REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = "REIDISPONGIOLIDE C" RESIDUE RGC 55 173 1 173 1 CHI1 0 0 0.0000 1 2 3 4 111 2 CHI2 0 0 0.0000 3 4 5 6 109 3 CHI3 0 0 0.0000 5 6 7 8 11 4 CHI4 0 0 0.0000 5 6 12 13 108 5 CHI5 0 0 0.0000 6 12 13 14 105 6 CHI6 0 0 0.0000 12 13 14 15 19 7 CHI7 0 0 0.0000 13 14 15 16 19 8 CHI8 0 0 0.0000 12 13 20 21 104 9 CHI9 0 0 0.0000 13 20 21 22 101 10 CHI10 0 0 0.0000 21 22 23 24 24 11 CHI11 0 0 0.0000 20 21 26 27 101 12 CHI12 0 0 0.0000 21 26 27 28 98 13 CHI13 0 0 0.0000 26 27 29 30 97 14 CHI14 0 0 0.0000 27 29 30 31 34 15 CHI15 0 0 0.0000 27 29 35 36 96 16 CHI16 0 0 0.0000 29 35 36 37 41 17 CHI17 0 0 0.0000 35 36 37 38 41 18 CHI18 0 0 0.0000 29 35 42 43 95 19 CHI19 0 0 0.0000 35 42 43 44 92 20 CHI20 0 0 0.0000 42 43 44 45 49 21 CHI21 0 0 0.0000 43 44 45 46 49 22 CHI22 0 0 0.0000 42 43 50 51 91 23 CHI23 0 0 0.0000 50 51 52 53 89 24 CHI24 0 0 0.0000 51 52 53 54 57 25 CHI25 0 0 0.0000 51 52 58 59 88 26 CHI26 0 0 0.0000 52 58 59 60 64 27 CHI27 0 0 0.0000 58 59 60 61 64 28 CHI28 0 0 0.0000 52 58 65 66 87 29 CHI29 0 0 0.0000 58 65 66 67 84 30 CHI30 0 0 0.0000 65 66 67 68 72 31 CHI31 0 0 0.0000 66 67 68 69 72 32 CHI32 0 0 0.0000 65 66 73 74 83 33 CHI33 0 0 0.0000 73 74 75 76 81 34 CHI34 0 0 0.0000 74 75 76 77 80 35 PHI1 0 0 0.0000 1 2 112 113 0 36 PHI2 0 0 0.0000 2 112 113 115 0 37 PHI3 0 0 0.0000 112 113 115 122 0 38 CHI35 0 0 0.0000 113 115 116 117 120 39 PHI4 0 0 0.0000 113 115 122 130 0 40 CHI36 0 0 0.0000 115 122 123 124 128 41 CHI37 0 0 0.0000 122 123 124 125 128 42 PHI5 0 0 0.0000 115 122 130 137 0 43 CHI38 0 0 0.0000 122 130 131 132 135 44 PHI6 0 0 0.0000 122 130 137 141 0 45 PHI7 0 0 0.0000 130 137 141 145 0 46 PHI8 0 0 0.0000 137 141 145 147 0 47 PHI9 0 0 0.0000 141 145 147 154 0 48 CHI39 0 0 0.0000 145 147 148 149 152 49 PHI10 0 0 0.0000 145 147 154 162 0 50 CHI40 0 0 0.0000 147 154 155 156 160 51 CHI41 0 0 0.0000 154 155 156 157 160 52 PHI11 0 0 0.0000 147 154 162 166 0 53 PHI12 0 0 0.0000 154 162 166 170 0 54 PHI13 0 0 0.0000 162 166 170 173 0 55 CHI42 0 0 