REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = 4-[(5-{[4-(3-CHLOROPHENYL)-3-OXOPIPERAZIN-1-YL]METHYL}-1H-IMIDAZOL-1-YL)METHYL]BENZONITRILE
RESIDUE A778 11 60 1 60
1 CHI1 0 0 0.0000 10 1 2 3 9
2 CHI2 0 0 0.0000 1 2 3 4 6
3 CHI3 0 0 0.0000 2 1 10 11 30
4 CHI4 0 0 0.0000 1 10 11 12 27
5 CHI5 0 0 0.0000 10 11 12 13 24
6 CHI6 0 0 0.0000 11 12 13 14 24
7 PHI1 0 0 0.0000 2 1 31 35 0
8 PHI2 0 0 0.0000 1 31 35 41 0
9 PHI3 0 0 0.0000 35 41 42 46 0
10 PHI4 0 0 0.0000 41 42 46 51 0
11 PHI5 0 0 0.0000 48 55 59 60 0
1 N1 N_AMI 0 0.0000 0.0370 0.3670 0.6280 2 10 31 0 0
2 C2 C_ALI 0 0.0000 0.6000 -0.5320 1.6460 1 3 7 8 0
3 C5 C_ALI 0 0.0000 1.9570 -1.0430 1.1610 2 4 5 12 0
4 H51 H_ALI 0 0.0000 1.8120 -1.7020 0.3050 3 0 0 0 6
5 H52 H_ALI 0 0.0000 2.4460 -1.5950 1.9640 3 0 0 0 6
6 Q1 PSEUD 0 0.0000 2.1290 -1.6485 1.1345 0 0 0 0 0
7 H21A H_ALI 0 0.0000 -0.0740 -1.3750 1.8010 2 0 0 0 9
8 H22 H_ALI 0 0.0000 0.7280 0.0120 2.5820 2 0 0 0 9
9 Q2 PSEUD 0 0.0000 0.3270 -0.6815 2.1915 0 0 0 0 0
10 C4 C_ALI 0 0.0000 0.8210 1.6050 0.6850 1 11 28 29 0
11 C8 C_BYL 0 0.0000 2.2870 1.3060 0.5460 10 12 27 0 0
12 N9 N_AMO 0 0.0000 2.7960 0.0880 0.7680 3 11 13 0 0
13 C14 C_ARO 0 0.0000 4.1740 -0.1080 0.6230 12 14 18 0 0
14 C20 C_ARO 0 0.0000 4.6610 -0.8880 -0.4170 13 15 17 0 0
15 C26 C_ARO 0 0.0000 6.0230 -1.0840 -0.5530 14 16 20 0 0
16 CL31 C_XXX 0 0.0000 6.6330 -2.0650 -1.8490 15 0 0 0 0
17 H20 H_ALI 0 0.0000 3.9760 -1.3480 -1.1150 14 0 0 0 24
18 C21 C_ARO 0 0.0000 5.0580 0.4820 1.5170 13 19 23 0 0
19 C27 C_ARO 0 0.0000 6.4180 0.2880 1.3730 18 20 22 0 0
20 C30 C_ARO 0 0.0000 6.9000 -0.4930 0.3400 15 19 21 0 0
21 H30 H_ALI 0 0.0000 7.9640 -0.6440 0.2290 20 0 0 0 0
22 H27 H_ALI 0 0.0000 7.1050 0.7470 2.0680 19 0 0 0 25
23 H21 H_ALI 0 0.0000 4.6820 1.0930 2.3250 18 0 0 0 24
24 Q6 PSEUD 0 0.0000 4.3290 -0.1275 0.6050 0 0 0 0 26
25 Q7 PSEUD 0 0.0000 7.1050 0.7470 2.0680 0 0 0 0 26
26 QQA PSEUD 0 0.0000 5.7170 0.3097 1.3365 0 0 0 0 0
27 O13 O_BYL 0 0.0000 3.0360 2.2000 0.2130 11 0 0 0 0
28 H41 H_ALI 0 0.0000 0.5080 2.2680 -0.1210 10 0 0 0 30
29 H42 H_ALI 0 0.0000 0.6470 2.0980 1.6420 10 0 0 0 30
30 Q3 PSEUD 0 0.0000 0.5775 2.1830 0.7605 0 0 0 0 0
31 C3 C_ALI 0 0.0000 -1.3220 0.7070 1.0690 1 32 33 35 0
32 H31 H_ALI 0 0.0000 -1.9360 -0.1930 1.0810 31 0 0 0 34
33 H32A H_ALI 0 0.0000 -1.2830 1.1330 2.0710 31 0 0 0 34
34 Q4 PSEUD 0 0.0000 -1.6095 0.4700 1.5760 0 0 0 0 0
35 C7 C_ARO 0 0.0000 -1.9220 1.7110 0.1190 31 36 41 0 0
36 C12 C_ARO 0 0.0000 -1.9110 3.0510 0.2550 35 37 40 0 0
37 N18 N_AMO 0 0.0000 -2.5470 3.5810 -0.8000 36 38 0 0 0
38 C17 C_ARO 0 0.0000 -2.9520 2.6200 -1.5850 37 39 41 0 0
39 H17 H_ALI 0 0.0000 -3.4940 2.7490 -2.5100 38 0 0 0 0
40 H12 H_ALI 0 0.0000 -1.4670 3.6030 1.0710 36 0 0 0 0
41 N11 N_AMI 0 0.0000 -2.5780 1.4370 -1.0500 35 38 42 0 0
42 C16 C_ALI 0 0.0000 -2.8340 0.1090 -1.6130 41 43 44 46 0
43 H161 H_ALI 0 0.0000 -2.9840 0.1930 -2.6900 42 0 0 0 45
44 H162 H_ALI 0 0.0000 -1.9810 -0.5400 -1.4150 42 0 0 0 45
45 Q5 PSEUD 0 0.0000 -2.4825 -0.1735 -2.0525 0 0 0 0 0
46 C25 C_ARO 0 0.0000 -4.0690 -0.4760 -0.9780 42 47 51 0 0
47 C29 C_ARO 0 0.0000 -3.9480 -1.3360 0.0990 46 48 50 0 0
48 C33 C_ARO 0 0.0000 -5.0740 -1.8720 0.6880 47 49 55 0 0
49 H33 H_ALI 0 0.0000 -4.9780 -2.5400 1.5310 48 0 0 0 57
50 H29 H_ALI 0 0.0000 -2.9690 -1.5830 0.4840 47 0 0 0 56
51 C28 C_ARO 0 0.0000 -5.3180 -0.1550 -1.4780 46 52 53 0 0
52 H28 H_ALI 0 0.0000 -5.4060 0.5130 -2.3220 51 0 0 0 56
53 C32 C_ARO 0 0.0000 -6.4530 -0.6880 -0.9020 51 54 55 0 0
54 H32 H_ALI 0 0.0000 -7.4280 -0.4360 -1.2930 53 0 0 0 57
55 C34 C_ARO 0 0.0000 -6.3380 -1.5520 0.1890 48 53 59 0 0
56 Q8 PSEUD 0 0.0000 -4.1875 -0.5350 -0.9190 0 0 0 0 58
57 Q9 PSEUD 0 0.0000 -6.2030 -1.4880 0.1190 0 0 0 0 58
58 QQB PSEUD 0 0.0000 -5.1953 -1.0115 -0.4000 0 0 0 0 0
59 C35 C_XXX 0 0.0000 -7.5120 -2.1080 0.7930 55 60 0 0 0
60 N36 N_AMI 0 0.0000 -8.4430 -2.5490 1.2720 59 0 0 0 0