REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = 4-{[(7R)-8-cyclopentyl-7-ethyl-5-methyl-6-oxo-5,6,7,8-tetrahydropteridin-2-yl]amino}-3-methoxy-N-(1-methylpiperidin-4-yl)benzamide RESIDUE R78 17 90 1 90 1 CHI1 0 0 0.0000 1 2 3 4 47 2 CHI2 0 0 0.0000 4 5 6 7 7 3 CHI3 0 0 0.0000 3 4 9 10 46 4 CHI4 0 0 0.0000 9 10 11 12 39 5 CHI5 0 0 0.0000 10 11 12 13 39 6 CHI6 0 0 0.0000 11 12 14 15 39 7 CHI7 0 0 0.0000 12 14 15 16 38 8 CHI8 0 0 0.0000 4 9 41 42 46 9 CHI9 0 0 0.0000 9 41 42 43 46 10 CHI10 0 0 0.0000 48 49 50 51 68 11 CHI11 0 0 0.0000 49 50 51 52 68 12 CHI12 0 0 0.0000 49 71 72 73 90 13 CHI13 0 0 0.0000 71 72 73 74 85 14 CHI14 0 0 0.0000 72 73 74 75 84 15 CHI15 0 0 0.0000 73 74 75 76 83 16 CHI16 0 0 0.0000 74 75 76 77 80 17 CHI17 0 0 0.0000 71 72 86 87 90 1 N1 N_AMI 0 0.0000 1.1370 -0.7660 0.4370 2 69 0 0 0 2 C1 C_ARO 0 0.0000 1.6520 0.4070 0.1010 1 3 48 0 0 3 N5 N_AMO 0 0.0000 0.8080 1.5000 -0.0250 2 4 47 0 0 4 C7 C_ARO 0 0.0000 -0.5710 1.3320 0.0830 3 5 9 0 0 5 C20 C_ARO 0 0.0000 -1.1630 0.1510 -0.3510 4 6 8 0 0 6 C19 C_ARO 0 0.0000 -2.5250 -0.0210 -0.2410 5 7 11 0 0 7 H19 H_ALI 0 0.0000 -2.9820 -0.9390 -0.5790 6 0 0 0 0 8 H20 H_ALI 0 0.0000 -0.5520 -0.6330 -0.7740 5 0 0 0 0 9 C16 C_ARO 0 0.0000 -1.3570 2.3490 0.6300 4 10 41 0 0 10 C17 C_ARO 0 0.0000 -2.7220 2.1810 0.7420 9 11 40 0 0 11 C18 C_ARO 0 0.0000 -3.3160 0.9920 0.3060 6 10 12 0 0 12 C21 C_BYL 0 0.0000 -4.7750 0.8090 0.4240 11 13 14 0 0 13 O2 O_BYL 0 0.0000 -5.4620 1.6910 0.9000 12 0 0 0 0 14 N6 N_AMO 0 0.0000 -5.3460 -0.3370 0.0030 12 15 39 0 0 15 C22 C_ALI 0 0.0000 -6.7950 -0.5200 0.1200 14 16 24 38 0 16 C29 C_ALI 0 0.0000 -7.1190 -2.0150 0.1840 15 17 21 22 0 17 C28 C_ALI 0 0.0000 -8.6370 -2.2010 0.2450 16 18 19 26 0 18 H28 H_ALI 0 0.0000 -8.8710 -3.2650 0.2760 17 0 0 0 20 19 H28A H_ALI 0 0.0000 -9.0260 -1.7170 1.1400 17 0 0 0 20 20 Q1 PSEUD 0 0.0000 -8.9485 -2.4910 0.7080 0 0 0 0 0 21 H29 H_ALI 0 0.0000 -6.7270 -2.5110 -0.7030 16 0 0 0 23 22 H29A H_ALI 0 0.0000 -6.6630 -2.4480 1.0750 16 0 0 0 23 23 Q2 PSEUD 0 0.0000 -6.6950 -2.4795 0.1860 0 0 0 0 0 24 C23 C_ALI 0 0.0000 -7.4880 0.0930 -1.1000 15 25 35 36 0 25 C24 C_ALI 0 0.0000 -8.9950 -0.1540 -1.0030 24 26 32 33 0 26 N7 N_AMO 0 0.0000 -9.2530 -1.5990 -0.9450 17 25 27 0 0 27 C30 C_ALI 0 0.0000 -10.6940 -1.8790 -0.9900 26 28 29 30 0 28 H30 H_ALI 0 0.0000 -11.1110 -1.4860 -1.9170 27 0 0 0 31 29 H30A H_ALI 0 0.0000 -10.8570 -2.9560 -0.9450 27 0 0 0 31 30 H30B H_ALI 0 0.0000 -11.1830 -1.4020 -0.1400 27 0 0 0 31 31 Q3 PSEUD 0 0.0000 -11.0503 -1.9480 -1.0007 0 0 0 0 0 32 H24 H_ALI 0 0.0000 -9.4900 0.2680 -1.8770 25 0 0 0 34 33 H24A H_ALI 0 0.0000 -9.3830 0.3200 -0.1020 25 0 0 0 34 34 Q4 PSEUD 0 0.0000 -9.4365 0.2940 -0.9895 0 0 0 0 0 35 H23 H_ALI 0 0.0000 -7.2960 1.1650 -1.1280 24 0 0 0 37 36 H23A H_ALI 0 0.0000 -7.1010 -0.3700 -2.0090 24 0 0 0 37 37 Q5 PSEUD 0 0.0000 -7.1985 0.3975 -1.5685 0 0 0 0 0 38 H22 H_ALI 0 0.0000 -7.1520 -0.0300 1.0260 15 0 