0.0000 166 170 171 172 172 1 O1 O_BYL 0 0.0000 3.0790 -3.0850 -4.8040 2 0 0 0 0 2 C1 C_BYL 0 0.0000 3.1150 -3.6560 -3.7260 1 3 112 0 0 3 C2 C_BYL 0 0.0000 3.9420 -4.8410 -3.4090 2 4 111 0 0 4 C3 C_BYL 0 0.0000 4.7320 -5.3800 -4.3490 3 5 110 0 0 5 C4 C_BYL 0 0.0000 5.5820 -6.5200 -4.0770 4 6 109 0 0 6 C5 C_BYL 0 0.0000 6.3650 -7.1900 -4.9450 5 7 12 0 0 7 C38 C_ALI 0 0.0000 6.5300 -6.8720 -6.4070 6 8 9 10 0 8 H381 H_ALI 0 0.0000 6.6980 -7.7930 -6.9570 7 0 0 0 11 9 H382 H_ALI 0 0.0000 7.3780 -6.2050 -6.5360 7 0 0 0 11 10 H383 H_ALI 0 0.0000 5.6300 -6.3850 -6.7710 7 0 0 0 11 11 Q1 PSEUD 0 0.0000 6.5687 -6.7943 -6.7547 0 0 0 0 0 12 C6 C_ALI 0 0.0000 7.1960 -8.3620 -4.4440 6 13 106 107 0 13 C7 C_ALI 0 0.0000 6.3650 -9.6420 -4.2790 12 14 20 105 0 14 O7 O_EST 0 0.0000 5.9790 -10.1370 -5.5620 13 15 0 0 0 15 C48 C_ALI 0 0.0000 7.1120 -10.4570 -6.3520 14 16 17 18 0 16 H481 H_ALI 0 0.0000 7.1560 -11.5380 -6.5050 15 0 0 0 19 17 H482 H_ALI 0 0.0000 8.0190 -10.1130 -5.8480 15 0 0 0 19 18 H483 H_ALI 0 0.0000 7.0240 -9.9580 -7.3200 15 0 0 0 19 19 Q2 PSEUD 0 0.0000 7.3997 -10.5363 -6.5577 0 0 0 0 0 20 C8 C_ALI 0 0.0000 7.1820 -10.7450 -3.5840 13 21 102 103 0 21 C9 C_BYL 0 0.0000 6.2960 -11.8450 -3.0510 20 22 26 0 0 22 C39 C_BYL 0 0.0000 6.1420 -13.0180 -3.6820 21 23 25 0 0 23 C40 C_BYL 0 0.0000 5.2870 -14.0790 -3.1150 22 24 28 0 0 24 O40 O_BYL 0 0.0000 5.3450 -15.2270 -3.5410 23 0 0 0 0 25 H39 H_ALI 0 0.0000 6.6680 -13.2430 -4.6040 22 0 0 0 0 26 C10 C_ALI 0 0.0000 5.5730 -11.5880 -1.7590 21 27 99 100 0 27 C11 C_ALI 0 0.0000 4.2340 -12.3190 -1.8110 26 28 29 98 0 28 O11 O_EST 0 0.0000 4.4540 -13.7190 -2.1020 23 27 0 0 0 29 C12 C_ALI 0 0.0000 3.4140 -12.1840 -0.5010 27 30 35 97 0 30 C41 C_ALI 0 0.0000 4.0420 -12.9980 0.6450 29 31 32 33 0 31 H411 H_ALI 0 0.0000 4.4830 -13.9230 0.2620 30 0 0 0 34 32 H412 H_ALI 0 0.0000 4.8280 -12.4200 1.1410 30 0 0 0 34 33 H413 H_ALI 0 0.0000 3.2840 -13.2600 1.3900 30 0 0 0 34 34 Q3 PSEUD 0 0.0000 4.1983 -13.2010 0.9310 0 0 0 0 0 35 C13 C_ALI 0 0.0000 1.9280 -12.6010 -0.7110 29 36 42 96 0 36 