REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = "3-[4-(2-PYRROLIDIN-1-YL-ETHOXY)-BENZYL]-2-4-(2-PYRROLIDIN-1-YL-ETHOXY)-PHENYL] -BENZO[B]THIOPHEN-6-OL" RESIDUE BT3 20 92 1 92 1 CHI1 0 0 0.0000 4 5 6 7 40 2 CHI2 0 0 0.0000 8 13 14 15 39 3 CHI3 0 0 0.0000 13 14 15 16 39 4 CHI4 0 0 0.0000 14 15 16 17 36 5 CHI5 0 0 0.0000 15 16 17 18 33 6 CHI6 0 0 0.0000 16 17 18 19 25 7 CHI7 0 0 0.0000 17 18 19 20 22 8 CHI8 0 0 0.0000 16 17 26 27 33 9 CHI9 0 0 0.0000 17 26 27 28 30 10 CHI10 0 0 0.0000 5 45 46 47 88 11 CHI11 0 0 0.0000 45 46 47 48 83 12 CHI12 0 0 0.0000 49 54 55 56 80 13 CHI13 0 0 0.0000 54 55 56 57 80 14 CHI14 0 0 0.0000 55 56 57 58 77 15 CHI15 0 0 0.0000 56 57 58 59 74 16 CHI16 0 0 0.0000 57 58 59 60 66 17 CHI17 0 0 0.0000 58 59 60 61 63 18 CHI18 0 0 0.0000 57 58 67 68 74 19 CHI19 0 0 0.0000 58 67 68 69 71 20 PHI1 0 0 0.0000 2 1 91 92 0 1 C1 C_ARO 0 0.0000 -4.4120 -0.2960 5.3390 2 42 91 0 0 2 C2 C_ARO 0 0.0000 -4.6990 -0.9980 4.1780 1 3 41 0 0 3 C3 C_ARO 0 0.0000 -4.0890 -0.6350 2.9980 2 4 44 0 0 4 S1 S_RED 0 0.0000 -4.1670 -1.2380 1.3310 3 5 0 0 0 5 C8 C_ARO 0 0.0000 -3.0130 -0.1100 0.5730 4 6 45 0 0 6 C10 C_ARO 0 0.0000 -2.5900 -0.0460 -0.8420 5 7 11 0 0 7 C12 C_ARO 0 0.0000 -2.6170 1.1690 -1.5370 6 8 10 0 0 8 C14 C_ARO 0 0.0000 -2.2130 1.1790 -2.8580 7 9 13 0 0 9 H14 H_ALI 0 0.0000 -2.2200 2.0980 -3.4240 8 0 0 0 0 10 H12 H_ALI 0 0.0000 -2.9450 2.0770 -1.0520 7 0 0 0 0 11 C20 C_ARO 0 0.0000 -2.1550 -1.1930 -1.5030 6 12 40 0 0 12 N1 N_AMO 0 0.0000 -1.7830 -1.1400 -2.7660 11 13 0 0 0 13 C16 C_ARO 0 0.0000 -1.7970 -0.0080 -3.4500 8 12 14 0 0 14 O2 O_EST 0 0.0000 -1.3990 -0.0050 -4.7470 13 15 0 0 0 15 C24 C_ALI 0 0.0000 -1.0350 -1.3480 -5.0700 14 16 37 38 0 16 C34 C_ALI 0 0.0000 -0.5740 -1.4150 -6.5270 15 17 34 35 0 17 N3 N_AMO 0 0.0000 0.5860 -0.5340 -6.7150 16 18 26 0 0 18 C22 C_ALI 0 0.0000 0.9770 -0.6450 -8.1320 17 19 23 24 0 19 C30 C_ALI 0 0.0000 0.7620 0.7400 -8.7750 18 20 21 27 0 20 H301 H_ALI 0 0.0000 1.5670 0.9700 -9.4730 19 0 0 0 22 21 H302 H_ALI 0 0.0000 -0.2060 0.7880 -9.2730 19 0 0 0 22 22 Q1 PSEUD 0 0.0000 0.6805 0.8790 -9.3730 0 0 0 0 0 23 H221 H_ALI 0 0.0000 2.0270 -0.9290 -8.2060 18 0 0 0 25 24 H222 H_ALI 0 0.0000 0.3550 -1.3870 -8.6320 18 0 0 0 25 25 Q2 PSEUD 0 0.0000 1.1910 -1.1580 -8.4190 0 0 0 0 0 26 C28 C_ALI 0 0.0000 0.1180 0.8440 -6.4620 17 27 31 32 0 27 C29 C_ALI 0 0.0000 0.8000 1.7010 -7.5580 19 26 28 29 0 28 H291 H_ALI 0 0.0000 1.8270 1.9410 -7.2820 27 0 0 0 30 29 H292 H_ALI 0 0.0000 0.2290 2.6070 -7.7570 27 0 0 0 30 30 Q3 PSEUD 0 0.0000 1.0280 2.2740 -7.5195 0 0 0 0 0 31 H281 H_ALI 0 0.0000 -0.9660 0.9000 -6.5570 26 0 0 0 33 32 H282 H_ALI 0 0.0000 0.4310 1.1760 -5.4720 26 0 0 0 33 33 Q4 PSEUD 0 0.0000 -0.2675 1.0380 -6.0145 0 0 0 0 0 34 H341 H_ALI 0 0.0000 -0.2960 -2.4400 -6.7740 16 0 0 0 36 35 H342 H_ALI 0 0.0000 -1.3850 -1.0910 -7.1800 16 0 0 0 36 36 Q5 PSEUD 0 0.0000 -0.8405 -1.7655 -6.9770 0 0 0 0 0 37 H241 H_ALI 0 0.0000 -0.2240 -1.6720 -4.4170 15 0 0 0 39 38 H242 H_ALI 0 0.0000 -1.8960 -2.0020 -4.9310 15 0 0 0 39 39 Q6 PSEUD 0 0.0000 -1.0600 -1.8370 -4.6740 0 0 0 0 0 40 H20 H_ALI 0 0.0000 -2.1300 -2.1370 -0.9770 11 0 0 0 0 41 H2 H_ALI 0 0.0000 -5.3960 -1.8230 4.1990 2 0 0 0 0 42 C6 C_ARO 0 0.0000 -3.5050 0.7580 5.2930 1 43 90 0 0 43 C5 C_ARO 0 0.0000 -2.8950 1.1200 4.1340 42 44 89 0 0 44 C4 C_ARO 0 0.0000 -3.1650 0.4310 2.9270 3 43 45 0 0 45 C9 C_ARO 0 0.0000 -2.6160 0.6730 1.6030 5 44 46 0 0 46 C7 C_ALI 0 0.0000 -1.6170 1.7800 1.3800 45 47 86 87 0 47 C13 C_ARO 0 0.0000 -0.2230 1.2470 1.5830 46 48 52 0 0 48 C11 C_ARO 0 0.0000 0.4740 0.7160 0.5140 47 49 51 0 0 49 C21 C_ARO 0 0.0000 1.7530 0.2260 0.6960 48 50 54 0 0 50 H21 H_ALI 0 0.0000 2.2970 -0.1890 -0.1380 49 0 0 0 84 51 H11 H_ALI 0 0.0000 0.0190 0.6830 -0.4640 48 0 0 0 83 52 C15 C_ARO 0 0.0000 0.3590 1.2940 2.8360 47 53 82 0 0 53 C32 C_ARO 0 0.0000 1.6350 0.8010 3.0250 52 54 81 0 0 54 C19 C_ARO 0 0.0000 2.3370 0.2670 1.9540 49 53 55 0 0 55 O3 O_EST 0 0.0000 3.5950 -0.2120 2.1370 54 56 0 0 0 56 C25 C_ALI 0 0.0000 3.9100 -0.0310 3.5190 55 57 78 79 