REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = 4-(2-{[4-{[3-(4-CHLOROPHENYL)PROPYL]SULFANYL}-6-(1-PIPERAZINYL)-1,3,5-TRIAZIN-2-YL]AMINO}ETHYL)PHENOL RESIDUE MON 16 77 1 77 1 CHI1 0 0 0.0000 21 1 2 3 20 2 CHI2 0 0 0.0000 1 2 3 4 16 3 CHI3 0 0 0.0000 2 3 4 5 13 4 CHI4 0 0 0.0000 3 4 5 6 10 5 CHI5 0 0 0.0000 4 5 6 7 9 6 CHI6 0 0 0.0000 1 2 17 18 20 7 CHI7 0 0 0.0000 21 22 24 25 48 8 CHI8 0 0 0.0000 22 24 25 26 47 9 CHI9 0 0 0.0000 24 25 26 27 44 10 CHI10 0 0 0.0000 25 26 27 28 39 11 CHI11 0 0 0.0000 29 34 35 36 36 12 PHI1 0 0 0.0000 23 50 51 52 0 13 PHI2 0 0 0.0000 50 51 52 56 0 14 PHI3 0 0 0.0000 51 52 56 60 0 15 PHI4 0 0 0.0000 52 56 60 64 0 16 PHI5 0 0 0.0000 56 60 64 69 0 1 C1 C_ARO 0 0.0000 -0.9190 0.3420 -4.4700 2 21 49 0 0 2 N2 N_AMO 0 0.0000 -1.4350 0.4100 -5.7490 1 3 17 0 0 3 C5 C_ALI 0 0.0000 -2.8960 0.4410 -5.6130 2 4 14 15 0 4 C9 C_ALI 0 0.0000 -3.5420 0.3940 -6.9980 3 5 11 12 0 5 N14 N_AMO 0 0.0000 -3.2020 -0.8720 -7.6590 4 6 10 0 0 6 C10 C_ALI 0 0.0000 -1.7400 -0.9020 -7.7940 5 7 8 17 0 7 H101 H_ALI 0 0.0000 -1.4420 -1.8190 -8.3030 6 0 0 0 9 8 H102 H_ALI 0 0.0000 -1.4120 -0.0420 -8.3770 6 0 0 0 9 9 Q1 PSEUD 0 0.0000 -1.4270 -0.9305 -8.3400 0 0 0 0 0 10 H14 H_AMI 0 0.0000 -3.5780 -0.8220 -8.5940 5 0 0 0 0 11 H91 H_ALI 0 0.0000 -4.6250 0.4700 -6.8970 4 0 0 0 13 12 H92 H_ALI 0 0.0000 -3.1750 1.2260 -7.5990 4 0 0 0 13 13 Q2 PSEUD 0 0.0000 -3.9000 0.8480 -7.2480 0 0 0 0 0 14 H51 H_ALI 0 0.0000 -3.2240 -0.4190 -5.0300 3 0 0 0 16 15 H52 H_ALI 0 0.0000 -3.1940 1.3580 -5.1050 3 0 0 0 16 16 Q3 PSEUD 0 0.0000 -3.2090 0.4695 -5.0675 0 0 0 0 0 17 C6 C_ALI 0 0.0000 -1.0940 -0.8550 -6.4090 2 6 18 19 0 18 H61 H_ALI 0 0.0000 -0.0120 -0.9310 -6.5110 17 0 0 0 20 19 H62 H_ALI 0 0.0000 -1.4610 -1.6870 -5.8090 17 0 0 0 20 20 Q4 PSEUD 0 0.0000 -0.7365 -1.3090 -6.1600 0 0 0 0 0 21 N3 N_AMO 0 0.0000 0.3960 0.3060 -4.2850 1 22 0 0 0 22 C7 C_ARO 0 0.0000 0.8930 0.2340 -3.0540 21 23 24 0 0 23 N11 N_AMO 0 0.0000 0.0740 0.2090 -2.0080 22 50 0 0 0 24 N12 N_AMO 0 0.0000 2.2590 0.1920 -2.8630 22 25 48 0 0 25 C15 C_ALI 0 0.0000 2.8070 0.1190 -1.5060 24 26 45 46 0 26 C17 C_ALI 0 0.0000 4.3350 0.0840 -1.5740 25 27 42 43 0 27 C19 C_ARO 0 0.0000 4.8990 0.0100 -0.1790 26 28 32 0 0 28 C21 C_ARO 0 0.0000 5.1270 -1.2200 0.4080 27 29 31 0 0 29 C24 C_ARO 0 0.0000 5.6430 -1.2920 1.6870 28 30 34 0 0 30 H24 H_ALI 0 0.0000 5.8220 -2.2530 2.1450 29 0 0 0 40 31 H21 H_ALI 0 0.0000 4.9010 -2.1270 -0.1340 28 0 0 0 39 32 C22 C_ARO 0 0.0000 5.1860 1.1720 0.5120 27 33 38 0 0 33 C25 C_ARO 0 0.0000 