [1,1,0,0,0,0|0,0,0]=2 591 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O L14329 [1,1,0,0,0,0|0,0,0]=2 592 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O L22341 [1,1,0,0,0,0|0,0,0]=2 593 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F Q64265 [1,1,0,0,0,0|0,0,0]=2 594 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O F-4333 [1,1,0,0,0,0|0,0,0]=2 595 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O L13193 [1,1,0,0,0,0|0,0,0]=2 596 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O Q54350 [1,1,0,0,0,0|0,0,0]=2 597 B9R1.41 O=C(O)[C@H]1CCC[C@@H]1F Q63427 [1,1,0,0,0,0|1,0,0]=3 598 B9R1.41 O=C(O)[C@H]1CCC[C@@H]1O Q63423 [1,1,0,0,0,0|1,0,0]=3 599 B9R1.41 O=C(O)[C@H]1CCC[C@H]1F Q63424 [1,1,0,0,0,0|1,0,0]=3 600 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O Q63420 [1,1,0,0,0,0|1,0,0]=3 601 B9R1.41 O=C(O)[C@H]1CCNC1=O Q55036 [1,1,0,0,0,0|2,0,0]=4 602 B9R1.41 O=C(O)[C@H]1CNC[C@@H]1O H-8823 [1,1,0,0,0,0|2,0,0]=4 603 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F Q64266 [1,1,0,0,0,0|0,0,0]=2 604 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F Q64267 [1,1,0,0,0,0|0,0,0]=2 605 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O I-9959 [1,1,0,0,0,0|0,0,0]=2 606 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O L21735 [1,1,0,0,0,0|0,0,0]=2 607 B9R1.41 O=C(O)[C@H]1NCC[C@H]1F Q64263 [1,1,0,0,0,0|0,0,0]=2 608 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O L22366 [1,1,0,0,0,0|0,0,0]=2 609 B9R1.163 CC1(C(=O)O)CCCC1 Q61035 [1,1,0,0,0,0|1,0,0]=3 610 B9R1.163 CC1(C(=O)O)CCCN1 P40785 [1,1,0,0,0,0|0,0,0]=2 611 B9R1.163 CC1(C(=O)O)CCNC1 P35438 [1,1,0,0,0,0|2,0,0]=4 612 B9R1.163 CC1(C(=O)O)CCOC1 I-9010 [1,1,0,0,0,0|2,0,0]=4 613 B9R1.163 C[C@@]1(C(=O)O)CCCN1 G-5500 [1,1,0,0,0,0|0,0,0]=2 614 B9R1.163 C[C@@]1(C(=O)O)CCCN1 M22903 [1,1,0,0,0,0|0,0,0]=2 615 B9R1.163 C[C@@]1(C(=O)O)CCNC1 Q61994 [1,1,0,0,0,0|2,0,0]=4 616 B9R1.163 C[C@]1(C(=O)O)CCCN1 G-6115 [1,1,0,0,0,0|0,0,0]=2 617 B9R1.163 C[C@]1(C(=O)O)CCNC1 Q61995 [1,1,0,0,0,0|2,0,0]=4 618 B9R1.163 NC1(C(=O)O)CCNC1 P43160 [1,1,0,0,0,0|2,0,0]=4 619 B9R1.163 NC1(C(=O)O)CCNC1 P45155 [1,1,0,0,0,0|2,0,0]=4 620 B9R1.163 NC1(C(=O)O)CCOC1 C-3361 [1,1,0,0,0,0|2,0,0]=4 621 B9R1.163 N[C@]1(C(=O)O)CCNC1 Q59170 [1,1,0,0,0,0|2,0,0]=4 622 B9R1.163 O=C(O)C1(F)CCCC1 Q57009 [1,1,0,0,0,0|1,0,0]=3 623 B9R1.163 O=C(O)C1(F)CCNC1 L21913 [1,1,0,0,0,0|2,0,0]=4 624 B9R1.163 O=C(O)[C@@]1(F)CCNC1 Q61821 [1,1,0,0,0,0|2,0,0]=4 625 B9R1.163 O=C(O)[C@@]1(F)CCNC1 Q61822 [1,1,0,0,0,0|2,0,0]=4 626 B9R1.163 O=C(O)[C@]1(F)CCNC1 Q61819 [1,1,0,0,0,0|2,0,0]=4 627 B9R1.163 O=C(O)[C@]1(F)CCNC1 Q61820 [1,1,0,0,0,0|2,0,0]=4 628 B9R1.51 CC(C)(O)C1CC(O)C1 Q53419 [0,1,0,0,1,0|1,0,1]=4 629 B9R1.51 CS(=O)(=O)C1CC(O)C1 P46578 [0,1,0,0,1,0|1,0,1]=4 630 B9R1.55 N[C@H]1[C@@H](C(=O)O)C[C@H]1O P45721 [0,1,0,0,1,0|0,0,0]=2 631 B9R1.55 N[C@H]1[C@@H](O)C[C@H]1C(=O)O P46166 [0,1,0,0,1,0|0,0,0]=2 632 B9R1.82 C=C1CC(C(=O)OC)C1 I-9440 [0,1,0,0,1,0|1,0,1]=4 633 B9R1.82 CNC(=O)C1CC(O)C1 P49829 [0,1,0,0,1,0|1,0,0]=3 634 B9R1.82 COC(=O)C1CC(=O)C1 C-2246 [0,1,0,0,1,0|0,0,2]=4 635 B9R1.82 COC(=O)C1CC(Br)C1 H-8052 [0,1,0,0,1,0|1,0,0]=3 636 B9R1.82 COC(=O)C1CC(Cl)C1 G-6592 [0,1,0,0,1,0|1,0,0]=3 637 B9R1.82 COC(=O)C1CC(F)C1 P47896 [0,1,0,0,1,0|1,0,0]=3 638 B9R1.82 COC(=O)C1CC(N)C1 P49386 [0,1,0,0,1,0|1,0,0]=3 639 B9R1.82 COC(=O)C1CC(N)C1 Q52519 [0,1,0,0,1,0|1,0,0]=3 640 B9R1.82 COC(=O)C1CC(O)C1 A-434 [0,1,0,0,1,0|0,0,0]=2 641 B9R1.82 COC(=O)C1CC(O)C1 F-4098 [0,1,0,0,1,0|0,0,0]=2 642 B9R1.82 COC(=O)C1CC(O)C1 F-4099 [0,1,0,0,1,0|0,0,0]=2 643 B9R1.82 COC(=O)N1CC(N)C1 P45916 [0,1,0,0,1,0|2,0,0]=4 644 B9R1.82 COC(=O)N1CC(N)C1 P47078 [0,1,0,0,1,0|2,0,0]=4 645 B9R1.82 COC(=O)N1CC(O)C1 L21408 [0,1,0,0,1,0|1,0,0]=3 646 B9R1.82 COC(=O)[C@H]1C[C@@H](Br)C1 P47452 [0,1,0,0,1,0|1,0,0]=3 647 B9R1.82 COC(=O)[C@H]1C[C@@H](F)C1 P50695 [0,1,0,0,1,0|1,0,0]=3 648 B9R1.82 COC(=O)[C@H]1C[C@@H](N)C1 G-5199 [0,1,0,0,1,0|1,0,0]=3 649 B9R1.82 COC(=O)[C@H]1C[C@H](Br)C1 G-7774 [0,1,0,0,1,0|1,0,0]=3 650 B9R1.82 COC(=O)[C@H]1C[C@H](F)C1 P44032 [0,1,0,0,1,0|1,0,0]=3 651 B9R1.82 COC(=O)[C@H]1C[C@H](N)C1 G-5470 [0,1,0,0,1,0|1,0,0]=3 652 B9R1.82 COC(=O)[C@H]1C[C@H](N)C1 P44094 [0,1,0,0,1,0|1,0,0]=3 653 B9R1.82 O=C(CCl)N1CC(O)C1 P47737 [0,1,0,0,1,0|2,0,0]=4 654 B9R1.95 CC(=O)N1CC(CO)C1 P48310 [0,1,0,0,1,0|2,0,0]=4 655 B9R1.95 CCC1CC(C(=O)O)C1 P45348 [0,1,0,0,1,0|1,0,0]=3 656 B9R1.95 CCN1CC(C(=O)O)C1 H-8216 [0,1,0,0,1,0|2,0,0]=4 657 B9R1.95 CNC1CC(C(=O)O)C1 P48460 [0,1,0,0,1,0|1,0,0]=3 658 B9R1.95 COC1CC(C(=O)O)C1 F-4385 [0,1,0,0,1,0|0,0,0]=2 659 B9R1.95 CO[C@H]1C[C@@H](C(=O)O)C1 