REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = 2-methyl-N-{4-methyl-3-[(2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}pyrimidin-5-yl)carbamoyl]phenyl}-3-(trifluoromethyl)benzamide
RESIDUE AM6 7 86 1 86
1 CHI1 0 0 0.0000 3 4 5 6 24
2 CHI2 0 0 0.0000 11 12 15 16 18
3 CHI3 0 0 0.0000 1 30 31 32 35
4 PHI1 0 0 0.0000 26 36 37 39 0
5 PHI2 0 0 0.0000 36 37 39 41 0
6 PHI3 0 0 0.0000 43 48 49 51 0
7 PHI4 0 0 0.0000 66 81 82 85 0
1 C9 C_ARO 0 0.0000 -4.8090 4.7510 -1.1620 2 29 30 0 0
2 C10 C_ARO 0 0.0000 -5.5290 3.6210 -0.8220 1 3 28 0 0
3 C11 C_ARO 0 0.0000 -4.8810 2.5110 -0.2940 2 4 26 0 0
4 N3 N_AMO 0 0.0000 -5.6140 1.3700 0.0480 3 5 25 0 0
5 C7 C_BYL 0 0.0000 -5.0760 0.1460 -0.1250 4 6 24 0 0
6 C14 C_ARO 0 0.0000 -5.8860 -1.0620 0.1410 5 7 11 0 0
7 C15 C_ARO 0 0.0000 -7.2340 -0.9400 0.4830 6 8 10 0 0
8 C19 C_ARO 0 0.0000 -7.9840 -2.0720 0.7300 7 9 13 0 0
9 H19 H_ALI 0 0.0000 -9.0270 -1.9790 0.9960 8 0 0 0 0
10 H15 H_ALI 0 0.0000 -7.6880 0.0370 0.5550 7 0 0 0 0
11 C16 C_ARO 0 0.0000 -5.3080 -2.3290 0.0450 6 12 19 0 0
12 C17 C_ARO 0 0.0000 -6.0680 -3.4510 0.3000 11 13 15 0 0
13 C18 C_ARO 0 0.0000 -7.4040 -3.3240 0.6390 8 12 14 0 0
14 H18 H_ALI 0 0.0000 -7.9950 -4.2060 0.8340 13 0 0 0 0
15 C20 C_ALI 0 0.0000 -5.4440 -4.8190 0.2040 12 16 17 18 0
16 F1 X_XXX 0 0.0000 -6.4050 -5.7920 0.4980 15 0 0 0 0
17 F3 X_XXX 0 0.0000 -4.9590 -5.0200 -1.0930 15 0 0 0 0
18 F2 X_XXX 0 0.0000 -4.3880 -4.9160 1.1170 15 0 0 0 0
19 C27 C_ALI 0 0.0000 -3.8550 -2.4690 -0.3300 11 20 21 22 0
20 H27 H_ALI 0 0.0000 -3.2360 -2.3300 0.5550 19 0 0 0 23
21 H27A H_ALI 0 0.0000 -3.6810 -3.4640 -0.7420 19 0 0 0 23
22 H27B H_ALI 0 0.0000 -3.5980 -1.7170 -1.0760 19 0 0 0 23
23 Q1 PSEUD 0 0.0000 -3.5050 -2.5037 -0.4210 0 0 0 0 0
24 O1 O_BYL 0 0.0000 -3.9250 0.0350 -0.5000 5 0 0 0 0
25 HN3 H_AMI 0 0.0000 -6.5100 1.4590 0.4100 4 0 0 0 0
26 C12 C_ARO 0 0.0000 -3.5080 2.5340 -0.1070 3 27 36 0 0
27 H12 H_ALI 0 0.0000 -3.0020 1.6720 0.3030 26 0 0 0 0
28 H10 H_ALI 0 0.0000 -6.6000 3.6010 -0.9670 2 0 0 0 0
29 H9 H_ALI 0 0.0000 -5.3180 5.6090 -1.5760 1 0 0 0 0
30 C21 C_ARO 0 0.0000 -3.4420 4.7840 -0.9800 1 31 36 0 0
31 C22 C_ALI 0 0.0000 -2.6610 6.0180 -1.3530 30 32 33 34 0
32 H22 H_ALI 0 0.0000 -2.5040 6.6300 -0.4650 31 0 0 0 35
33 H22A H_ALI 0 0.0000 -1.6970 5.7260 -1.7700 31 0 0 0 35
34 H22B H_ALI 0 0.0000 -3.2190 6.5900 -2.0950 31 0 0 0 35
35 Q2 PSEUD 0 0.0000 -2.4733 6.3153 -1.4433 0 0 0 0 0
36 C13 C_ARO 0 0.0000 -2.7810 3.6740 -0.4510 26 30 37 0 0
37 C8 C_BYL 0 0.0000 -1.3160 3.7070 -0.2540 36 38 39 0 0
38 O2 O_BYL 0 0.0000 -0.7000 4.7370 -0.4470 37 0 0 0 0
39 N6 N_AMI 0 0.0000 -0.6640 2.5950 0.1390 37 40 41 0 0
