REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = 4-methyl-N~3~-(2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}pyrimidin-5-yl)-N~1~-[3-(trifluoromethyl)phenyl]benzene-1,3-dicarboxamide RESIDUE AM5 11 85 1 85 1 CHI1 0 0 0.0000 2 3 6 7 55 2 CHI2 0 0 0.0000 3 6 7 8 54 3 CHI3 0 0 0.0000 6 7 8 9 53 4 CHI4 0 0 0.0000 10 14 15 16 52 5 CHI5 0 0 0.0000 14 15 16 17 49 6 CHI6 0 0 0.0000 18 23 24 25 46 7 CHI7 0 0 0.0000 26 35 36 37 40 8 CHI8 0 0 0.0000 1 2 56 57 60 9 CHI9 0 0 0.0000 64 65 66 67 84 10 CHI10 0 0 0.0000 65 66 67 68 81 11 CHI11 0 0 0.0000 72 73 76 77 79 1 C7 C_ARO 0 0.0000 -4.2060 -3.7290 1.4670 2 61 62 0 0 2 C21 C_ARO 0 0.0000 -2.8370 -3.8200 1.3080 1 3 56 0 0 3 C13 C_ARO 0 0.0000 -2.1430 -2.8230 0.6180 2 4 6 0 0 4 C12 C_ARO 0 0.0000 -2.8350 -1.7360 0.0900 3 5 64 0 0 5 H12 H_ALI 0 0.0000 -2.3030 -0.9620 -0.4450 4 0 0 0 0 6 C8 C_BYL 0 0.0000 -0.6780 -2.9230 0.4490 3 7 55 0 0 7 N6 N_AMO 0 0.0000 0.0080 -1.9010 -0.1010 6 8 54 0 0 8 C24 C_ARO 0 0.0000 1.3790 -2.0340 -0.3550 7 9 12 0 0 9 C23 C_ARO 0 0.0000 1.9220 -3.2660 -0.7100 8 10 11 0 0 10 N1 N_AMO 0 0.0000 3.2210 -3.3530 -0.9430 9 14 0 0 0 11 H23 H_ALI 0 0.0000 1.2910 -4.1380 -0.7940 9 0 0 0 0 12 C25 C_ARO 0 0.0000 2.2310 -0.9370 -0.2590 8 13 53 0 0 13 N4 N_AMO 0 0.0000 3.5200 -1.1000 -0.5060 12 14 0 0 0 14 C26 C_ARO 0 0.0000 4.0020 -2.2880 -0.8420 10 13 15 0 0 15 N7 N_AMO 0 0.0000 5.3590 -2.4200 -1.0930 14 16 52 0 0 16 C5 C_ARO 0 0.0000 6.2200 -1.3350 -0.8780 15 17 21 0 0 17 C30 C_ARO 0 0.0000 5.9670 -0.4420 0.1550 16 18 20 0 0 18 C29 C_ARO 0 0.0000 6.8150 0.6260 0.3670 17 19 23 0 0 19 H29 H_ALI 0 0.0000 6.6180 1.3210 1.1710 18 0 0 0 50 20 H30 H_ALI 0 0.0000 5.1060 -0.5840 0.7920 17 0 0 0 49 21 C31 C_ARO 0 0.0000 7.3260 -1.1540 -1.6970 16 22 48 0 0 22 C27 C_ARO 0 0.0000 8.1750 -0.0850 -1.4850 21 23 47 0 0 23 C28 C_ARO 0 0.0000 7.9220 0.8080 -0.4520 18 22 24 0 0 24 N5 N_AMO 0 0.0000 8.7820 1.8900 -0.2370 23 25 33 0 0 25 C4 C_ALI 0 0.0000 8.3300 2.7040 0.9010 24 26 30 31 0 26 C3 C_ALI 0 0.0000 9.2490 3.9180 1.0530 25 27 28 35 0 27 H3 H_ALI 0 0.0000 8.9330 4.5080 1.9140 26 0 0 0 29 28 H3A H_ALI 0 0.0000 9.1950 4.5310 0.1530 26 0 0 0 29 29 Q1 PSEUD 0 0.0000 9.0640 4.5195 1.0335 0 0 0 0 0 30 H4 H_ALI 0 0.0000 8.3630 2.1060 1.8110 25 0 0 0 32 31 H4A H_ALI 0 0.0000 7.3080 3.0410 0.7240 25 0 0 0 32 32 Q2 PSEUD 0 0.0000 7.8355 2.5735 1.2675 0 0 0 0 0 33 C6 C_ALI 0 0.0000 10.1640 1.4330 -0.0370 24 34 44 45 0 34 C1 C_ALI 0 0.0000 11.0830 2.6480 0.1150 33 35 41 42 0 35 N2 N_AMO 0 0.0000 10.6310 3.4610 1.2530 26 34 36 0 0 36 C2 C_ALI 0 0.0000 11.5340 4.5970 1.4790 35 37 38 39 0 37 H2 H_ALI 0 0.0000 11.5580 5.2250 0.5880 36 0 0 0 40 38 H2A H_ALI 0 0.0000 11.1770 