G-7356 [0,1,0,0,1,0|0,0,0]=2 660 B9R1.95 CO[C@H]1C[C@H](C(=O)O)C1 G-7357 [0,1,0,0,1,0|0,0,0]=2 661 B9R1.95 N#CC1CC(C(=O)O)C1 P43789 [0,1,0,0,1,0|1,0,0]=3 662 B9R1.95 NCC1CC(C(=O)O)C1 L14512 [0,1,0,0,1,0|1,0,0]=3 663 B9R1.95 NCC1CC(C(=O)O)C1 P48866 [0,1,0,0,1,0|1,0,0]=3 664 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 P48252 [0,1,0,0,1,0|1,0,0]=3 665 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 P48255 [0,1,0,0,1,0|1,0,0]=3 666 B9R1.95 NC[C@H]1C[C@H](C(=O)O)C1 P47233 [0,1,0,0,1,0|1,0,0]=3 667 B9R1.95 O=C(O)C1CC(CBr)C1 P49897 [0,1,0,0,1,0|1,0,0]=3 668 B9R1.95 O=C(O)C1CC(CF)C1 P47785 [0,1,0,0,1,0|1,0,0]=3 669 B9R1.95 O=C(O)C1CC(CO)C1 D-2561 [0,1,0,0,1,0|0,0,0]=2 670 B9R1.95 O=C(O)[C@H]1C[C@@H](CO)C1 P47160 [0,1,0,0,1,0|0,0,0]=2 671 B9R1.95 O=C(O)[C@H]1C[C@H](CO)C1 P47223 [0,1,0,0,1,0|0,0,0]=2 672 B9R1.152 C=C1CC(C)(C(=O)O)C1 L18189 [0,1,0,0,1,0|1,0,1]=4 673 B9R1.152 C=C1CC(N)(C(=O)O)C1 P45998 [0,1,0,0,1,0|1,0,1]=4 674 B9R1.152 C=C1CC(O)(C(=O)O)C1 Q53353 [0,1,0,0,1,0|1,0,1]=4 675 B9R1.152 CC1(C(=O)O)CC(=O)C1 G-7323 [0,1,0,0,1,0|0,0,2]=4 676 B9R1.152 CC1(C(=O)O)CC(N)C1 P46878 [0,1,0,0,1,0|1,0,0]=3 677 B9R1.152 CC1CC(C)(C(=O)O)C1 P45152 [0,1,0,0,1,0|1,0,0]=3 678 B9R1.152 CC1CC(N)(C(=O)O)C1 P47365 [0,1,0,0,1,0|1,0,0]=3 679 B9R1.152 C[C@]1(C(=O)O)C[C@@H](N)C1 I-9804 [0,1,0,0,1,0|1,0,0]=3 680 B9R1.152 C[C@]1(C(=O)O)C[C@@H](N)C1 P43910 [0,1,0,0,1,0|1,0,0]=3 681 B9R1.152 C[C@]1(C(=O)O)C[C@H](N)C1 G-5884 [0,1,0,0,1,0|1,0,0]=3 682 B9R1.152 C[C@]1(C(=O)O)C[C@H](N)C1 P48427 [0,1,0,0,1,0|1,0,0]=3 683 B9R1.152 NC1(C(=O)O)CC(F)C1 L21448 [0,1,0,0,1,0|1,0,0]=3 684 B9R1.152 NC1(C(=O)O)CC(O)C1 L21397 [0,1,0,0,1,0|0,0,0]=2 685 B9R1.152 NC1CC(F)(C(=O)O)C1 P48244 [0,1,0,0,1,0|1,0,0]=3 686 B9R1.152 N[C@]1(C(=O)O)C[C@@H](F)C1 P45945 [0,1,0,0,1,0|1,0,0]=3 687 B9R1.152 N[C@]1(C(=O)O)C[C@@H](O)C1 P46053 [0,1,0,0,1,0|0,0,0]=2 688 B9R1.152 N[C@]1(C(=O)O)C[C@H](F)C1 P44861 [0,1,0,0,1,0|1,0,0]=3 689 B9R1.152 N[C@]1(C(=O)O)C[C@H](O)C1 P46625 [0,1,0,0,1,0|0,0,0]=2 690 B9R1.152 O=C(O)C1(F)CC(F)C1 P46337 [0,1,0,0,1,0|1,0,0]=3 691 B9R1.152 O=C(O)C1(F)CC(O)C1 P46092 [0,1,0,0,1,0|0,0,0]=2 692 B9R1.152 O=C(O)[C@]1(F)C[C@@H](O)C1 P50591 [0,1,0,0,1,0|0,0,0]=2 693 B9R1.152 O=C(O)[C@]1(F)C[C@H](O)C1 P50586 [0,1,0,0,1,0|0,0,0]=2 694 B9R1.152 O=C(O)[C@]1(O)C[C@@H](O)C1 P50588 [0,1,0,0,1,0|0,0,0]=2 695 B9R1.152 O=C(O)[C@]1(O)C[C@H](O)C1 P50592 [0,1,0,0,1,0|0,0,0]=2 696 B9R1.152 O=C1CC(F)(C(=O)O)C1 P46018 [0,1,0,0,1,0|0,0,2]=4 697 B9R1.164 CC(=O)C1CC(F)(F)C1 L14840 [0,1,0,0,1,0|2,0,0]=4 698 B9R1.164 CC1(C)CC(C(=O)O)C1 G-7355 [0,1,0,0,1,0|1,0,0]=3 699 B9R1.164 CC1(F)CC(C(=O)O)C1 L13213 [0,1,0,0,1,0|1,0,0]=3 700 B9R1.164 CC1(O)CC(C(=O)O)C1 L13034 [0,1,0,0,1,0|0,0,0]=2 701 B9R1.164 C[C@]1(F)C[C@@H](C(=O)O)C1 L18045 [0,1,0,0,1,0|1,0,0]=3 702 B9R1.164 C[C@]1(F)C[C@H](C(=O)O)C1 L21324 [0,1,0,0,1,0|1,0,0]=3 703 B9R1.164 C[C@]1(O)C[C@@H](C(=O)O)C1 I-9401 [0,1,0,0,1,0|0,0,0]=2 704 B9R1.164 C[C@]1(O)C[C@H](C(=O)O)C1 G-6555 [0,1,0,0,1,0|0,0,0]=2 705 B9R1.164 C[C@]1(O)C[C@H](C(=O)[O-])C1 P50099 [0,1,0,0,1,0|0,0,1]=3 706 B9R1.164 NC(=O)C1CC(F)(F)C1 P45033 [0,1,0,0,1,0|2,0,0]=4 707 B9R1.164 O=C(Cl)C1CC(F)(F)C1 P44757 [0,1,0,0,1,0|2,0,0]=4 708 B9R1.164 O=C(O)C1CC(F)(F)C1 C-2311 [0,1,0,0,1,0|1,0,0]=3 709 B9R1.164 O=C(O)C1CS(=O)(=O)C1 H-8018 [0,1,0,0,1,0|1,0,1]=4 710 B9R1.52 CC1CN(C)[C@@H]1C(=O)O L14533 [0,1,0,0,1,0|1,0,0]=3 711 B9R1.81 COC(=O)C1CCC1N P48812 [0,1,0,0,1,0|2,0,0]=4 712 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N F-4529 [0,1,0,0,1,0|2,0,0]=4 713 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N G-6951 [0,1,0,0,1,0|2,0,0]=4 714 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N K12006 [0,1,0,0,1,0|2,0,0]=4 715 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N P48655 [0,1,0,0,1,0|2,0,0]=4 716 B9R1.81 COC(=O)[C@@H]1CC[C@@H]1N P50299 [0,1,0,0,1,0|2,0,0]=4 717 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N P47008 [0,1,0,0,1,0|2,0,0]=4 718 B9R1.81 COC(=O)[C@@H]1CC[C@H]1N Q56097 [0,1,0,0,1,0|2,0,0]=4 719 B9R1.81 COC(=O)[C@H]1CC[C@H]1N P48086 [0,1,0,0,1,0|2,0,0]=4 720 B9R1.81 COC(=O)[C@H]1CC[C@H]1N Q52809 [0,1,0,0,1,0|2,0,0]=4 721 B9R1.96 CCC1CCC1C(=O)O P47971 [0,1,0,0,1,0|2,0,0]=4 722 B9R1.96 CCC1CN[C@@H]1C(=O)O L21366 [0,1,0,0,1,0|1,0,0]=3 723 B9R1.96 CO[C@@H]1CC[C@@H]1C(=O)O P50796 [0,1,0,0,1,0|1,0,0]=3 724 B9R1.96 CO[C@@H]1CC[C@H]1C(=O)O P48367 [0,1,0,0,1,0|1,0,0]=3 725 B9R1.96 N#CC1CCC1C(=O)O L18042 [0,1,0,0,1,0|2,0,0]=4 726 B9R1.96 O=C(O)C1CCC1CF P48305 [0,1,0,0,1,0|2,0,0]=4 727 B9R1.96 O=C(O)N1CCC1CO P47009 [0,1,0,0,1,0|2,0,0]=4 728 B9R1.166 CC1(C)CCC1C(=O)O P45623 [0,1,0,0,1,0|2,0,0]=4 729 B9R1.166 CC1(C)CN[C@@H]1C(=O)O L13876 [0,1,0,0,1,0|1,0,0]=3 730 B9R1.166 CC1(C)CN[C@H]1C(=O)O P46143 [0,1,0,0,1,0|1,0,0]=3 731 B9R1.166 O=C(O)C1CCC1(F)F F-4689 [0,1,0,0,1,0|2,0,0]=4 732 B11R1.3 CCC1CCC(C(=O)O)CC1 P44625 [0,1,0,0,0,1|2,0,0]=4 733 B11R1.3 CNC1CCC(C(=O)O)CC1 P35898 [0,1,0,0,0,1|2,0,0]=4 734 B11R1.3 CN[C@H]1CC[C@@H](C(=O)O)CC1 P45252 [0,1,0,0,0,1|2,0,0]=4 735 B11R1.3 COC1CCC(C(=O)O)CC1 P34721 [0,1,0,0,0,1|1,0,0]=3 736 B11R1.3 CO[C@H]1CC[C@@H](C(=O)O)CC1 L21392 [0,1,0,0,0,1|1,0,0]=3 737 B11R1.3 CO[C@H]1CC[C@H](C(=O)O)CC1 I-9958 [0,1,0,0,0,1|1,0,0]=3 738 B11R1.3 N#CC1CCC(C(=O)O)CC1 O32431 [0,1,0,0,0,1|2,0,0]=4 739 B11R1.3 NC[C@H]1CC[C@@H](C(=O)O)CC1 P44047 [0,1,0,0,0,1|2,0,0]=4 740 B11R1.3 NC[C@H]1CC[C@H](C(=O)O)CC1 P49430 [0,1,0,0,0,1|2,0,0]=4 741 B11R1.3 O=C(O)[C@H]1CC[C@H](CF)CC1 P49781 [0,1,0,0,0,1|2,0,0]=4 742 B11R1.3 O=C(O)[C@H]1CC[C@H](CO)CC1 P44439 [0,1,0,0,0,1|1,0,0]=3 743 B11R1.21 O=C(O)[C@@H]1CC[C@@H](F)[C@@H](F)C1 Q60737 [0,1,0,0,0,1|2,0,0]=4 744 B11R1.22 COC(=O)C1CCC(C)NC1 L14297 [0,1,0,0,0,1|2,0,0]=4 745 B11R1.22 COC(=O)C1CCC(N)CC1 P43106 [0,1,0,0,0,1|2,0,0]=4 746 B11R1.22 COC(=O)C1CCC(O)CC1 P40519 [0,1,0,0,0,1|1,0,0]=3 747 B11R1.22 COC(=O)C1CNC(=O)CN1 L20810 [0,1,0,0,0,1|0,0,2]=4 748 B11R1.22 COC(=O)[C@@H]1CC[C@@H](C)NC1 L21447 [0,1,0,0,0,1|2,0,0]=4 749 B11R1.22 COC(=O)[C@@H]1CC[C@@H](C)NC1 L21795 [0,1,0,0,0,1|2,0,0]=4 750 B11R1.22 COC(=O)[C@@H]1CC[C@@H](C)NC1 Q65077 [0,1,0,0,0,1|2,0,0]=4 751 B11R1.22 COC(=O)[C@@H]1CC[C@@H](C)NC1 Q65078 [0,1,0,0,0,1|2,0,0]=4 752 B11R1.22 COC(=O)[C@@H]1CC[C@H](C)NC1 I-9522 [0,1,0,0,0,1|2,0,0]=4 753 B11R1.22 COC(=O)[C@@H]1CC[C@H](O)CN1 Q56463 [0,1,0,0,0,1|0,0,0]=2 754 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 L18343 [0,1,0,0,0,1|2,0,0]=4 755 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 Q56563 [0,1,0,0,0,1|2,0,0]=4 756 B11R1.22 COC(=O)[C@H]1CC[C@@H](C)NC1 Q69191 [0,1,0,0,0,1|2,0,0]=4 757 B11R1.22 COC(=O)[C@H]1CC[C@@H](F)CC1 P45982 [0,1,0,0,0,1|2,0,0]=4 758 B11R1.22 COC(=O)[C@H]1CC[C@@H](N)CC1 I-9280 [0,1,0,0,0,1|2,0,0]=4 759 B11R1.22 COC(=O)[C@H]1CC[C@@H](O)CC1 F-4822 [0,1,0,0,0,1|1,0,0]=3 760 B11R1.22 COC(=O)[C@H]1CC[C@@H](O)CN1 Q52178 [0,1,0,0,0,1|0,0,0]=2 761 B11R1.22 COC(=O)[C@H]1CC[C@H](C)NC1 Q65079 [0,1,0,0,0,1|2,0,0]=4 762 B11R1.22 COC(=O)[C@H]1CC[C@H](C)NC1 Q65118 [0,1,0,0,0,1|2,0,0]=4 763 B11R1.22 COC(=O)[C@H]1CC[C@H](F)CC1 P46247 [0,1,0,0,0,1|2,0,0]=4 764 B11R1.22 COC(=O)[C@H]1CC[C@H](N)CC1 I-9186 [0,1,0,0,0,1|2,0,0]=4 765 B11R1.22 COC(=O)[C@H]1CC[C@H](N)CN1 Q52451 [0,1,0,0,0,1|1,0,0]=3 766 B11R1.220 CC1(C(=O)O)CCC(O)CC1 P48496 [0,1,0,0,0,1|1,0,0]=3 767 B11R1.220 CC1CCC(F)(C(=O)O)CC1 Q60770 [0,1,0,0,0,1|2,0,0]=4 768 B11R1.220 C[C@]1(C(=O)O)CC[C@@H](O)CC1 P44992 [0,1,0,0,0,1|1,0,0]=3 769 B11R1.220 C[C@]1(C(=O)O)CC[C@H](O)CC1 P45202 [0,1,0,0,0,1|1,0,0]=3 770 B11R1.220 NC1CCC(F)(C(=O)O)CC1 P48250 [0,1,0,0,0,1|2,0,0]=4 771 B11R1.727 CC1(C)CCC(C(=O)O)CC1 Q59516 [0,1,0,0,0,1|2,0,0]=4 772 B11R1.727 CC1(C)CCC(C(=O)O)NC1 Q53321 [0,1,0,0,0,1|1,0,0]=3 773 B11R1.727 CC1(C)CCC(C(=O)O)NC1 Q53322 [0,1,0,0,0,1|1,0,0]=3 774 B11R1.727 O=C(O)C1CCC(F)(F)CC1 H-8603 [0,1,0,0,0,1|2,0,0]=4 775 B11R1.727 O=C(O)C1CCC(F)(F)CN1 G-5912 [0,1,0,0,0,1|1,0,0]=3 776 B11R1.727 O=C(O)C1CCC(F)(F)CO1 Q63454 [0,1,0,0,0,1|2,0,0]=4 777 B11R1.39 COC(=O)CC1CCC(O)C1 Q56969 [0,1,0,0,0,1|1,0,0]=3 778 B11R1.39 COC(=O)C[C@@H]1C=C[C@H](O)C1 Q57019 [0,1,0,0,0,1|1,0,1]=4 779 B11R1.39 COC(=O)C[C@@H]1CC[C@@H](O)C1 Q57017 [0,1,0,0,0,1|1,0,0]=3 780 B11R1.39 COC(=O)C[C@@H]1CC[C@H](O)C1 Q57016 [0,1,0,0,0,1|1,0,0]=3 781 B11R1.43 O=C(O)CN1CCC(CO)C1 Q60896 [0,1,0,0,0,1|2,0,0]=4 782 B11R1.645 O=C(O)CN1C[C@@H](O)CC1=O S72472 [0,1,0,0,0,1|2,0,0]=4 783 B11R1.710 O=C(O)CC1CCC(F)(F)C1 Q55019 [0,1,0,0,0,1|2,0,0]=4 784 B11R1.23 COC(=O)C1CC(O)CCN1 Q53691 [0,1,0,0,0,1|0,0,0]=2 785 B11R1.23 COC(=O)C1CCCC(N)C1 P45023 [0,1,0,0,0,1|2,0,0]=4 786 B11R1.23 COC(=O)C1CCCC(O)C1 P45682 [0,1,0,0,0,1|1,0,0]=3 787 B11R1.23 COC(=O)C1CNCC(C)C1 L13185 [0,1,0,0,0,1|1,0,0]=3 788 B11R1.23 COC(=O)C1CNCC(C)C1 Q65266 [0,1,0,0,0,1|1,0,0]=3 789 B11R1.23 COC(=O)C1CNCC(F)C1 Q61303 [0,1,0,0,0,1|1,0,0]=3 790 B11R1.23 COC(=O)C1COCC(F)C1 Q54621 [0,1,0,0,0,1|2,0,0]=4 791 B11R1.23 COC(=O)C1COCC(N)C1 Q61430 [0,1,0,0,0,1|2,0,0]=4 792 B11R1.23 COC(=O)C1COCC(O)C1 O33130 [0,1,0,0,0,1|1,0,0]=3 793 B11R1.23 COC(=O)[C@@H]1CC(=O)CCN1 G-5855 [0,1,0,0,0,1|0,0,2]=4 794 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](N)C1 P45291 [0,1,0,0,0,1|2,0,0]=4 795 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](N)C1 P45572 [0,1,0,0,0,1|2,0,0]=4 796 