REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = 3-(3-chlorophenyl)-2-({(1S)-1-[(6S)-2,8-diazaspiro[5.5]undec-2-ylcarbonyl]pentyl}sulfanyl)quinazolin-4(3H)-one RESIDUE A38M 19 87 1 87 1 CHI1 0 0 0.0000 5 6 7 8 64 2 CHI2 0 0 0.0000 6 7 8 9 64 3 CHI3 0 0 0.0000 7 8 9 10 46 4 CHI4 0 0 0.0000 8 9 11 12 46 5 CHI5 0 0 0.0000 9 11 12 13 42 6 CHI6 0 0 0.0000 11 12 13 14 39 7 CHI7 0 0 0.0000 12 13 14 15 36 8 CHI8 0 0 0.0000 13 14 15 16 33 9 CHI9 0 0 0.0000 14 15 16 17 29 10 CHI10 0 0 0.0000 15 16 17 18 26 11 CHI11 0 0 0.0000 16 17 18 19 25 12 CHI12 0 0 0.0000 17 18 19 20 22 13 CHI13 0 0 0.0000 14 15 30 31 33 14 CHI14 0 0 0.0000 9 11 43 44 46 15 CHI15 0 0 0.0000 7 8 47 48 63 16 CHI16 0 0 0.0000 8 47 48 49 60 17 CHI17 0 0 0.0000 47 48 49 50 57 18 CHI18 0 0 0.0000 48 49 50 51 54 19 PHI1 0 0 0.0000 6 73 74 81 0 1 C C_ARO 0 0.0000 -0.8760 -4.4150 2.3870 2 67 68 0 0 2 C1 C_ARO 0 0.0000 -1.7890 -3.3980 2.6320 1 3 66 0 0 3 C2 C_ARO 0 0.0000 -1.5670 -2.1290 2.1770 2 4 65 0 0 4 C3 C_ARO 0 0.0000 -0.4040 -1.8470 1.4540 3 5 70 0 0 5 N7 N_AMO 0 0.0000 -0.1450 -0.6040 0.9840 4 6 0 0 0 6 C8 C_BYL 0 0.0000 0.9460 -0.3420 0.3060 5 7 73 0 0 7 S S_RED 0 0.0000 1.2030 1.3040 -0.2680 6 8 0 0 0 8 C15 C_ALI 0 0.0000 -0.3680 2.0570 0.2230 7 9 47 64 0 9 C16 C_BYL 0 0.0000 -1.4610 1.5880 -0.7020 8 10 11 0 0 10 O18 O_BYL 0 0.0000 -1.1800 1.1330 -1.7910 9 0 0 0 0 11 N19 N_AMO 0 0.0000 -2.7500 1.6750 -0.3200 9 12 43 0 0 12 C23 C_ALI 0 0.0000 -3.1070 2.2290 0.9930 11 13 40 41 0 13 C24 C_ALI 0 0.0000 -3.9910 1.2190 1.7320 12 14 37 38 0 14 C25 C_ALI 0 0.0000 -5.1930 0.8620 0.8530 13 15 34 35 0 15 C26 C_ALI 0 0.0000 -4.7050 0.2200 -0.4460 14 16 30 43 0 16 C7 C_ALI 0 0.0000 -5.9060 -0.1680 -1.3100 15 17 27 28 0 17 N1 N_AMO 0 0.0000 -5.4350 -0.8010 -2.5490 16 18 26 0 0 18 C35 C_ALI 0 0.0000 -4.6880 -2.0330 -2.2640 17 19 23 24 0 19 C19 C_ALI 0 0.0000 -3.4500 -1.7010 -1.4280 18 20 21 30 0 20 H19 H_ALI 0 0.0000 -2.8060 -1.0210 -1.9860 19 0 0 0 22 21 H19A H_ALI 0 0.0000 -2.9050 -2.6170 -1.2040 19 0 0 0 22 22 Q1 PSEUD 0 0.0000 -2.8555 -1.8190 -1.5950 0 0 0 0 0 23 H35 H_ALI 0 0.0000 -4.3800 -2.4960 -3.2020 18 0 0 0 25 24 H35A H_ALI 0 0.0000 -5.3250 -2.7240 -1.7110 18 0 0 0 25 25 Q2 PSEUD 0 0.0000 -4.8525 -2.6100 -2.4565 0 0 0 0 0 26 HN1 H_AMI 0 0.0000 -6.2030 -0.9810 -3.1780 17 0 0 0 0 27 H7 H_ALI 0 0.0000 -6.5370 -0.8670 -0.7620 16 0 0 0 29 28 H7A H_ALI 0 0.0000 -6.4800 0.7260 -1.5550 16 0 0 0 29 29 Q3 PSEUD 0 0.0000 -6.5085 -0.0705 -1.1585 0 0 0 0 0 30 C18 C_ALI 0 0.0000 -3.8870 -1.0330 -0.1210 15 19 31 32 0 31 H18 H_ALI 0 0.0000 -3.0070 -0.7540 0.4580 30 0 0 0 33 32 H18A H_ALI 0 0.0000 -4.4980 -1.7270 0.4560 30 0 0 0 33 33 Q4 PSEUD 0 0.0000 -3.7525 -1.2405 0.4570 0 0 0 0 0 34 H25 H_ALI 0 0.0000 -5.8360 0.1620 1.3860 14 0 0 0 36 35 H25A H_ALI 0 0.0000 -5.7550 1.7670 0.6220 14 0 0 0 36 36 Q5 PSEUD 0 0.0000 -5.7955 0.9645 1.0040 0 0 