5.1830 2.3260 36 0 0 0 40 39 H2B H_ALI 0 0.0000 12.5380 4.2280 1.6900 36 0 0 0 40 40 Q3 PSEUD 0 0.0000 11.7577 4.8787 1.5347 0 0 0 0 0 41 H1 H_ALI 0 0.0000 11.0500 3.2460 -0.7960 34 0 0 0 43 42 H1A H_ALI 0 0.0000 12.1040 2.3110 0.2920 34 0 0 0 43 43 Q4 PSEUD 0 0.0000 11.5770 2.7785 -0.2520 0 0 0 0 0 44 H6 H_ALI 0 0.0000 10.4800 0.8440 -0.8980 33 0 0 0 46 45 H6A H_ALI 0 0.0000 10.2180 0.8210 0.8630 33 0 0 0 46 46 Q5 PSEUD 0 0.0000 10.3490 0.8325 -0.0175 0 0 0 0 0 47 H27 H_ALI 0 0.0000 9.0330 0.0580 -2.1250 22 0 0 0 50 48 H31 H_ALI 0 0.0000 7.5230 -1.8480 -2.5010 21 0 0 0 49 49 Q9 PSEUD 0 0.0000 6.3145 -1.2160 -0.8545 0 0 0 0 51 50 Q10 PSEUD 0 0.0000 7.8255 0.6895 -0.4770 0 0 0 0 51 51 QQB PSEUD 0 0.0000 7.0700 -0.2633 -0.6657 0 0 0 0 0 52 HN7 H_AMI 0 0.0000 5.7130 -3.2620 -1.4180 15 0 0 0 0 53 H25 H_ALI 0 0.0000 1.8450 0.0340 0.0140 12 0 0 0 0 54 HN6 H_AMI 0 0.0000 -0.4490 -1.0740 -0.3210 7 0 0 0 0 55 O2 O_BYL 0 0.0000 -0.0910 -3.9260 0.8060 6 0 0 0 0 56 C22 C_ALI 0 0.0000 -2.0910 -4.9980 1.8800 2 57 58 59 0 57 H22 H_ALI 0 0.0000 -1.9290 -5.7400 1.0980 56 0 0 0 60 58 H22A H_ALI 0 0.0000 -1.1290 -4.6640 2.2690 56 0 0 0 60 59 H22B H_ALI 0 0.0000 -2.6750 -5.4410 2.6870 56 0 0 0 60 60 Q6 PSEUD 0 0.0000 -1.9110 -5.2817 2.0180 0 0 0 0 0 61 H7 H_ALI 0 0.0000 -4.7380 -4.5010 2.0040 1 0 0 0 0 62 C9 C_ARO 0 0.0000 -4.8980 -2.6540 0.9460 1 63 64 0 0 63 H9 H_ALI 0 0.0000 -5.9680 -2.5890 1.0730 62 0 0 0 0 64 C10 C_ARO 0 0.0000 -4.2160 -1.6500 0.2530 4 62 65 0 0 65 C11 C_BYL 0 0.0000 -4.9580 -0.4990 -0.3040 64 66 85 0 0 66 N3 N_AMO 0 0.0000 -6.2940 -0.4180 -0.1450 65 67 84 0 0 67 C14 C_ARO 0 0.0000 -6.9830 0.7150 -0.5890 66 68 72 0 0 68 C15 C_ARO 0 0.0000 -6.5780 1.3670 -1.7450 67 69 71 0 0 69 C19 C_ARO 0 0.0000 -7.2610 2.4860 -2.1810 68 70 74 0 0 70 H19 H_ALI 0 0.0000 -6.9460 2.9940 -3.0810 69 0 0 0 82 71 H15 H_ALI 0 0.0000 -5.7290 1.0010 -2.3030 68 0 0 0 81 72 C16 C_ARO 0 0.0000 -8.0790 1.1870 0.1230 67 73 80 0 0 73 C17 C_ARO 0 0.0000 -8.7540 2.3090 -0.3150 72 74 76 0 0 74 C18 C_ARO 0 0.0000 -8.3480 2.9560 -1.4670 69 73 75 0 0 75 H18 H_ALI 0 0.0000 -8.8800 3.8310 -1.8100 74 0 0 0 0 76 C20 C_ALI 0 0.0000 -9.9380 2.8250 0.4610 73 77 78 79 0 77 F1 X_XXX 0 0.0000 -10.4550 3.9580 -0.1770 76 0 0 0 0 78 F3 X_XXX 0 0.0000 -10.9240 1.8340 0.5220 76 0 0 0 0 79 F2 X_XXX 0 0.0000 -9.5360 3.1630 1.7570 76 0 0 0 0 80 H16 H_ALI 0 0.0000 -8.3990 0.6790 1.0210 72 0 0 0 81 81 Q7 PSEUD 0 0.0000 -7.0640 0.8400 -0.6410 0 0 0 0 83 82 Q8 PSEUD 0 0.0000 -6.9460 2.9940 -3.0810 0 0 0 0 83 83 QQA PSEUD 0 0.0000 -7.0050 1.9170 -1.8610 0 0 0 0 0 84 HN3 H_AMI 0 0.0000 -6.7770 -1.1450 0.2780 66 0 0 0 0 85 O1 O_BYL 0 0.0000 -4.3640 0.3730 -0.9060 65 0 0 0 0