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](N)C1 P46950 [0,1,0,0,0,1|2,0,0]=4 797 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](N)C1 P46951 [0,1,0,0,0,1|2,0,0]=4 798 B11R1.23 COC(=O)[C@@H]1CCC[C@@H](O)C1 P44686 [0,1,0,0,0,1|1,0,0]=3 799 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 P45007 [0,1,0,0,0,1|2,0,0]=4 800 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 P46434 [0,1,0,0,0,1|2,0,0]=4 801 B11R1.23 COC(=O)[C@@H]1CCC[C@H](N)C1 P48782 [0,1,0,0,0,1|2,0,0]=4 802 B11R1.23 COC(=O)[C@@H]1CCC[C@H](O)C1 O33421 [0,1,0,0,0,1|1,0,0]=3 803 B11R1.23 COC(=O)[C@@H]1CCC[C@H](O)C1 P45300 [0,1,0,0,0,1|1,0,0]=3 804 B11R1.23 COC(=O)[C@@H]1CCN[C@H](C)C1 G-7298 [0,1,0,0,0,1|2,0,0]=4 805 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](C)C1 Q52376 [0,1,0,0,0,1|1,0,0]=3 806 B11R1.23 COC(=O)[C@@H]1CNC[C@@H](C)C1 Q52377 [0,1,0,0,0,1|1,0,0]=3 807 B11R1.23 COC(=O)[C@@H]1C[C@H](C)CCN1 Q52553 [0,1,0,0,0,1|1,0,0]=3 808 B11R1.23 COC(=O)[C@@H]1C[C@H](O)CCN1 Q53153 [0,1,0,0,0,1|0,0,0]=2 809 B11R1.23 COC(=O)[C@H]1CCC[C@@H](N)C1 P45213 [0,1,0,0,0,1|2,0,0]=4 810 B11R1.23 COC(=O)[C@H]1CCC[C@@H](O)C1 P48011 [0,1,0,0,0,1|1,0,0]=3 811 B11R1.23 COC(=O)[C@H]1CCC[C@H](N)C1 O33219 [0,1,0,0,0,1|2,0,0]=4 812 B11R1.23 COC(=O)[C@H]1CCC[C@H](O)C1 P44687 [0,1,0,0,0,1|1,0,0]=3 813 B11R1.23 COC(=O)[C@H]1CCC[C@H](O)C1 P45405 [0,1,0,0,0,1|1,0,0]=3 814 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C)C1 L14614 [0,1,0,0,0,1|1,0,0]=3 815 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C)C1 Q52374 [0,1,0,0,0,1|1,0,0]=3 816 B11R1.23 COC(=O)[C@H]1CNC[C@@H](C)C1 Q52375 [0,1,0,0,0,1|1,0,0]=3 817 B11R1.23 COC(=O)[C@H]1CNC[C@@H](F)C1 Q61302 [0,1,0,0,0,1|1,0,0]=3 818 B11R1.74 CC1CC(C(=O)O)CC(C)O1 Q57676 [0,1,0,0,0,1|2,0,0]=4 819 B11R1.74 CC1CC(C)CC(C(=O)O)C1 Q59603 [0,1,0,0,0,1|2,0,0]=4 820 B11R1.74 C[C@@H]1C[C@H](C(=O)O)C[C@H](C)C1 P44997 [0,1,0,0,0,1|2,0,0]=4 821 B11R1.167 C[C@@H]1CCN(C)[C@@H](C(=O)O)C1 Q53001 [0,1,0,0,0,1|1,0,0]=3 822 B11R1.266 CCC1CC(C(=O)O)CCO1 Q57703 [0,1,0,0,0,1|2,0,0]=4 823 B11R1.266 COC1CCCC(C(=O)O)C1 S72460 [0,1,0,0,0,1|1,0,0]=3 824 B11R1.266 CO[C@@H]1CCC[C@@H](C(=O)O)C1 P46947 [0,1,0,0,0,1|1,0,0]=3 825 B11R1.266 CO[C@H]1CCC[C@H](C(=O)O)C1 P50788 [0,1,0,0,0,1|1,0,0]=3 826 B11R1.266 O=C(O)C1CCCC(CO)C1 P46440 [0,1,0,0,0,1|1,0,0]=3 827 B11R1.667 C[C@@]1(C(=O)O)CCC[C@@H](N)C1 P46151 [0,1,0,0,0,1|2,0,0]=4 828 B11R1.667 C[C@]1(C(=O)O)CCC[C@H](N)C1 P46135 [0,1,0,0,0,1|2,0,0]=4 829 B11R1.667 C[C@]1(C(=O)O)CCC[C@H](N)C1 P50893 [0,1,0,0,0,1|2,0,0]=4 830 B11R1.667 NC1CCCC(F)(C(=O)O)C1 Q59545 [0,1,0,0,0,1|2,0,0]=4 831 B11R1.730 CC1(C)CCCC(C(=O)O)C1 Q59503 [0,1,0,0,0,1|2,0,0]=4 832 B11R1.730 CC1(C)CCNC(C(=O)O)C1 Q57366 [0,1,0,0,0,1|1,0,0]=3 833 B11R1.730 CC1(C)CCNC(C(=O)O)C1 Q57367 [0,1,0,0,0,1|1,0,0]=3 834 B11R1.730 O=C(O)C1CC(F)(F)CCO1 Q64670 [0,1,0,0,0,1|2,0,0]=4 835 B11R1.730 O=C(O)C1CCCC(F)(F)C1 P45095 [0,1,0,0,0,1|2,0,0]=4 836 B11R1.730 O=C(O)C1CNCC(F)(F)C1 M23918 [0,1,0,0,0,1|1,0,0]=3 837 B11R1.730 O=C(O)[C@@H]1CC(F)(F)CCN1 Q61296 [0,1,0,0,0,1|1,0,0]=3 838 B11R1.730 O=C(O)[C@@H]1CCCC(F)(F)C1 P50388 [0,1,0,0,0,1|2,0,0]=4 839 B11R1.730 O=C(O)[C@H]1CCCC(F)(F)C1 P45954 [0,1,0,0,0,1|2,0,0]=4 840 B11R1.15 CCOC(=O)[C@H]1C[C@H](F)CN1 G-7751 [0,2,0,0,0,0|1,0,0]=3 841 B11R1.44 C(=O)C1CCC(C(=O)OC)C1 Q55065 [0,2,0,0,0,0|1,0,1]=4 842 B11R1.44 COC(=O)C1CCC(CN)C1 P50311 [0,2,0,0,0,0|2,0,0]=4 843 B11R1.44 COC(=O)C1CCC(CN)C1 Q54480 [0,2,0,0,0,0|2,0,0]=4 844 B11R1.44 COC(=O)[C@@H]1CC[C@H](CO)C1 L18270 [0,2,0,0,0,0|1,0,0]=3 845 B11R1.226 COC(=O)[C@@H]1C[C@@H](O)C(=O)N1 Q57166 [0,2,0,0,0,0|0,0,1]=3 846 B11R1.226 COC(=O)[C@@H]1C[C@H](O)C(=O)N1 Q57167 [0,2,0,0,0,0|0,0,1]=3 847 B11R1.866 COC(=O)C1CCC(F)(F)C1 I-9155 [0,2,0,0,0,0|2,0,0]=4 848 B11R1.866 COC(=O)[C@@H]1CC(F)(F)CN1 G-6556 [0,2,0,0,0,0|1,0,0]=3 849 B11R1.866 COC(=O)[C@@H]1CC(F)(F)CN1 I-9405 [0,2,0,0,0,0|1,0,0]=3 850 B11R1.866 COC(=O)[C@@H]1CCC(F)(F)C1 Q56515 [0,2,0,0,0,0|2,0,0]=4 851 B11R1.866 COC(=O)[C@H]1CC(F)(F)CN1 I-9409 [0,2,0,0,0,0|1,0,0]=3 852 B11R1.866 COC(=O)[C@H]1CCC(F)(F)C1 Q56516 [0,2,0,0,0,0|2,0,0]=4 853 B11R1.885 COC(=O)C1(C)CCC(N)C1 Q57029 [0,2,0,0,0,0|2,0,0]=4 854 B11R1.885 COC(=O)C1(C)C[C@@H](F)CN1 Q56755 [0,2,0,0,0,0|1,0,0]=3 855 B11R1.885 COC(=O)C1(C)C[C@H](F)CN1 Q56756 [0,2,0,0,0,0|1,0,0]=3 856 B11R1.885 COC(=O)[C@@]1(C)CC[C@@H](O)C1 Q57126 [0,2,0,0,0,0|1,0,0]=3 857 B11R1.885 COC(=O)[C@@]1(C)C[C@@H](F)CN1 Q56763 [0,2,0,0,0,0|1,0,0]=3 858 B11R1.885 COC(=O)[C@]1(C)C[C@@H](F)CN1 Q56764 [0,2,0,0,0,0|1,0,0]=3 859 B11R1.885 COC(=O)[C@]1(C)C[C@H](F)CN1 Q56762 [0,2,0,0,0,0|1,0,0]=3 860 B11R1.50 CO[C@@H]1C[C@@H](C(=O)O)N(C)C1 