O13 O_EST 0 0.0000 1.2630 -12.6820 0.5530 35 37 0 0 0 37 C49 C_ALI 0 0.0000 1.2350 -11.4200 1.2000 36 38 39 40 0 38 H491 H_ALI 0 0.0000 1.8950 -10.7260 0.6750 37 0 0 0 41 39 H492 H_ALI 0 0.0000 1.5580 -11.5340 2.2370 37 0 0 0 41 40 H493 H_ALI 0 0.0000 0.2130 -11.0330 1.1790 37 0 0 0 41 41 Q4 PSEUD 0 0.0000 1.2220 -11.0977 1.3637 0 0 0 0 0 42 C14 C_ALI 0 0.0000 1.1550 -11.5910 -1.5870 35 43 93 94 0 43 C15 C_ALI 0 0.0000 -0.3120 -11.9880 -1.8350 42 44 50 92 0 44 O15 O_EST 0 0.0000 -0.3190 -13.2650 -2.4790 43 45 0 0 0 45 C50 C_ALI 0 0.0000 -1.6400 -13.7610 -2.6200 44 46 47 48 0 46 H501 H_ALI 0 0.0000 -2.1500 -13.2190 -3.4200 45 0 0 0 49 47 H502 H_ALI 0 0.0000 -2.1800 -13.6330 -1.6780 45 0 0 0 49 48 H503 H_ALI 0 0.0000 -1.5960 -14.8230 -2.8720 45 0 0 0 49 49 Q5 PSEUD 0 0.0000 -1.9753 -13.8917 -2.6567 0 0 0 0 0 50 C16 C_BYL 0 0.0000 -1.1170 -11.0340 -2.6830 43 51 91 0 0 51 C17 C_BYL 0 0.0000 -0.7420 -9.8250 -3.1300 50 52 90 0 0 52 C18 C_ALI 0 0.0000 -1.6170 -8.9480 -3.9990 51 53 58 89 0 53 C42 C_ALI 0 0.0000 -0.8470 -8.5340 -5.2560 52 54 55 56 0 54 H421 H_ALI 0 0.0000 -1.5250 -8.4420 -6.1090 53 0 0 0 57 55 H422 H_ALI 0 0.0000 -0.3520 -7.5710 -5.1030 53 0 0 0 57 56 H423 H_ALI 0 0.0000 -0.0840 -9.2790 -5.5010 53 0 0 0 57 57 Q6 PSEUD 0 0.0000 -0.6537 -8.4307 -5.5710 0 0 0 0 0 58 C19 C_ALI 0 0.0000 -2.1910 -7.7270 -3.2400 52 59 65 88 0 59 O19 O_EST 0 0.0000 -3.0960 -8.2280 -2.2520 58 60 0 0 0 60 C51 C_ALI 0 0.0000 -4.0660 -9.0840 -2.8330 59 61 62 63 0 61 H511 H_ALI 0 0.0000 -3.7770 -9.3190 -3.8600 60 0 0 0 64 62 H512 H_ALI 0 0.0000 -5.0410 -8.5910 -2.8210 60 0 0 0 64 63 H513 H_ALI 0 0.0000 -4.1190 -10.0070 -2.2510 60 0 0 0 64 64 Q7 PSEUD 0 0.0000 -4.3123 -9.3057 -2.9773 0 0 0 0 0 65 C20 C_ALI 0 0.0000 -1.1460 -6.8000 -2.5860 58 66 85 86 0 66 C21 C_ALI 0 0.0000 -1.7750 -5.4950 -2.0600 65 67 73 84 0 67 O21 O_EST 0 0.0000 -2.6580 -5.7940 -0.9800 66 68 0 0 0 68 C52 C_ALI 0 0.0000 -3.3000 -4.6230 -0.4980 67 69 70 71 0 69 H521 H_ALI 0 0.0000 -3.0310 -3.7730 -1.1300 68 0 0 0 72 70 H522 H_ALI 0 0.0000 -2.9920 -4.4360 