REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = 4-benzyl-3-[(2-chlorobenzyl)sulfanyl]-5-thiophen-2-yl-4H-1,2,4-triazole
RESIDUE TT1 3 47 1 47
1 PHI1 0 0 0.0000 11 12 16 17 0
2 PHI2 0 0 0.0000 12 16 17 29 0
3 CHI1 0 0 0.0000 19 20 21 22 28
1 C26 C_ARO 0 0.0000 -4.4900 -1.0050 1.2970 2 10 11 0 0
2 C25 C_ARO 0 0.0000 -5.7540 -1.5030 1.0460 1 3 9 0 0
3 C24 C_ARO 0 0.0000 -6.5690 -0.8840 0.1170 2 4 8 0 0
4 C23 C_ARO 0 0.0000 -6.1200 0.2330 -0.5620 3 5 7 0 0
5 C21 C_ARO 0 0.0000 -4.8540 0.7320 -0.3110 4 6 11 0 0
6 CL22 C_XXX 0 0.0000 -4.2890 2.1350 -1.1630 5 0 0 0 0
7 H23 H_ALI 0 0.0000 -6.7570 0.7160 -1.2880 4 0 0 0 0
8 H24 H_ALI 0 0.0000 -7.5570 -1.2740 -0.0790 3 0 0 0 0
9 H25 H_ALI 0 0.0000 -6.1060 -2.3760 1.5760 2 0 0 0 0
10 H26 H_ALI 0 0.0000 -3.8550 -1.4870 2.0260 1 0 0 0 0
11 C20 C_ARO 0 0.0000 -4.0390 0.1120 0.6190 1 5 12 0 0
12 C8 C_ALI 0 0.0000 -2.6600 0.6550 0.8940 11 13 14 16 0
13 H8 H_ALI 0 0.0000 -2.6550 1.7330 0.7310 12 0 0 0 15
14 H8A H_ALI 0 0.0000 -2.3850 0.4420 1.9260 12 0 0 0 15
15 Q1 PSEUD 0 0.0000 -2.5200 1.0875 1.3285 0 0 0 0 0
16 S9 S_RED 0 0.0000 -1.4700 -0.1280 -0.2230 12 17 0 0 0
17 C10 C_ARO 0 0.0000 0.0110 0.6680 0.3020 16 18 29 0 0
18 N19 N_AMO 0 0.0000 0.1170 1.5690 1.2520 17 19 0 0 0
19 N18 N_AMO 0 0.0000 1.3410 1.9400 1.3760 18 20 0 0 0
20 C12 C_ARO 0 0.0000 2.0950 1.2980 0.5110 19 21 29 0 0
21 C13 C_ARO 0 0.0000 3.5490 1.4440 0.3390 20 22 26 0 0
22 C17 C_ARO 0 0.0000 4.3880 2.0070 1.2350 21 23 25 0 0
23 C16 C_ARO 0 0.0000 5.7120 2.0290 0.8500 22 24 27 0 0
24 H16 H_ALI 0 0.0000 6.4890 2.4500 1.4700 23 0 0 0 0
25 H17 H_ALI 0 0.0000 4.0490 2.4100 2.1780 22 0 0 0 0
26 S14 S_RED 0 0.0000 4.4660 0.9040 -1.0610 21 27 0 0 0
27 C15 C_ARO 0 0.0000 5.9620 1.4900 -0.3470 23 26 28 0 0
28 H15 H_ALI 0 0.0000 6.9380 1.4220 -0.8060 27 0 0 0 0
29 N11 N_AMI 0 0.0000 1.2660 0.4590 -0.2000 17 20 30 0 0
30 C1 C_ALI 0 0.0000 1.6480 -0.4630 -1.2730 29 31 32 34 0
31 H1 H_ALI 0 0.0000 0.8530 -0.5040 -2.0180 30 0 0 0 33
32 H1A H_ALI 0 0.0000 2.5680 -0.1140 -1.7410 30 0 0 0 33
33 Q2 PSEUD 0 0.0000 1.7105 -0.3090 -1.8795 0 0 0 0 0
34 C2 C_ARO 0 0.0000 1.8670 -1.8390 -0.6980 30 35 43 0 0
35 C7 C_ARO 0 0.0000 0.8440 -2.7680 -0.7180 34 36 42 0 0
36 C6 C_ARO 0 0.0000 1.0460 -4.0300 -0.1910 35 37 41 0 0
37 C5 C_ARO 0 0.0000 2.2700 -4.3630 0.3570 36 38 40 0 0
38 C4 C_ARO 0 0.0000 3.2940 -3.4340 0.3760 37 39 43 0 0
39 H4 H_ALI 0 0.0000 4.2510 -3.6940 0.8040 38 0 0 0 46
40 H5 H_ALI 0 0.0000 2.4280 -5.3480 0.7690 37 0 0 0 0
41 H6 H_ALI 0 0.0000 0.2460 -4.7560 -0.2060 36 0 0 0 46
42 H7 H_ALI 0 0.0000 -0.1130 -2.5080 -1.1460 35 0 0 0 45
43 C3 C_ARO 0 0.0000 3.0940 -2.1740 -0.1550 34 38 44 0 0
44 H3 H_ALI 0 0.0000 3.8950 -1.4490 -0.1430 43 0 0 0 45
45 Q3 PSEUD 0 0.0000 1.8910 -1.9785 -0.6445 0 0 0 0 47
46 Q4 PSEUD 0 0.0000 2.2485 -4.2250 0.2990 0 0 0 0 47
47 QQA PSEUD 0 0.0000 2.0697 -3.1017 -0.1727 0 0 0 0 0