0 0 0 39 HN6 H_AMI 0 0.0000 -4.7980 -1.0410 -0.3770 14 0 0 0 0 40 H17 H_ALI 0 0.0000 -3.3310 2.9660 1.1650 10 0 0 0 0 41 O3 O_EST 0 0.0000 -0.7760 3.5030 1.0540 9 42 0 0 0 42 C31 C_ALI 0 0.0000 -1.6400 4.5000 1.6040 41 43 44 45 0 43 H31 H_ALI 0 0.0000 -2.3740 4.7990 0.8550 42 0 0 0 46 44 H31A H_ALI 0 0.0000 -2.1550 4.0950 2.4750 42 0 0 0 46 45 H31B H_ALI 0 0.0000 -1.0510 5.3680 1.9010 42 0 0 0 46 46 Q6 PSEUD 0 0.0000 -1.8600 4.7540 1.7437 0 0 0 0 0 47 HN5 H_AMI 0 0.0000 1.1790 2.3820 -0.1870 3 0 0 0 0 48 N2 N_AMO 0 0.0000 2.9490 0.5670 -0.1190 2 49 0 0 0 49 C2 C_ARO 0 0.0000 3.7830 -0.4600 -0.0060 48 50 71 0 0 50 N3 N_AMO 0 0.0000 5.1370 -0.3040 -0.2360 49 51 74 0 0 51 C8 C_ALI 0 0.0000 5.5300 1.1080 -0.1310 50 52 60 68 0 52 C15 C_ALI 0 0.0000 4.4740 2.0130 -0.7990 51 53 57 58 0 53 C14 C_ALI 0 0.0000 5.2460 3.1480 -1.4960 52 54 55 61 0 54 H14 H_ALI 0 0.0000 4.9500 4.1110 -1.0790 53 0 0 0 56 55 H14A H_ALI 0 0.0000 5.0510 3.1280 -2.5680 53 0 0 0 56 56 Q7 PSEUD 0 0.0000 5.0005 3.6195 -1.8235 0 0 0 0 0 57 H15 H_ALI 0 0.0000 3.9050 1.4430 -1.5340 52 0 0 0 59 58 H15A H_ALI 0 0.0000 3.8040 2.4250 -0.0450 52 0 0 0 59 59 Q8 PSEUD 0 0.0000 3.8545 1.9340 -0.7895 0 0 0 0 0 60 C12 C_ALI 0 0.0000 6.8240 1.3730 -0.9400 51 61 65 66 0 61 C13 C_ALI 0 0.0000 6.7430 2.8930 -1.2270 53 60 62 63 0 62 H13 H_ALI 0 0.0000 7.3370 3.1480 -2.1040 61 0 0 0 64 63 H13A H_ALI 0 0.0000 7.0770 3.4630 -0.3590 61 0 0 0 64 64 Q9 PSEUD 0 0.0000 7.2070 3.3055 -1.2315 0 0 0 0 0 65 H12 H_ALI 0 0.0000 7.7060 1.1380 -0.3450 60 0 0 0 67 66 H12A H_ALI 0 0.0000 6.8220 0.8040 -1.8700 60 0 0 0 67 67 Q10 PSEUD 0 0.0000 7.2640 0.9710 -1.1075 0 0 0 0 0 68 H8 H_ALI 0 0.0000 5.6660 1.3880 0.9130 51 0 0 0 0 69 C4 C_ARO 0 0.0000 1.9080 -1.8380 0.5690 1 70 71 0 0 70 H4 H_ALI 0 0.0000 1.4820 -2.7920 0.8440 69 0 0 0 0 71 C3 C_ARO 0 0.0000 3.2670 -1.7120 0.3500 49 69 72 0 0 72 N4 N_AMO 0 0.0000 4.1320 -2.8080 0.4820 71 73 86 0 0 73 C6 C_BYL 0 0.0000 5.4560 -2.5660 0.6180 72 74 85 0 0 74 C5 C_ALI 0 0.0000 5.9480 -1.1420 0.6520 50 73 75 84 0 75 C9 C_ALI 0 0.0000 7.4080 -1.0990 0.1970 74 76 81 82 0 76 C10 C_ALI 0 0.0000 7.4910 -1.4640 -1.2860 75 77 78 79 0 77 H10 H_ALI 0 0.0000 7.2450 -2.5180 -1.4150 76 0 0 0 80 78 H10A H_ALI 0 0.0000 6.7850 -0.8550 -1.8500 76 0 0 0 80 79 H10B H_ALI 0 0.0000 8.5020 -1.2800 -1.6500 76 0 0 0 80 80 Q11 PSEUD 0 0.0000 7.5107 -1.5510 -1.6383 0 0 0 0 0 81 H9 H_ALI 0 0.0000 7.8060 -0.0950 0.3470 75 0 0 0 83 82 H9A H_ALI 0 0.0000 7.9910 -1.8120 0.7800 75 0 0 0 83 83 Q12 PSEUD 0 0.0000 7.8985 -0.9535 0.5635 0 0 0 0 0 84 H5 H_ALI 0 0.0000 5.8780 -0.7610 1.6710 74 0 0 0 0 85 O1 O_BYL 0 0.0000 6.2400 -3.4870 0.7110 73 0 0 0 0 86 C11 C_ALI 0 0.0000 3.6150 -4.1780 0.4740 72 87 88 89 0 87 H11 H_ALI 0 0.0000 4.4430 -4.8790 0.5890 86 0 0 0 90 88 H11A H_ALI 0 0.0000 2.9140 -4.3070 1.2980 86 0 0 0 90 89 H11B H_ALI 0 0.0000 3.1060 -4.3690 -0.4710 86 0 0 0 90 90 Q13 PSEUD 0 0.0000 3.4877 -4.5183 0.4720 0 0 0 0 0