0.5330 68 0 0 0 72 71 H523 H_ALI 0 0.0000 -4.3820 -4.7710 -0.5320 68 0 0 0 72 72 Q8 PSEUD 0 0.0000 -3.4683 -4.3267 -0.3763 0 0 0 0 0 73 C22 C_BYL 0 0.0000 -0.7370 -4.5300 -1.5560 66 74 83 0 0 74 C23 C_BYL 0 0.0000 -0.4980 -3.3400 -2.1290 73 75 82 0 0 75 C24 C_ALI 0 0.0000 0.4860 -2.3190 -1.5990 74 76 81 113 0 76 C43 C_ALI 0 0.0000 -0.2810 -1.0310 -1.2900 75 77 78 79 0 77 H431 H_ALI 0 0.0000 -0.7530 -1.0920 -0.3040 76 0 0 0 80 78 H432 H_ALI 0 0.0000 0.3950 -0.1700 -1.2950 76 0 0 0 80 79 H433 H_ALI 0 0.0000 -1.0630 -0.8600 -2.0360 76 0 0 0 80 80 Q9 PSEUD 0 0.0000 -0.4737 -0.7073 -1.2117 0 0 0 0 0 81 H24 H_ALI 0 0.0000 0.9130 -2.6940 -0.6590 75 0 0 0 0 82 H23 H_ALI 0 0.0000 -1.0580 -3.0620 -3.0200 74 0 0 0 0 83 H22 H_ALI 0 0.0000 -0.1820 -4.8160 -0.6660 73 0 0 0 0 84 H21 H_ALI 0 0.0000 -2.3740 -5.0370 -2.8560 66 0 0 0 0 85 H201 H_ALI 0 0.0000 -0.3640 -6.5480 -3.3110 65 0 0 0 87 86 H202 H_ALI 0 0.0000 -0.6790 -7.3260 -1.7440 65 0 0 0 87 87 Q10 PSEUD 0 0.0000 -0.5215 -6.9370 -2.5275 0 0 0 0 0 88 H19 H_ALI 0 0.0000 -2.7930 -7.1440 -3.9500 58 0 0 0 0 89 H18 H_ALI 0 0.0000 -2.4760 -9.5470 -4.3350 52 0 0 0 0 90 H17 H_ALI 0 0.0000 0.2390 -9.4320 -2.8800 51 0 0 0 0 91 H16 H_ALI 0 0.0000 -2.1150 -11.3850 -2.9430 50 0 0 0 0 92 H15 H_ALI 0 0.0000 -0.8270 -12.1040 -0.8740 43 0 0 0 0 93 H141 H_ALI 0 0.0000 1.6510 -11.4920 -2.5570 42 0 0 0 95 94 H142 H_ALI 0 0.0000 1.1780 -10.6110 -1.0940 42 0 0 0 95 95 Q11 PSEUD 0 0.0000 1.4145 -11.0515 -1.8255 0 0 0 0 0 96 H13 H_ALI 0 0.0000 1.8880 -13.6000 -1.1570 35 0 0 0 0 97 H12 H_ALI 0 0.0000 3.4240 -11.1310 -0.1880 29 0 0 0 0 98 H11 H_ALI 0 0.0000 3.6570 -11.9100 -2.6470 27 0 0 0 0 99 H101 H_ALI 0 0.0000 6.2090 -11.9400 -0.9400 26 0 0 0 101 100 H102 H_ALI 0 0.0000 5.3960 -10.5170 -1.6100 26 0 0 0 101 101 Q12 PSEUD 0 0.0000 5.8025 -11.2285 -1.2750 0 0 0 0 0 102 H81 H_ALI 0 0.0000 7.7540 -10.3330 -2.7440 20 0 0 0 104 103 H82 H_ALI 0 0.0000 7.9130 -11.1630 -4.2880 20 0 0 0 104 104 Q13 PSEUD 0 0.0000 7.8335 -10.7480 -3.5160 0 0 0 0 0 105 H7 H_ALI 0 0.0000 5.4500 -9.4320 -3.7110 13 0 0 