0 57 C33 C_ALI 0 0.0000 5.3210 -0.5550 3.7930 56 58 75 76 0 58 N2 N_AMO 0 0.0000 6.2870 0.1840 2.9690 57 59 67 0 0 59 C26 C_ALI 0 0.0000 7.6190 -0.3650 3.2800 58 60 64 65 0 60 C23 C_ALI 0 0.0000 8.1540 -1.0240 1.9910 59 61 62 68 0 61 H231 H_ALI 0 0.0000 9.2200 -0.8320 1.8750 60 0 0 0 63 62 H232 H_ALI 0 0.0000 7.9510 -2.0950 1.9930 60 0 0 0 63 63 Q7 PSEUD 0 0.0000 8.5855 -1.4635 1.9340 0 0 0 0 0 64 H261 H_ALI 0 0.0000 8.2880 0.4360 3.5920 59 0 0 0 66 65 H262 H_ALI 0 0.0000 7.5360 -1.1110 4.0710 59 0 0 0 66 66 Q8 PSEUD 0 0.0000 7.9120 -0.3375 3.8315 0 0 0 0 0 67 C27 C_ALI 0 0.0000 5.9670 -0.1240 1.5590 58 68 72 73 0 68 C17 C_ALI 0 0.0000 7.3430 -0.3150 0.8740 60 67 69 70 0 69 H171 H_ALI 0 0.0000 7.7890 0.6460 0.6190 68 0 0 0 71 70 H172 H_ALI 0 0.0000 7.2560 -0.9490 -0.0070 68 0 0 0 71 71 Q9 PSEUD 0 0.0000 7.5225 -0.1515 0.3060 0 0 0 0 0 72 H271 H_ALI 0 0.0000 5.3810 -1.0400 1.4950 67 0 0 0 74 73 H272 H_ALI 0 0.0000 5.4280 0.7050 1.1020 67 0 0 0 74 74 Q10 PSEUD 0 0.0000 5.4045 -0.1675 1.2985 0 0 0 0 0 75 H331 H_ALI 0 0.0000 5.5620 -0.4160 4.8470 57 0 0 0 77 76 H332 H_ALI 0 0.0000 5.3700 -1.6150 3.5450 57 0 0 0 77 77 Q11 PSEUD 0 0.0000 5.4660 -1.0155 4.1960 0 0 0 0 0 78 H251 H_ALI 0 0.0000 3.8620 1.0280 3.7660 56 0 0 0 80 79 H252 H_ALI 0 0.0000 3.1940 -0.5800 4.1300 56 0 0 0 80 80 Q12 PSEUD 0 0.0000 3.5280 0.2240 3.9480 0 0 0 0 0 81 H32 H_ALI 0 0.0000 2.0880 0.8340 4.0050 53 0 0 0 84 82 H15 H_ALI 0 0.0000 -0.1870 1.7100 3.6690 52 0 0 0 83 83 Q14 PSEUD 0 0.0000 -0.0840 1.1965 1.6025 0 0 0 0 85 84 Q15 PSEUD 0 0.0000 2.1925 0.3225 1.9335 0 0 0 0 85 85 QQA PSEUD 0 0.0000 1.0543 0.7595 1.7680 0 0 0 0 0 86 H71 H_ALI 0 0.0000 -1.7170 2.1600 0.3640 46 0 0 0 88 87 H72 H_ALI 0 0.0000 -1.8050 2.5860 2.0900 46 0 0 0 88 88 Q13 PSEUD 0 0.0000 -1.7610 2.3730 1.2270 0 0 0 0 0 89 H5 H_ALI 0 0.0000 -2.1960 1.9440 4.1330 43 0 0 0 0 90 H6 H_ALI 0 0.0000 -3.2800 1.3010 6.2000 42 0 0 0 0 91 O1 O_HYD 0 0.0000 -5.0080 -0.6380 6.5120 1 92 0 0 0 92 HO1 H_OXY 0 0.0000 -5.8230 -0.1210 6.5720 91 0 0 0 0