40 HN6 H_AMI 0 0.0000 -1.1430 1.7550 0.2210 39 0 0 0 0
41 C24 C_ARO 0 0.0000 0.7060 2.6520 0.4290 39 42 45 0 0
42 C25 C_ARO 0 0.0000 1.5390 1.5720 0.1500 41 43 44 0 0
43 N4 N_AMO 0 0.0000 2.8270 1.6610 0.4380 42 48 0 0 0
44 H25 H_ALI 0 0.0000 1.1390 0.6730 -0.2940 42 0 0 0 0
45 C23 C_ARO 0 0.0000 1.2660 3.7900 1.0030 41 46 47 0 0
46 H23 H_ALI 0 0.0000 0.6500 4.6470 1.2330 45 0 0 0 0
47 N1 N_AMI 0 0.0000 2.5630 3.8070 1.2630 45 48 0 0 0
48 C26 C_ARO 0 0.0000 3.3250 2.7600 0.9840 43 47 49 0 0
49 N7 N_AMI 0 0.0000 4.6810 2.8170 1.2710 48 50 51 0 0
50 HN7 H_AMI 0 0.0000 5.0450 3.5810 1.7440 49 0 0 0 0
51 C5 C_ARO 0 0.0000 5.5240 1.7700 0.8780 49 52 56 0 0
52 C32 C_ARO 0 0.0000 6.6030 1.4110 1.6750 51 53 55 0 0
53 C28 C_ARO 0 0.0000 7.4340 0.3790 1.2880 52 54 60 0 0
54 H28 H_ALI 0 0.0000 8.2710 0.0970 1.9100 53 0 0 0 62
55 H32 H_ALI 0 0.0000 6.7920 1.9390 2.5980 52 0 0 0 61
56 C31 C_ARO 0 0.0000 5.2800 1.0900 -0.3080 51 57 58 0 0
57 H31 H_ALI 0 0.0000 4.4410 1.3690 -0.9280 56 0 0 0 61
58 C30 C_ARO 0 0.0000 6.1120 0.0580 -0.6960 56 59 60 0 0
59 H30 H_ALI 0 0.0000 5.9230 -0.4700 -1.6190 58 0 0 0 62
60 C29 C_ARO 0 0.0000 7.1910 -0.3010 0.1010 53 58 64 0 0
61 Q8 PSEUD 0 0.0000 5.6165 1.6540 0.8350 0 0 0 0 63
62 Q9 PSEUD 0 0.0000 7.0970 -0.1865 0.1455 0 0 0 0 63
63 QQA PSEUD 0 0.0000 6.3568 0.7338 0.4903 0 0 0 0 0
64 N5 N_AMI 0 0.0000 8.0340 -1.3470 -0.2920 60 65 73 0 0
65 C6 C_ALI 0 0.0000 8.1110 -2.3810 0.7500 64 66 70 71 0
66 C1 C_ALI 0 0.0000 9.1010 -3.4650 0.3170 65 67 68 81 0
67 H1 H_ALI 0 0.0000 9.1380 -4.2470 1.0750 66 0 0 0 69
68 H1A H_ALI 0 0.0000 10.0910 -3.0260 0.1980 66 0 0 0 69
69 Q3 PSEUD 0 0.0000 9.6145 -3.6365 0.6365 0 0 0 0 0
70 H6 H_ALI 0 0.0000 7.1260 -2.8250 0.8950 65 0 0 0 72
71 H6A H_ALI 0 0.0000 8.4490 -1.9320 1.6840 65 0 0 0 72
72 Q4 PSEUD 0 0.0000 7.7875 -2.3785 1.2895 0 0 0 0 0
73 C4 C_ALI 0 0.0000 7.5960 -1.9240 -1.5710 64 74 75 77 0
74 H4 H_ALI 0 0.0000 7.5590 -1.1410 -2.3290 73 0 0 0 76
75 H4A H_ALI 0 0.0000 6.6060 -2.3630 -1.4520 73 0 0 0 76
76 Q5 PSEUD 0 0.0000 7.0825 -1.7520 -1.8905 0 0 0 0 0
77 C3 C_ALI 0 0.0000 8.5860 -3.0080 -2.0040 73 78 79 81 0
78 H3 H_ALI 0 0.0000 9.5710 -2.5640 -2.1490 77 0 0 0 80
79 H3A H_ALI 0 0.0000 8.2480 -3.4570 -2.9380 77 0 0 0 80
80 Q6 PSEUD 0 0.0000 8.9095 -3.0105 -2.5435 0 0 0 0 0
81 N2 N_AMI 0 0.0000 8.6630 -4.0420 -0.9620 66 77 82 0 0
82 C2 C_ALI 0 0.0000 7.3780 -4.7360 -0.8140 81 83 84 85 0
83 H2 H_ALI 0 0.0000 6.6210 -4.0310 -0.4710 82 0 0 0 86
84 H2A H_ALI 0 0.0000 7.0770 -5.1540 -1.7750 82 0 0 0 86
85 H2B H_ALI 0 0.0000 7.4810 -5.5400 -0.0850 82 0 0 0 86
86 Q7 PSEUD 0 0.0000 7.0597 -4.9083 -0.7770 0 0 0 0 0