0 0 106 H61 H_ALI 0 0.0000 8.0290 -8.5400 -5.1360 12 0 0 0 108 107 H62 H_ALI 0 0.0000 7.6490 -8.0850 -3.4820 12 0 0 0 108 108 Q14 PSEUD 0 0.0000 7.8390 -8.3125 -4.3090 0 0 0 0 0 109 H4 H_ALI 0 0.0000 5.5680 -6.8650 -3.0430 5 0 0 0 0 110 H3 H_ALI 0 0.0000 4.7520 -4.9530 -5.3450 4 0 0 0 0 111 H2 H_ALI 0 0.0000 3.8970 -5.2420 -2.4010 3 0 0 0 0 112 O25 O_EST 0 0.0000 2.4390 -3.3220 -2.5950 2 113 0 0 0 113 C25 C_ALI 0 0.0000 1.6340 -2.1150 -2.6160 75 112 114 115 0 114 H25 H_ALI 0 0.0000 1.2200 -1.9580 -3.6210 113 0 0 0 0 115 C26 C_ALI 0 0.0000 2.5570 -0.9510 -2.2590 113 116 121 122 0 116 C44 C_ALI 0 0.0000 3.1360 -1.1670 -0.8580 115 117 118 119 0 117 H441 H_ALI 0 0.0000 2.3370 -1.3680 -0.1350 116 0 0 0 120 118 H442 H_ALI 0 0.0000 3.8250 -2.0180 -0.8430 116 0 0 0 120 119 H443 H_ALI 0 0.0000 3.6740 -0.2830 -0.5020 116 0 0 0 120 120 Q15 PSEUD 0 0.0000 3.2787 -1.2230 -0.4933 0 0 0 0 0 121 H26 H_ALI 0 0.0000 1.9300 -0.0480 -2.2380 115 0 0 0 0 122 C27 C_ALI 0 0.0000 3.6610 -0.7750 -3.3350 115 123 129 130 0 123 O27 O_EST 0 0.0000 3.0430 -0.6350 -4.6170 122 124 0 0 0 124 C53 C_ALI 0 0.0000 2.2590 0.5450 -4.6830 123 125 126 127 0 125 H531 H_ALI 0 0.0000 2.4290 1.1460 -3.7860 124 0 0 0 128 126 H532 H_ALI 0 0.0000 1.2020 0.2780 -4.7610 124 0 0 0 128 127 H533 H_ALI 0 0.0000 2.5540 1.1190 -5.5640 124 0 0 0 128 128 Q16 PSEUD 0 0.0000 2.0617 0.8477 -4.7037 0 0 0 0 0 129 H27 H_ALI 0 0.0000 4.2410 -1.7060 -3.3770 122 0 0 0 0 130 C28 C_ALI 0 0.0000 4.6590 0.3950 -3.1110 122 131 136 137 0 131 C45 C_ALI 0 0.0000 5.4570 0.2510 -1.8090 130 132 133 134 0 132 H451 H_ALI 0 0.0000 6.1960 1.0500 -1.7000 131 0 0 0 135 133 H452 H_ALI 0 0.0000 5.9820 -0.7080 -1.7610 131 0 0 0 135 134 H453 H_ALI 0 0.0000 4.8010 0.3160 -0.9350 131 0 0 0 135 135 Q17 PSEUD 0 0.0000 5.6597 0.2193 -1.4653 0 0 0 0 0 136 H28 H_ALI 0 0.0000 4.0860 1.3280 -3.0540 130 0 0 0 0 137 C29 C_ALI 0 0.0000 5.6080 0.5060 -4.3290 130 138 139 141 0 138 H291 H_ALI 0 0.0000 5.0030 0.6070 -5.2400 137 0 0 0 140 139 H292 H_ALI 0 0.0000 6.2110 1.4200 -4.2570 137 0 0 0 140 140 Q18 