REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = 2-fluoro-6-{[2-({2-methoxy-4-[(methylsulfonyl)methyl]phenyl}amino)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]amino}benzamide RESIDUE GS7 8 59 1 59 1 CHI1 0 0 0.0000 2 3 4 5 32 2 CHI2 0 0 0.0000 3 4 5 6 31 3 CHI3 0 0 0.0000 5 6 7 8 12 4 CHI4 0 0 0.0000 13 17 18 19 29 5 CHI5 0 0 0.0000 17 18 19 20 26 6 PHI1 0 0 0.0000 2 1 42 59 0 7 CHI6 0 0 0.0000 1 42 43 44 58 8 CHI7 0 0 0.0000 43 44 45 46 50 1 C11 C_ARO 0 0.0000 -2.5150 1.0950 -0.3110 2 33 42 0 0 2 N2 N_AMO 0 0.0000 -1.6140 0.1190 -0.2980 1 3 0 0 0 3 C10 C_ARO 0 0.0000 -0.3220 0.3800 -0.4520 2 4 37 0 0 4 N1 N_AMO 0 0.0000 0.5790 -0.6730 -0.4310 3 5 32 0 0 5 C9 C_ARO 0 0.0000 1.9560 -0.4180 -0.4450 4 6 15 0 0 6 C2 C_ARO 0 0.0000 2.8410 -1.3900 -0.9070 5 7 13 0 0 7 O1 O_EST 0 0.0000 2.3700 -2.5880 -1.3440 6 8 0 0 0 8 C1 C_ALI 0 0.0000 3.3360 -3.5360 -1.8030 7 9 10 11 0 9 H1 H_ALI 0 0.0000 3.8890 -3.1150 -2.6430 8 0 0 0 12 10 H1A H_ALI 0 0.0000 4.0280 -3.7710 -0.9940 8 0 0 0 12 11 H1B H_ALI 0 0.0000 2.8290 -4.4460 -2.1220 8 0 0 0 12 12 Q1 PSEUD 0 0.0000 3.5820 -3.7773 -1.9197 0 0 0 0 0 13 C3 C_ARO 0 0.0000 4.2020 -1.1320 -0.9200 6 14 17 0 0 14 H3 H_ALI 0 0.0000 4.8910 -1.8830 -1.2770 13 0 0 0 0 15 C8 C_ARO 0 0.0000 2.4410 0.8050 -0.0060 5 16 31 0 0 16 C7 C_ARO 0 0.0000 3.8000 1.0540 -0.0220 15 17 30 0 0 17 C4 C_ARO 0 0.0000 4.6790 0.0880 -0.4750 13 16 18 0 0 18 C5 C_ALI 0 0.0000 6.1600 0.3660 -0.4910 17 19 27 28 0 19 S S_XXX 0 0.0000 6.8880 -0.1450 1.0890 18 20 21 22 0 20 O2 O_XXX 0 0.0000 6.3620 0.6820 2.1190 19 0 0 0 0 21 O3 O_XXX 0 0.0000 6.7730 -1.5560 1.2060 19 0 0 0 0 22 C6 C_ALI 0 0.0000 8.6370 0.2750 0.8490 19 23 24 25 0 23 H6 H_ALI 0 0.0000 8.7310 1.3440 0.6610 22 0 0 0 26 24 H6A H_ALI 0 0.0000 9.2000 0.0120 1.7450 22 0 0 0 26 25 H6B H_ALI 0 0.0000 9.0300 -0.2810 -0.0020 22 0 0 0 26 26 Q2 PSEUD 0 0.0000 8.9870 0.3583 0.8013 0 0 0 0 0 27 H5 H_ALI 0 0.0000 6.6260 -0.1920 -1.3040 18 0 0 0 29 28 H5A H_ALI 0 0.0000 6.3270 1.4330 -0.6410 18 0 0 0 29 29 Q3 PSEUD 0 0.0000 6.4765 0.6205 -0.9725 0 0 0 0 0 30 H7 H_ALI 0 0.0000 4.1770 2.0070 0.3200 16 0 0 0 0 31 H8 H_ALI 0 0.0000 1.7570 1.5620 0.3480 15 0 0 0 0 32 HN1 H_AMI 0 0.0000 0.2550 -1.5870 -0.4060 4 0 0 0 0 33 C19 C_ARO 0 0.0000 -2.0700 2.4140 -0.4910 1 34 38 0 0 34 C22 C_ARO 0 0.0000 -0.6920 2.6480 -0.6500 33 35 37 0 0 35 N5 N_AMO 0 0.0000 -0.5270 3.9970 -0.8060 34 36 39 0 0 36 HN5 H_AMI 0 0.0000 0.3260 4.4420 -0.9360 35 0 0 0 0 37 N6 N_AMO 0 0.0000 0.1400 1.6070 -0.6240 3 34 0 0 0 38 C20 C_ARO 0 0.0000 -2.7170 3.7230 -0.5630 33 39 41 0 0 39 C21 C_ARO 0 0.0000 -1.7440 4.6280 -0.7520 35 38 40 0 0 40 H21 H_ALI 0 0.0000 -1.8960 5.6930 -0.8480 39 0 0 0 0 41 H20 H_ALI 0 0.0000 -3.7750 3.9240 -0.4800 38 0 0 0 0 42 N3 N_AMI 0 0.0000 -3.8630 0.8170 -0.1550 1 43 59 0 0 43 C12 C_ARO 0 0.0000 -4.3010 -0.5020 -0.1160 42 44 53 0 0 44 C17 C_ARO 0 0.0000 -5.5380 -0.8170 0.4680 43 45 51 0 0 45 C18 C_BYL 0 0.0000 -6.3800 0.2460 1.0430 44 46 47 0 0 46 O4 O_BYL 0 0.0000 -6.2570 0.5530 2.2130 45 0 0 0 0 47 N4 N_AMO 0 0.0000 -7.2850 0.8800 0.2710 45 48 49 0 0 48 HN4 H_AMI 0 0.0000 -7.8390 1.5810 0.6500 47 0 0 0 50 49 HN4A H_AMI 0 0.0000 -7.3820 0.6360 -0.6630 47 0 0 0 50 50 Q4 PSEUD 0 0.0000 -7.6105 1.1085 -0.0065 0 0 0 0 0 51 C16 C_ARO 0 0.0000 -5.9690 -2.1480 0.4950 44 52 55 0 0 52 F X_XXX 0 0.0000 -7.1600 -2.4630 1.0500 51 0 0 0 0 53 C13 C_ARO 0 0.0000 -3.5150 -1.5140 -0.6500 43 54 58 0 0 54 C14 C_ARO 0 0.0000 -3.9530 -2.8230 -0.6160 53 55 57 0 0 55 C15 C_ARO 0 0.0000 -5.1740 -3.1400 -0.0470 51 54 56 0 0 56 H15 H_ALI 0 0.0000 -5.5060 -4.1670 -0.0250 55 0 0 0 0 57 H14 H_ALI 0 0.0000 -3.3380 -3.6050 -1.0360 54 0 0 0 0 58 H13 H_ALI 0 0.0000 -2.5600 -1.2760 -1.0960 53 0 0 0 0 59 HN3 H_AMI 0 0.0000 -4.5010 1.5430 -0.0740 42 0 0 0 0