5.6980 1.1060 1.7930 32 34 37 0 0 34 C28 C_ARO 0 0.0000 5.9330 -0.1270 2.3830 29 33 35 0 0 35 O31 O_HYD 0 0.0000 6.4410 -0.1940 3.6410 34 36 0 0 0 36 H31 H_OXY 0 0.0000 7.4040 -0.2140 3.5530 35 0 0 0 0 37 H25 H_ALI 0 0.0000 5.9220 2.0140 2.3330 33 0 0 0 40 38 H22 H_ALI 0 0.0000 5.0070 2.1320 0.0510 32 0 0 0 39 39 Q10 PSEUD 0 0.0000 4.9540 0.0025 -0.0415 0 0 0 0 41 40 Q11 PSEUD 0 0.0000 5.8720 -0.1195 2.2390 0 0 0 0 41 41 QQA PSEUD 0 0.0000 5.4130 -0.0585 1.0987 0 0 0 0 0 42 H171 H_ALI 0 0.0000 4.6980 0.9880 -2.0650 26 0 0 0 44 43 H172 H_ALI 0 0.0000 4.6540 -0.7890 -2.1420 26 0 0 0 44 44 Q5 PSEUD 0 0.0000 4.6760 0.0995 -2.1035 0 0 0 0 0 45 H151 H_ALI 0 0.0000 2.4440 -0.7830 -1.0160 25 0 0 0 47 46 H152 H_ALI 0 0.0000 2.4890 0.9940 -0.9390 25 0 0 0 47 47 Q6 PSEUD 0 0.0000 2.4665 0.1055 -0.9775 0 0 0 0 0 48 H12 H_AMI 0 0.0000 2.8570 0.2100 -3.6270 24 0 0 0 0 49 N4 N_AMI 0 0.0000 -1.7380 0.3170 -3.4240 1 50 0 0 0 50 C8 C_ARO 0 0.0000 -1.2410 0.2500 -2.1920 23 49 51 0 0 51 S13 S_RED 0 0.0000 -2.3270 0.2180 -0.8050 50 52 0 0 0 52 C16 C_ALI 0 0.0000 -1.1170 0.1290 0.5380 51 53 54 56 0 53 H161 H_ALI 0 0.0000 -0.5150 -0.7720 0.4260 52 0 0 0 55 54 H162 H_ALI 0 0.0000 -0.4700 1.0050 0.5030 52 0 0 0 55 55 Q7 PSEUD 0 0.0000 -0.4925 0.1165 0.4645 0 0 0 0 0 56 C18 C_ALI 0 0.0000 -1.8490 0.0890 1.8810 52 57 58 60 0 57 H181 H_ALI 0 0.0000 -2.4510 0.9910 1.9940 56 0 0 0 59 58 H182 H_ALI 0 0.0000 -2.4960 -0.7860 1.9170 56 0 0 0 59 59 Q8 PSEUD 0 0.0000 -2.4735 0.1025 1.9555 0 0 0 0 0 60 C20 C_ALI 0 0.0000 -0.8260 0.0140 3.0170 56 61 62 64 0 61 H201 H_ALI 0 0.0000 -0.1790 0.8900 2.9820 60 0 0 0 63 62 H202 H_ALI 0 0.0000 -0.2240 -0.8860 2.9040 60 0 0 0 63 63 Q9 PSEUD 0 0.0000 -0.2015 0.0020 2.9430 0 0 0 0 0 64 C23 C_ARO 0 0.0000 -1.5470 -0.0240 4.3400 60 65 69 0 0 65 C27 C_ARO 0 0.0000 -1.8420 1.1530 5.0010 64 66 68 0 0 66 C30 C_ARO 0 0.0000 -2.5070 1.1180 6.2120 65 67 73 0 0 67 H30 H_ALI 0 0.0000 -2.7410 2.0380 6.7270 66 0 0 0 75 68 H27 H_ALI 0 0.0000 -1.5600 2.1010 4.5670 65 0 0 0 74 69 C26 C_ARO 0 0.0000 -1.9080 -1.2380 4.8950 64 70 71 0 0 70 H26 H_ALI 0 0.0000 -1.6730 -2.1580 4.3800 69 0 0 0 74 71 C29 C_ARO 0 0.0000 -2.5680 -1.2750 6.1080 69 72 73 0 0 72 H29 H_ALI 0 0.0000 -2.8510 -2.2230 6.5410 71 0 0 0 75 73 C32 C_ARO 0 0.0000 -2.8690 -0.0960 6.7680 66 71 77 0 0 74 Q12 PSEUD 0 0.0000 -1.6165 -0.0285 4.4735 0 0 0 0 76 75 Q13 PSEUD 0 0.0000 -2.7960 -0.0925 6.6340 0 0 0 0 76 76 QQB PSEUD 0 0.0000 -2.2062 -0.0605 5.5538 0 0 0 0 0 77 CL33 C_XXX 0 0.0000 -3.6980 -0.1410 8.2920 73 0 0 0 0