L14227 [0,2,0,0,0,0|0,0,0]=2 861 B11R1.50 CO[C@@H]1C[C@H](C(=O)O)N(C)C1 L14266 [0,2,0,0,0,0|0,0,0]=2 862 B11R1.50 CO[C@@H]1C[C@H](C(=O)O)N(C)C1 Q56027 [0,2,0,0,0,0|0,0,0]=2 863 B11R1.50 CO[C@H]1C[C@@H](C(=O)O)N(C)C1 L14228 [0,2,0,0,0,0|0,0,0]=2 864 B11R1.50 CO[C@H]1C[C@H](C(=O)O)N(C)C1 L14305 [0,2,0,0,0,0|0,0,0]=2 865 B11R1.50 CO[C@H]1C[C@H](C(=O)O)N(C)C1 Q56028 [0,2,0,0,0,0|0,0,0]=2 866 B11R1.124 [N-]=[N+]=N[C@@H]1CN[C@H](C(N)=O)C1 Q61709 [0,2,0,0,0,0|2,0,0]=4 867 B11R1.124 [N-]=[N+]=N[C@@H]1CN[C@H](C(N)=O)C1 Q61710 [0,2,0,0,0,0|2,0,0]=4 868 B11R1.175 O=C(O)[C@H]1CC[C@@H](C(=O)O)C1 P43720 [0,2,0,0,0,0|1,0,0]=3 869 B11R1.175 O=C(O)[C@H]1CC[C@H](C(=O)O)N1 Q61576 [0,2,0,0,0,0|2,0,0]=4 870 B11R1.644 CC1(C)C[C@@H](C(=O)O)NC1=O Q64037 [0,2,0,0,0,0|1,0,1]=4 871 B11R1.644 N[C@@H]1C[C@H](C(=O)O)CC1(F)F Q57033 [0,2,0,0,0,0|2,0,0]=4 872 B11R1.644 N[C@H]1C[C@@H](C(=O)O)CC1(F)F Q57031 [0,2,0,0,0,0|2,0,0]=4 873 B11R1.644 N[C@H]1C[C@@H](C(=O)O)CC1(F)F Q57032 [0,2,0,0,0,0|2,0,0]=4 874 B11R1.644 O=C(O)C1CC(F)(F)C(=O)N1 Q64042 [0,2,0,0,0,0|1,0,1]=4 875 B11R1.644 O=C(O)[C@@H]1CC(F)(F)C(=O)N1 Q64043 [0,2,0,0,0,0|1,0,1]=4 876 B11R1.644 O=C(O)[C@H]1CC(F)(F)C(=O)N1 Q64044 [0,2,0,0,0,0|1,0,1]=4 877 B11R1.488 CN1CC(C)(C)C[C@H]1C(=O)O L14399 [0,2,0,0,0,0|1,0,0]=3 878 B11R1.488 CN1CC(F)(F)CC1C(=O)O Q63438 [0,2,0,0,0,0|1,0,0]=3 879 B11R1.488 CN1CC(F)(F)C[C@@H]1C(=O)O Q63440 [0,2,0,0,0,0|1,0,0]=3 880 B11R1.488 CN1CC(F)(F)C[C@H]1C(=O)O Q63439 [0,2,0,0,0,0|1,0,0]=3 881 B11R1.488 N[C@H]1CC(F)(F)C[C@H]1C(=O)O Q55259 [0,2,0,0,0,0|2,0,0]=4 882 B11R1.64 CC[C@H]1[C@@H](C(=O)O)NC[C@@H]1O Q53629 [0,2,0,0,0,0|0,0,0]=2 883 B11R1.315 CC1(C)C(O)CN[C@@H]1C(=O)O Q62148 [0,2,0,0,0,0|0,0,0]=2 884 B11R1.738 C[C@@]1(C(=O)O)CC(F)(F)CN1 Q56437 [0,2,0,0,0,0|1,0,0]=3 885 B9R1.6 CC(=O)C1CCCCN1 O30407 [0,0,1,1,0,0|2,0,0]=4 886 B9R1.6 CC(=O)C1CCCCN1 O30418 [0,0,1,1,0,0|2,0,0]=4 887 B9R1.6 CC(=O)C1CCCOC1 Q57702 [0,0,1,1,0,0|2,0,0]=4 888 B9R1.6 O=C(O)C1CCCCS1 Q57885 [0,0,1,1,0,0|2,0,0]=4 889 B9R1.6 O=C(O)C1CCCNC1 Q68914 [0,0,1,1,0,0|2,0,0]=4 890 B9R1.6 O=C(O)C1CCCNC1 Q68915 [0,0,1,1,0,0|2,0,0]=4 891 B9R1.6 O=C(O)C1CCCOC1 C-3481 [0,0,1,1,0,0|1,0,0]=3 892 B9R1.6 O=C(O)C1CCCSC1 G-5680 [0,0,1,1,0,0|1,1,0]=4 893 B9R1.6 O=C(O)C1CNCCN1 G-6608 [0,0,1,1,0,0|1,0,0]=3 894 B9R1.6 O=C(O)C1CNCCO1 B-1026 [0,0,1,1,0,0|2,0,0]=4 895 B9R1.6 O=C(O)C1CNCCS1 P51392 [0,0,1,1,0,0|2,0,0]=4 896 B9R1.6 O=C(O)C1COCCN1 10206 [0,0,1,1,0,0|0,0,0]=2 897 B9R1.6 O=C(O)C1COCCN1 O28641 [0,0,1,1,0,0|0,0,0]=2 898 B9R1.6 O=C(O)C1COCCO1 O34332 [0,0,1,1,0,0|1,0,0]=3 899 B9R1.6 O=C(O)C1CSCCN1 A-595 [0,0,1,1,0,0|0,1,0]=3 900 B9R1.6 O=C(O)C1CSCCN1 O31853 [0,0,1,1,0,0|0,1,0]=3 901 B9R1.6 O=C(O)[C@@H]1CCCCO1 L18365 [0,0,1,1,0,0|2,0,0]=4 902 B9R1.6 O=C(O)[C@@H]1CCCOC1 Q63448 [0,0,1,1,0,0|1,0,0]=3 903 B9R1.6 O=C(O)[C@@H]1CNCCN1 G-6607 [0,0,1,1,0,0|1,0,0]=3 904 B9R1.6 O=C(O)[C@@H]1CNCCN1 G-6939 [0,0,1,1,0,0|1,0,0]=3 905 B9R1.6 O=C(O)[C@@H]1CNCCO1 B-1027 [0,0,1,1,0,0|2,0,0]=4 906 B9R1.6 O=C(O)[C@@H]1COCCN1 10205 [0,0,1,1,0,0|0,0,0]=2 907 B9R1.6 O=C(O)[C@@H]1COCCN1 B-1036 [0,0,1,1,0,0|0,0,0]=2 908 B9R1.6 O=C(O)[C@@H]1COCCO1 O34581 [0,0,1,1,0,0|1,0,0]=3 909 B9R1.6 O=C(O)[C@@H]1CSCCN1 A-596 [0,0,1,1,0,0|0,1,0]=3 910 B9R1.6 O=C(O)[C@H]1CCCCO1 L21810 [0,0,1,1,0,0|2,0,0]=4 911 B9R1.6 O=C(O)[C@H]1CCCOC1 Q63449 [0,0,1,1,0,0|1,0,0]=3 912 B9R1.6 O=C(O)[C@H]1CNCCN1 G-6940 [0,0,1,1,0,0|1,0,0]=3 913 B9R1.6 O=C(O)[C@H]1CNCCO1 10203 [0,0,1,1,0,0|2,0,0]=4 914 B9R1.6 O=C(O)[C@H]1CNCCO1 B-1028 [0,0,1,1,0,0|2,0,0]=4 915 B9R1.6 O=C(O)[C@H]1COCCN1 B-1037 [0,0,1,1,0,0|0,0,0]=2 916 B9R1.6 O=C(O)[C@H]1COCCN1 I-9498 [0,0,1,1,0,0|0,0,0]=2 917 B9R1.6 O=C(O)[C@H]1COCCO1 O34574 [0,0,1,1,0,0|1,0,0]=3 918 B9R1.6 O=C(O)[C@H]1CSCCN1 A-597 [0,0,1,1,0,0|0,1,0]=3 919 B9R1.110 CC(C(=O)O)C1CCC1 P49848 [0,0,1,1,0,0|2,0,0]=4 920 B9R1.110 CC(C(=O)O)C1CCO1 Q56202 [0,0,1,1,0,0|1,0,0]=3 921 B9R1.110 CC(C(=O)O)N1CCC1 P43803 [0,0,1,1,0,0|1,0,0]=3 922 B9R1.1 NCC1CCC(=O)NC1 F-4482 [0,0,1,1,0,0|2,0,0]=4 923 B9R1.84 O=C(O)CCC1CCC1 P34709 [0,0,1,1,0,0|2,0,0]=4 924 B9R1.84 O=C(O)CCC1CCO1 Q58424 [0,0,1,1,0,0|1,0,0]=3 925 B9R1.84 O=C([O-])CCC1CCO1 Q57244 [0,0,1,1,0,0|1,0,1]=4 926 B9R1.86 CCC1CC1CC(=O)O O32172 [0,0,1,1,0,0|2,0,0]=4 927 B9R1.15 CNC1CCCCC1=O O32079 [0,0,1,1,0,0|2,0,0]=4 928 B9R1.33 O=C1OCCC1CCBr Q69615 [0,0,1,1,0,0|2,0,0]=4 929 B9R1.119 CCC1(C(=O)O)CCC1 P44129 [0,0,1,1,0,0|2,0,0]=4 930 B9R1.119 CCC1(C(=O)O)CCO1 Q56228 [0,0,1,1,0,0|1,0,0]=3 931 B9R1.119 CNC1(C(=O)O)CCC1 P49117 [0,0,1,1,0,0|1,0,0]=3 932 B9R1.119 CNC1(C(=O)O)COC1 Q55950 [0,0,1,1,0,0|2,0,0]=4 933 B9R1.119 COC1(C(=O)O)CCC1 P44683 [0,0,1,1,0,0|2,0,0]=4 934 B9R1.119 CSC1(C(=O)O)CCC1 P45716 [0,0,1,1,0,0|2,0,0]=4 935 B9R1.179 NCCC1(C(=O)O)CC1 L14323 [0,0,1,1,0,0|2,0,0]=4 936 B9R1.179 NCCC1(C(=O)O)CC1 L14422 [0,0,1,1,0,0|2,0,0]=4 937 B9R1.179 O=C(O)C1(CCCl)CC1 L22204 [0,0,1,1,0,0|2,0,0]=4 938 B9R1.53 CC1CC(CC(=O)O)C1 P49313 [0,0,1,1,0,0|2,0,0]=4 939 B9R1.53 CC1CN(CC(=O)O)C1 P47055 [0,0,1,1,0,0|1,0,0]=3 940 B9R1.53 CC1CN(CC(=O)O)C1 P47914 [0,0,1,1,0,0|1,0,0]=3 941 B9R1.53 NC1CC(CC(=O)O)C1 I-9459 [0,0,1,1,0,0|2,0,0]=4 942 B9R1.53 NC1CC(CC(=O)O)C1 Q56497 [0,0,1,1,0,0|2,0,0]=4 943 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 G-7331 [0,0,1,1,0,0|2,0,0]=4 944 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 G-7981 [0,0,1,1,0,0|2,0,0]=4 945 B9R1.53 N[C@H]1C[C@H](CC(=O)O)C1 G-7332 [0,0,1,1,0,0|2,0,0]=4 946 B9R1.53 O=C(O)CC1CC(F)C1 P47187 [0,0,1,1,0,0|2,0,0]=4 947 B9R1.53 O=C(O)C[C@H]1C[C@@H](O)C1 P46932 [0,0,1,1,0,0|1,0,0]=3 948 B9R1.53 O=C(O)C[C@H]1C[C@H](O)C1 P46934 [0,0,1,1,0,0|1,0,0]=3 949 B9R1.85 O=C(O)COCC1CC1 P39397 [0,0,1,1,0,0|2,0,0]=4 950 B9R2.39 O=C1CC2CNC1C2 P46610 [1,0,0,1,0,0|1,0,0]=3 951 B9R2.39 O=C1C[C@@H]2CC[C@H]1C2 P45557 [1,0,0,1,0,0|2,0,0]=4 952 B9R2.39 O=C1C[C@@H]2CC[C@H]1C2 Q52554 [1,0,0,1,0,0|2,0,0]=4 953 B9R2.39 O=C1NC2CCC1C2 P45900 [1,0,0,1,0,0|2,0,0]=4 954 B9R2.39 O=C1OC2CCC1C2 P45453 [1,0,0,1,0,0|1,0,0]=3 955 B9R2.39 O=C1OC2CNC1C2 L19710 [1,0,0,1,0,0|0,0,0]=2 956 B9R2.39 O=C1O[C@@H]2CN[C@H]1C2 P45200 [1,0,0,1,0,0|0,0,0]=2 957 B9R2.39 OC1CC2CNC1C2 L18520 [1,0,0,1,0,0|1,0,1]=4 958 B9R2.39 OC1CC2CNC1C2 P45681 [1,0,0,1,0,0|1,0,1]=4 959 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 P47891 [1,0,0,1,0,0|1,0,1]=4 960 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 L21373 [1,0,0,1,0,0|1,0,1]=4 961 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 P46684 [1,0,0,1,0,0|1,0,1]=4 962 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 P48210 [1,0,0,1,0,0|1,0,1]=4 963 B9R2.39 O[C@H]1C[C@H]2CN[C@@H]1C2 P48650 [1,0,0,1,0,0|1,0,1]=4 964 B9R2.39 [C@@H]12CC[C@@H](N1)[C@H](O)C2 L13369 [1,0,0,1,0,0|1,0,1]=4 965 B9R2.47 O=CC1CC2CC2C1 Q57293 [1,0,0,1,0,0|2,0,0]=4 966 B9R2.47 OC[C@@H]1C[C@@H]2O[C@@H]2C1 Q61890 [1,0,0,1,0,0|1,0,1]=4 967 B9R2.61 OCC12CC(CN1)C2 P45373 [1,0,0,1,0,0|1,0,1]=4 968 B9R2.70 OC[C@H]1NC[C@@H]2C[C@H]12 Q56916 [1,0,0,1,0,0|1,0,1]=4 969 B9R2.70 [C@@H]12CN[C@H](CO)[C@@H]1C2 C-2899 [1,0,0,1,0,0|1,0,1]=4 970 B9R2.70 [C@@H]12CN[C@H](CO)[C@@H]1C2 O33218 [1,0,0,1,0,0|1,0,1]=4 971 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO L22191 [1,0,0,1,0,0|1,0,1]=4 972 B9R2.144 O=C(O)C12CCC1C2 Q54741 [1,0,0,1,0,0|1,0,0]=3 973 B9R2.19 O=C1CCC2CC1C2 P44051 [0,0,0,1,1,0|2,0,0]=4 974 B9R2.19 O=C1NCC2CC1C2 K16109 [0,0,0,1,1,0|2,0,0]=4 975 B9R2.19 O=C1NCC2CC1N2 P44085 [0,0,0,1,1,0|2,0,0]=4 976 B9R2.145 CC(=O)C12CC(C1)C2 P48562 [0,0,0,1,1,0|2,0,0]=4 977 B9R2.145 NC(=O)C12CC(C1)C2 P49858 [0,0,0,1,1,0|2,0,0]=4 978 B9R2.145 O=C(O)C12CC(C1)C2 L13918 [0,0,0,1,1,0|1,0,0]=3 979 B9R2.147 O=C(O)C1C2CC1C2 Q53412 [0,0,0,1,1,0|2,0,0]=4 980 B11R2.68 O=C1O[C@H]2C[C@@H]1CC[C@@H]2I P49241 [0,0,0,1,0,1|2,0,0]=4 981 B11R2.1839 O=C(O)C12CCC(CC1)C2 P46810 [0,0,0,1,0,1|2,0,0]=4 982 B11R2.1839 O=C(O)C12CCC(CC1)N2 P45745 [0,0,0,1,0,1|2,0,0]=4 983 B11R2.1839 O=C(O)C12CCC(CC1)N2 P46955 [0,0,0,1,0,1|2,0,0]=4 984 B11R2.1839 O=C(O)C12CCC(CN1)C2 P49764 [0,0,0,1,0,1|1,0,0]=3 985 B11R2.1839 O=C(O)C12CC[C@@H](C1)NC2 P49331 [0,0,0,1,0,1|2,0,0]=4 986 B11R2.1839 O=C(O)C12CC[C@H](C1)NC2 P49329 [0,0,0,1,0,1|2,0,0]=4 987 B11R2.1839 O=C(O)C12CN[C@H](CN1)C2 P46245 [0,0,0,1,0,1|1,0,0]=3 988 B11R2.1839 O=C(O)C12COC(CN1)C2 P46835 [0,0,0,1,0,1|1,0,0]=3 989 B11R2.1839 O=C(O)[C@@]12CC[C@@H](CN1)C2 P44537 [0,0,0,1,0,1|1,0,0]=3 990 B11R2.1839 O=C(O)[C@@]12CC[C@@H](CN1)C2 P49631 [0,0,0,1,0,1|1,0,0]=3 991 B11R2.1839 O=C(O)[C@]12CC[C@H](CN1)C2 P44536 [0,0,0,1,0,1|1,0,0]=3 992 B11R2.1839 O=C(O)[C@]12CC[C@H](CN1)C2 P49630 [0,0,0,1,0,1|1,0,0]=3 993 B11R2.434 O=C1CC2CC(O)C(C1)N2 P46887 [0,0,0,1,0,1|1,0,0]=3 994 B11R2.434 O=C1C[C@H]2C[C@H](O)[C@@H](C1)O2 P44915 [0,0,0,1,0,1|2,0,0]=4 995 B11R2.845 O=C(O)C1CC2CNC1C2 L14492 [0,0,0,1,0,1|1,0,0]=3 996 B11R2.845 O=C(O)C1CC2CNC1C2 P48077 [0,0,0,1,0,1|1,0,0]=3 997 B11R2.845 O=C(O)C1C[C@@H]2CC[C@H]1C2 P44646 [0,0,0,1,0,1|2,0,0]=4 998 B11R2.845 O=C(O)C1NC2CCC1C2 P44975 [0,0,0,1,0,1|2,0,0]=4 999 B11R2.845 O=C(O)[C@@H]1C[C@H]2CC[C@@H]1C2 P45883 [0,0,0,1,0,1|2,0,0]=4 1000 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 L18185 [0,0,0,1,0,1|2,0,0]=4 1001 B11R2.845 O=C(O)[C@@H]1N[C@H]2CC[C@@H]1C2 P45600 [0,0,0,1,0,1|2,0,0]=4 1002 B11R2.845 O=C(O)[C@H]1C[C@@H]2CC[C@H]1C2 P45173 [0,0,0,1,0,1|2,0,0]=4 1003 B11R2.845 O=C(O)[C@H]1C[C@H]2CC[C@@H]1C2 P44808 [0,0,0,1,0,1|2,0,0]=4 1004 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@H]1C2 L21485 [0,0,0,1,0,1|2,0,0]=4 1005 B11R2.845 O=C(O)[C@H]1N[C@@H]2CC[C@H]1C2 P44679 [0,0,0,1,0,1|2,0,0]=4 1006 B11R2.857 O=C(O)CC12CC(CN1)C2 P45285 [0,0,0,1,0,1|1,0,0]=3 1007 B11R2.857 O=C(O)CC12CC(CN1)C2 P45372 [0,0,0,1,0,1|1,0,0]=3 1008 B11R2.1826 O=C(O)C12CC(CCN1)C2 L13412 [0,0,0,1,0,1|1,0,0]=3 1009 B11R2.1826 O=C(O)C12CC(CCN1)C2 P49681 [0,0,0,1,0,1|1,0,0]=3 1010 B11R2.1826 O=C(O)C12CCCC(C1)C2 P44877 [0,0,0,1,0,1|2,0,0]=4 1011 B11R2.1837 O=C(O)C1CCCC2CC21 Q63672 [0,0,0,1,0,1|2,0,0]=4 1012 B11R2.1837 O=C(O)C1CCNC2CC21 Q61181 [0,0,0,1,0,1|2,0,0]=4 1013 B11R2.1837 O=C(O)C1NCCC2CC21 K12433 [0,0,0,1,0,1|1,0,0]=3 1014 B11R2.1837 O=C(O)C1NCCC2CC21 K12433HCL [0,0,0,1,0,1|1,0,0]=3 1015 B11R2.1837 O=C(O)[C@H]1NCC[C@@H]2C[C@@H]21 Q61198 [0,0,0,1,0,1|1,0,0]=3 1016 B11R2.1837 [C@@H]12CCNC(C(=O)O)[C@@H]1C2 O33017 [0,0,0,1,0,1|1,0,0]=3 1017 B11R2.1837 [C@H]12CCNC(C(=O)O)[C@H]1C2 O33015 [0,0,0,1,0,1|1,0,0]=3 1018 B11R2.162 CO[C@H]1C[C@H]2C[C@@H]1NC2=O P48336 [0,1,0,1,0,0|2,0,0]=4 1019 B11R2.901 COC(=O)C12CC(CN1)C2 P43885 [0,1,0,1,0,0|1,0,0]=3 1020 B11R2.911 COC(=O)[C@@H]1NC[C@H]2C[C@H]21 Q56648 [0,1,0,1,0,0|1,0,0]=3 1021 B11R2.911 COC(=O)[C@H]1NC[C@H]2C[C@H]21 L22487 [0,1,0,1,0,0|1,0,0]=3 1022 B11R2.914 COC(=O)C1CC2CC2C1 Q52111 [0,1,0,1,0,0|2,0,0]=4 1023 B11R2.914 COC(=O)C1CC2OC2C1 L14021 [0,1,0,1,0,0|1,0,0]=3 1024 B11R2.914 COC(=O)[C@H]1C[C@@H]2O[C@@H]2C1 L22442 [0,1,0,1,0,0|1,0,0]=3 1025 B11R2.822 [C@H]12CC[C@H]1CN[C@@H]2C(=O)O Q54445 [0,1,0,1,0,0|1,0,0]=3 1026 B11R2.822 [C@H]12CC[C@H]1CN[C@H]2C(=O)O Q53530 [0,1,0,1,0,0|1,0,0]=3 1027 B11R2.842 O=C(O)C1CC2CCC2C1 Q54737 [0,1,0,1,0,0|2,0,0]=4 1028 B11R2.842 O=C(O)[C@@H]1C[C@@H]2CC[C@@H]2N1 Q54449 [0,1,0,1,0,0|1,0,0]=3 1029 B11R2.1868 O=C(O)C1CC2(CC2)CN1 Q57063 [0,1,0,1,0,0|1,0,0]=3 1030 B11R2.1868 O=C(O)C1CCC2(CC2)C1 Q62621 [0,1,0,1,0,0|2,0,0]=4 1031 B11R2.1868 O=C(O)[C@@H]1CC2(CC2)CN1 L14923 [0,1,0,1,0,0|1,0,0]=3 1032 B11R2.1868 O=C(O)[C@@H]1CC2(CC2)CN1 Q55535 [0,1,0,1,0,0|1,0,0]=3 1033 B11R2.1868 O=C(O)[C@H]1CC2(CC2)CN1 Q55536 [0,1,0,1,0,0|1,0,0]=3 1034 B11R2.1868 O=C(O)[C@H]1CC2(CC2)CN1 Q55537 [0,1,0,1,0,0|1,0,0]=3 1035 B11R2.1051 O=C1NC2(C(=O)O)CC1C2 P49699 [0,1,0,1,0,0|1,0,1]=4 1036 B11R2.2454 NC12CCC(C(=O)O)(C1)C2 P47566 [0,1,0,1,0,0|2,0,0]=4 1037 B11R2.2454 O=C(O)C12CC(F)(CN1)C2 P49431 [0,1,0,1,0,0|1,0,0]=3 1038 B11R2.2454 O=C(O)C12CCC(F)(C1)C2 P46324 [0,1,0,1,0,0|2,0,0]=4 1039 B7R0.16 CC(C)[C@@H](O)C(=O)O P40530 [0,0,1,0,1,0|2,0,0]=4 1040 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O P39382 [0,0,1,0,1,0|0,0,0]=2 1041 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O Q70089 [0,0,1,0,1,0|0,0,0]=2 1042 B7R1.8 OCC1CCC1O P50851 [1,0,0,0,1,0|1,0,1]=4 1043 B7R1.8 OC[C@@H]1CC[C@H]1O P50820 [1,0,0,0,1,0|1,0,1]=4 1044 B7R1.8 OC[C@H]1CC[C@H]1O P48230 [1,0,0,0,1,0|1,0,1]=4 1045 B7R1.10 CNC1CC(O)C1 G-5725 [1,0,0,0,1,0|2,0,0]=4 1046 B7R1.10 CNC1CC(O)C1 P48534 [1,0,0,0,1,0|2,0,0]=4 1047 B7R1.10 CN[C@H]1C[C@@H](O)C1 I-9565 [1,0,0,0,1,0|2,0,0]=4 1048 B7R1.10 CN[C@H]1C[C@H](O)C1 G-7351 [1,0,0,0,1,0|2,0,0]=4 1049 B7R1.10 CN[C@H]1C[C@H](O)C1 P49935 [1,0,0,0,1,0|2,0,0]=4 1050 B7R1.10 COC1CC(O)C1 P48191 [1,0,0,0,1,0|2,0,0]=4 1051 B7R1.10 CO[C@H]1C[C@@H](O)C1 P46991 [1,0,0,0,1,0|2,0,0]=4 1052 B7R1.10 CO[C@H]1C[C@H](O)C1 P46971 [1,0,0,0,1,0|2,0,0]=4 1053 B7R1.10 N#CC1CC(O)C1 L13803 [1,0,0,0,1,0|1,0,1]=4 1054 B7R1.10 N#C[C@H]1C[C@@H](O)C1 P44973 [1,0,0,0,1,0|1,0,1]=4 1055 B7R1.10 N#C[C@H]1C[C@H](O)C1 P44972 [1,0,0,0,1,0|1,0,1]=4 1056 B7R1.10 NC1CC(CO)C1 C-3529 [1,0,0,0,1,0|1,0,1]=4 1057 B7R1.10 NC1CC(CO)C1 P44453 [1,0,0,0,1,0|1,0,1]=4 1058 B7R1.10 NCC1CC(O)C1 G-5291 [1,0,0,0,1,0|1,0,1]=4 1059 B7R1.10 NCC1CC(O)C1 P47397 [1,0,0,0,1,0|1,0,1]=4 1060 B7R1.10 NC[C@H]1C[C@@H](O)C1 C-2431 [1,0,0,0,1,0|1,0,1]=4 1061 B7R1.10 NC[C@H]1C[C@@H](O)C1 P44178 [1,0,0,0,1,0|1,0,1]=4 1062 B7R1.10 NC[C@H]1C[C@H](O)C1 C-2432 [1,0,0,0,1,0|1,0,1]=4 1063 B7R1.10 NC[C@H]1C[C@H](O)C1 C-2432-01 [1,0,0,0,1,0|1,0,1]=4 1064 B7R1.10 NN[C@H]1C[C@@H](O)C1 P50573 [1,0,0,0,1,0|2,0,0]=4 1065 B7R1.10 NN[C@H]1C[C@H](O)C1 P50572 [1,0,0,0,1,0|2,0,0]=4 1066 B7R1.10 N[C@H]1C[C@@H](CO)C1 C-3635 [1,0,0,0,1,0|1,0,1]=4 1067 B7R1.10 N[C@H]1C[C@@H](CO)C1 P48253 [1,0,0,0,1,0|1,0,1]=4 1068 B7R1.10 N[C@H]1C[C@H](CO)C1 C-3636 [1,0,0,0,1,0|1,0,1]=4 1069 B7R1.10 N[C@H]1C[C@H](CO)C1 P49246 [1,0,0,0,1,0|1,0,1]=4 1070 B7R1.10 O=CC1CC(F)C1 P47244 [1,0,0,0,1,0|1,0,0]=3 1071 B7R1.10 OC1CC(CBr)C1 P47356 [1,0,0,0,1,0|1,0,1]=4 1072 B7R1.10 