PSEUD 0 0.0000 5.6070 1.0135 -4.7485 0 0 0 0 0 141 C30 C_ALI 0 0.0000 6.5360 -0.6990 -4.4940 137 142 143 145 0 142 H301 H_ALI 0 0.0000 7.1600 -0.8280 -3.6040 141 0 0 0 144 143 H302 H_ALI 0 0.0000 5.9390 -1.6060 -4.6410 141 0 0 0 144 144 Q19 PSEUD 0 0.0000 6.5495 -1.2170 -4.1225 0 0 0 0 0 145 C31 C_BYL 0 0.0000 7.4750 -0.5510 -5.6830 141 146 147 0 0 146 O31 O_BYL 0 0.0000 7.4760 0.4520 -6.3970 145 0 0 0 0 147 C32 C_ALI 0 0.0000 8.4150 -1.7290 -5.9510 145 148 153 154 0 148 C46 C_ALI 0 0.0000 9.6850 -1.5830 -5.1100 147 149 150 151 0 149 H461 H_ALI 0 0.0000 10.2740 -0.7080 -5.4060 148 0 0 0 152 150 H462 H_ALI 0 0.0000 9.4310 -1.4590 -4.0510 148 0 0 0 152 151 H463 H_ALI 0 0.0000 10.3210 -2.4680 -5.1970 148 0 0 0 152 152 Q20 PSEUD 0 0.0000 10.0087 -1.5450 -4.8847 0 0 0 0 0 153 H32 H_ALI 0 0.0000 7.8940 -2.6310 -5.6040 147 0 0 0 0 154 C33 C_ALI 0 0.0000 8.6730 -1.8420 -7.4680 147 155 161 162 0 155 O33 O_EST 0 0.0000 9.3360 -0.6600 -7.9110 154 156 0 0 0 156 C54 C_ALI 0 0.0000 9.6390 -0.7260 -9.2970 155 157 158 159 0 157 H541 H_ALI 0 0.0000 9.0770 0.0450 -9.8300 156 0 0 0 160 158 H542 H_ALI 0 0.0000 9.3780 -1.7150 -9.6810 156 0 0 0 160 159 H543 H_ALI 0 0.0000 10.7090 -0.5540 -9.4350 156 0 0 0 160 160 Q21 PSEUD 0 0.0000 9.7213 -0.7413 -9.6487 0 0 0 0 0 161 H33 H_ALI 0 0.0000 9.3470 -2.6860 -7.6570 154 0 0 0 0 162 C34 C_ALI 0 0.0000 7.3680 -2.0430 -8.2580 154 163 164 166 0 163 H341 H_ALI 0 0.0000 7.6110 -2.1000 -9.3260 162 0 0 0 165 164 H342 H_ALI 0 0.0000 6.7070 -1.1810 -8.1150 162 0 0 0 165 165 Q22 PSEUD 0 0.0000 7.1590 -1.6405 -8.7205 0 0 0 0 0 166 C35 C_ALI 0 0.0000 6.6170 -3.3220 -7.8830 162 167 168 170 0 167 H351 H_ALI 0 0.0000 6.3880 -3.3460 -6.8110 166 0 0 0 169 168 H352 H_ALI 0 0.0000 7.2460 -4.1980 -8.0810 166 0 0 0 169 169 Q23 PSEUD 0 0.0000 6.8170 -3.7720 -7.4460 0 0 0 0 0 170 C36 C_BYL 0 0.0000 5.3370 -3.5070 -8.6550 166 171 173 0 0 171 O2 O_HYD 0 0.0000 4.4490 -4.2600 -7.9610 170 172 0 0 0 172 HO2 H_OXY 0 0.0000 3.6100 -4.3850 -8.4540 171 0 0 0 0 173 O3 O_BYL 0 0.0000 5.1190 -3.0390 -9.7630 170 0 0 0 0