0 0 0 37 H24 H_ALI 0 0.0000 -3.4160 0.3190 1.9440 13 0 0 0 39 38 H24A H_ALI 0 0.0000 -4.3410 1.6580 2.6660 13 0 0 0 39 39 Q6 PSEUD 0 0.0000 -3.8785 0.9885 2.3050 0 0 0 0 0 40 H23 H_ALI 0 0.0000 -2.2010 2.4110 1.5710 12 0 0 0 42 41 H23A H_ALI 0 0.0000 -3.6520 3.1630 0.8600 12 0 0 0 42 42 Q7 PSEUD 0 0.0000 -2.9265 2.7870 1.2155 0 0 0 0 0 43 C27 C_ALI 0 0.0000 -3.8270 1.2220 -1.2110 11 15 44 45 0 44 H27 H_ALI 0 0.0000 -4.4290 2.0760 -1.5210 43 0 0 0 46 45 H27A H_ALI 0 0.0000 -3.3970 0.7380 -2.0880 43 0 0 0 46 46 Q8 PSEUD 0 0.0000 -3.9130 1.4070 -1.8045 0 0 0 0 0 47 C17 C_ALI 0 0.0000 -0.2500 3.5800 0.1430 8 48 61 62 0 48 C20 C_ALI 0 0.0000 0.7790 4.0670 1.1660 47 49 58 59 0 49 C21 C_ALI 0 0.0000 0.9970 5.5720 0.9940 48 50 55 56 0 50 C22 C_ALI 0 0.0000 2.0250 6.0580 2.0170 49 51 52 53 0 51 H22 H_ALI 0 0.0000 2.1800 7.1300 1.8950 50 0 0 0 54 52 H22A H_ALI 0 0.0000 1.6600 5.8560 3.0240 50 0 0 0 54 53 H22B H_ALI 0 0.0000 2.9690 5.5350 1.8610 50 0 0 0 54 54 Q9 PSEUD 0 0.0000 2.2697 6.1737 2.2600 0 0 0 0 0 55 H21 H_ALI 0 0.0000 1.3620 5.7730 -0.0130 49 0 0 0 57 56 H21A H_ALI 0 0.0000 0.0530 6.0950 1.1510 49 0 0 0 57 57 Q10 PSEUD 0 0.0000 0.7075 5.9340 0.5690 0 0 0 0 0 58 H20 H_ALI 0 0.0000 0.4140 3.8650 2.1730 48 0 0 0 60 59 H20A H_ALI 0 0.0000 1.7220 3.5430 1.0100 48 0 0 0 60 60 Q11 PSEUD 0 0.0000 1.0680 3.7040 1.5915 0 0 0 0 0 61 H17 H_ALI 0 0.0000 0.0700 3.8680 -0.8590 47 0 0 0 63 62 H17A H_ALI 0 0.0000 -1.2180 4.0320 0.3590 47 0 0 0 63 63 Q12 PSEUD 0 0.0000 -0.5740 3.9500 -0.2500 0 0 0 0 0 64 H15 H_ALI 0 0.0000 -0.6070 1.7650 1.2460 8 0 0 0 0 65 H2 H_ALI 0 0.0000 -2.2860 -1.3470 2.3740 3 0 0 0 0 66 H1 H_ALI 0 0.0000 -2.6890 -3.6130 3.1900 2 0 0 0 0 67 H H_ALI 0 0.0000 -1.0730 -5.4100 2.7570 1 0 0 0 0 68 C5 C_ARO 0 0.0000 0.2730 -4.1690 1.6880 1 69 70 0 0 69 H5 H_ALI 0 0.0000 0.9780 -4.9660 1.5030 68 0 0 0 0 70 C4 C_ARO 0 0.0000 0.5230 -2.8850 1.2070 4 68 71 0 0 71 C6 C_BYL 0 0.0000 1.7370 -2.5640 0.4440 70 72 73 0 0 72 O O_BYL 0 0.0000 2.5720 -3.4150 0.2000 71 0 0 0 0 73 N N_AMI 0 0.0000 1.8930 -1.2870 0.0240 6 71 74 0 0 74 C9 C_ARO 0 0.0000 3.0340 -0.9310 -0.7070 73 75 81 0 0 75 C10 C_ARO 0 0.0000 2.9610 -0.7910 -2.0860 74 76 80 0 0 76 C11 C_ARO 0 0.0000 4.0880 -0.4390 -2.8040 75 77 79 0 0 77 C12 C_ARO 0 0.0000 5.2870 -0.2260 -2.1510 76 78 83 0 0 78 H12 H_ALI 0 0.0000 6.1670 0.0480 -2.7150 77 0 0 0 0 79 H11 H_ALI 0 0.0000 4.0310 -0.3300 -3.8770 76 0 0 0 85 80 H10 H_ALI 0 0.0000 2.0240 -0.9570 -2.5970 75 0 0 0 84 81 C14 C_ARO 0 0.0000 4.2390 -0.7110 -0.0520 74 82 83 0 0 82 H14 H_ALI 0 0.0000 4.2980 -0.8200 1.0210 81 0 0 0 84 83 C13 C_ARO 0 0.0000 5.3640 -0.3650 -0.7760 77 81 87 0 0 84 Q13 PSEUD 0 0.0000 3.1610 -0.8885 -0.7880 0 0 0 0 86 85 Q14 PSEUD 0 0.0000 4.0310 -0.3300 -3.8770 0 0 0 0 86 86 QQA PSEUD 0 0.0000 3.5960 -0.6093 -2.3325 0 0 0 0 0 87 CL C_XXX 0 0.0000 6.8720 -0.0970 0.0400 83 0 0 0 0