OC1CC(CF)C1 P47254 [1,0,0,0,1,0|1,0,1]=4 1073 B7R1.10 OCC1CC(Cl)C1 I-9035 [1,0,0,0,1,0|1,0,1]=4 1074 B7R1.10 OCC1CC(F)C1 O33399 [1,0,0,0,1,0|1,0,1]=4 1075 B7R1.10 OCC1CC(O)C1 P49195 [1,0,0,0,1,0|0,0,1]=3 1076 B7R1.10 O[C@H]1C[C@@H](CBr)C1 P46704 [1,0,0,0,1,0|1,0,1]=4 1077 B7R1.10 O[C@H]1C[C@@H](CF)C1 P46123 [1,0,0,0,1,0|1,0,1]=4 1078 B7R1.10 O[C@H]1C[C@H](CBr)C1 P46014 [1,0,0,0,1,0|1,0,1]=4 1079 B7R1.18 CC(=O)C1CCC1 Q54751 [1,0,0,0,1,0|1,0,0]=3 1080 B7R1.18 CC(=O)C1CNC1 P44065 [1,0,0,0,1,0|2,0,0]=4 1081 B7R1.18 CC(=O)C1CNC1 P48871 [1,0,0,0,1,0|2,0,0]=4 1082 B7R1.18 CC(=O)C1CNC1 P48872 [1,0,0,0,1,0|2,0,0]=4 1083 B7R1.18 CC(=O)C1COC1 Q56096 [1,0,0,0,1,0|2,0,0]=4 1084 B7R1.18 CC(=O)N1CCC1 P45596 [1,0,0,0,1,0|2,0,0]=4 1085 B7R1.18 CC(O)C1CCC1 P45236 [1,0,0,0,1,0|1,0,1]=4 1086 B7R1.18 C[C@H](O)C1CCC1 P47847 [1,0,0,0,1,0|1,0,1]=4 1087 B7R1.18 N=C(N)C1CCC1 G-7205 [1,0,0,0,1,0|2,0,0]=4 1088 B7R1.18 NC(=O)C1CCC1 O34470 [1,0,0,0,1,0|1,0,0]=3 1089 B7R1.18 NC(=O)C1CCN1 O28301 [1,0,0,0,1,0|1,0,0]=3 1090 B7R1.18 NC(=O)C1CNC1 C-2241 [1,0,0,0,1,0|2,0,0]=4 1091 B7R1.18 NC(=O)C1CNC1 L21539 [1,0,0,0,1,0|2,0,0]=4 1092 B7R1.18 NC(=O)N1CCC1 P45464 [1,0,0,0,1,0|2,0,0]=4 1093 B7R1.18 NC(=S)C1CCC1 P47843 [1,0,0,0,1,0|1,1,0]=4 1094 B7R1.18 O=C(O)C1CCN1 B-1112 [1,0,0,0,1,0|0,0,0]=2 1095 B7R1.18 O=C(O)C1CCO1 D-2702 [1,0,0,0,1,0|1,0,0]=3 1096 B7R1.18 O=C(O)C1CNC1 A-422 [1,0,0,0,1,0|1,0,0]=3 1097 B7R1.18 O=C(O)C1CNC1 P42961 [1,0,0,0,1,0|1,0,0]=3 1098 B7R1.18 O=C(O)C1COC1 A-970 [1,0,0,0,1,0|1,0,0]=3 1099 B7R1.18 O=C(O)C1CSC1 H-8019 [1,0,0,0,1,0|1,0,0]=3 1100 B7R1.18 O=C(O)[C@@H]1CCN1 B-1110 [1,0,0,0,1,0|0,0,0]=2 1101 B7R1.18 O=C(O)[C@@H]1CCN1 P46195 [1,0,0,0,1,0|0,0,0]=2 1102 B7R1.18 O=C(O)[C@@H]1CCO1 Q62698 [1,0,0,0,1,0|1,0,0]=3 1103 B7R1.18 O=C(O)[C@H]1CCN1 B-1109 [1,0,0,0,1,0|0,0,0]=2 1104 B7R1.18 O=C(O)[C@H]1CCN1 P45364 [1,0,0,0,1,0|0,0,0]=2 1105 B7R1.18 O=C(O)[C@H]1CCO1 Q62699 [1,0,0,0,1,0|1,0,0]=3 1106 B7R1.18 OB(O)C1CCC1 P45097 [1,0,0,0,1,0|1,0,1]=4 1107 B7R1.12 CC1CC1C(=O)Cl O31612 [0,0,0,0,2,0|2,0,0]=4 1108 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O P44059 [0,0,0,0,2,0|1,0,0]=3 1109 B7R1.12 C[C@@H]1C[C@H]1C(=O)O L22375 [0,0,0,0,2,0|1,0,0]=3 1110 B7R1.12 C[C@H]1C[C@H]1C(=O)O O33127 [0,0,0,0,2,0|1,0,0]=3 1111 B7R1.12 O=C(O)C1CC1F Q52394 [0,0,0,0,2,0|1,0,0]=3 1112 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F K10809 [0,0,0,0,2,0|1,0,0]=3 1113 B7R1.12 O=C(O)[C@@H]1C[C@H]1F O33126 [0,0,0,0,2,0|1,0,0]=3 1114 B7R1.12 O=C(O)[C@@H]1C[C@H]1F O33327 [0,0,0,0,2,0|1,0,0]=3 1115 B7R1.12 O=C(O)[C@H]1C[C@@H]1F O33229 [0,0,0,0,2,0|1,0,0]=3 1116 B7R1.12 O=C(O)[C@H]1C[C@H]1F K10802 [0,0,0,0,2,0|1,0,0]=3 1117 B9R1.2 CC1CCCC(C=O)C1 Q59550 [1,0,0,0,0,1|2,0,0]=4 1118 B9R1.2 C[C@H]1CCOC(C=O)C1 Q57858 [1,0,0,0,0,1|2,0,0]=4 1119 B9R1.2 OCC1CNCC(F)C1 Q61297 [1,0,0,0,0,1|1,0,1]=4 1120 B9R1.13 CC(O)CC1CCCN1 Q59227 [1,0,0,0,0,1|1,0,1]=4 1121 B9R1.13 NC(=O)CC1CCCN1 Q61611 [1,0,0,0,0,1|1,0,0]=3 1122 B9R1.13 NC(=O)CC1CCCN1 Q61612 [1,0,0,0,0,1|1,0,0]=3 1123 B9R1.13 O=C(Cl)CC1CCCO1 L21210 [1,0,0,0,0,1|2,0,0]=4 1124 B9R1.13 O=C(O)CC1CCCN1 P36438 [1,0,0,0,0,1|0,0,0]=2 1125 B9R1.13 O=C(O)CC1CCCN1 P51099 [1,0,0,0,0,1|0,0,0]=2 1126 B9R1.13 O=C(O)CC1CCNC1 G-6773 [1,0,0,0,0,1|2,0,0]=4 1127 B9R1.13 O=C(O)CC1CCNC1 M22656 [1,0,0,0,0,1|2,0,0]=4 1128 B9R1.13 O=C(O)CC1CCOC1 A-556 [1,0,0,0,0,1|2,0,0]=4 1129 B9R1.13 O=C(O)CN1CCCC1 10114 [1,0,0,0,0,1|2,0,0]=4 1130 B9R1.13 O=C(O)C[C@@H]1CCCN1 P37561 [1,0,0,0,0,1|0,0,0]=2 1131 B9R1.13 O=C(O)C[C@@H]1CCCN1 Q68982 [1,0,0,0,0,1|0,0,0]=2 1132 B9R1.13 O=C(O)C[C@@H]1CCNC1 L21906 [1,0,0,0,0,1|2,0,0]=4 1133 B9R1.13 O=C(O)C[C@H]1CCCN1 P38072 [1,0,0,0,0,1|0,0,0]=2 1134 B9R1.13 O=C(O)C[C@H]1CCCN1 P51185 [1,0,0,0,0,1|0,0,0]=2 1135 B9R1.13 O=C(O)C[C@H]1CCOC1 Q55020 [1,0,0,0,0,1|2,0,0]=4 1136 B11R1.20 C[C@H]1CC[C@H](CC(=O)O)CC1 Q60800 [0,0,0,0,0,2|2,0,0]=4 1137 B11R1.20 NC1CCC(CC(=O)O)CC1 P42675 [0,0,0,0,0,2|2,0,0]=4 1138 B11R1.20 N[C@H]1CC[C@@H](CC(=O)O)CC1 P44179 [0,0,0,0,0,2|2,0,0]=4 1139 B11R1.20 N[C@H]1CC[C@H](CC(=O)O)CC1 P44177 [0,0,0,0,0,2|2,0,0]=4 1140 B11R1.20 O=C(O)CC1CCC(F)CC1 P45648 [0,0,0,0,0,2|2,0,0]=4 1141 B11R1.20 O=C(O)CC1CCC(O)CC1 K12393 [0,0,0,0,0,2|1,0,0]=3 1142 B11R1.20 O=C(O)C[C@H]1CC[C@@H](F)CC1 P47213 [0,0,0,0,0,2|2,0,0]=4 1143 B11R1.20 O=C(O)C[C@H]1CC[C@H](F)CC1 P47129 [0,0,0,0,0,2|2,0,0]=4 1144 B11R1.157 CC1CC(CC(=O)O)CCO1 Q63846 [0,0,0,0,0,2|2,0,0]=4 1145 B11R1.157 O=C(O)CC1CCCC(F)C1 P47902 [0,0,0,0,0,2|2,0,0]=4 1146 B11R1.157 O=C(O)C[C@@H]1CCC[C@@H](F)C1 P46710 [0,0,0,0,0,2|2,0,0]=4 1147 B11R1.157 O=C(O)C[C@H]1CCC[C@@H](F)C1 P46711 [0,0,0,0,0,2|2,0,0]=4