REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = N-[(1S,2R)-1-benzyl-3-{[(1S)-2-(cyclohexylamino)-1-methyl-2-oxoethyl]amino}-2-hydroxypropyl]-3-(pentylsulfonyl)benzamide RESIDUE VG3 14 104 1 104 1 CHI1 0 0 0.0000 67 1 2 3 66 2 CHI2 0 0 0.0000 1 2 3 4 65 3 CHI3 0 0 0.0000 2 3 4 5 46 4 CHI4 0 0 0.0000 3 4 5 6 6 5 CHI5 0 0 0.0000 3 4 7 8 45 6 CHI6 0 0 0.0000 8 9 10 11 14 7 CHI7 0 0 0.0000 8 9 15 16 40 8 CHI8 0 0 0.0000 2 3 47 48 64 9 CHI9 0 0 0.0000 3 47 48 49 59 10 PHI1 0 0 0.0000 2 1 68 75 0 11 CHI10 0 0 0.0000 81 82 83 84 99 12 CHI11 0 0 0.0000 82 83 84 85 96 13 CHI12 0 0 0.0000 83 84 85 86 93 14 CHI13 0 0 0.0000 84 85 86 87 90 1 C1 C_BYL 0 0.0000 30.5470 1.2450 34.3590 2 67 68 0 0 2 N2 N_AMO 0 0.0000 29.3600 1.4560 33.7170 1 3 66 0 0 3 C3 C_ALI 0 0.0000 29.2020 2.3450 32.5500 2 4 47 65 0 4 C4 C_ALI 0 0.0000 28.3370 3.5240 33.0190 3 5 7 46 0 5 O19 O_HYD 0 0.0000 28.0980 4.4500 31.9870 4 6 0 0 0 6 H19 H_OXY 0 0.0000 28.0440 5.3250 32.3530 5 0 0 0 0 7 C21 C_ALI 0 0.0000 28.9930 4.2820 34.1860 4 8 43 44 0 8 N22 N_AMO 0 0.0000 28.2730 5.5240 34.4250 7 9 42 0 0 9 C20 C_ALI 0 0.0000 28.9560 6.7450 34.8900 8 10 15 41 0 10 C24 C_ALI 0 0.0000 29.5260 6.5250 36.3070 9 11 12 13 0 11 H241 H_ALI 0 0.0000 30.6240 6.4730 36.2570 10 0 0 0 14 12 H242 H_ALI 0 0.0000 29.2280 7.3620 36.9560 10 0 0 0 14 13 H243 H_ALI 0 0.0000 29.1330 5.5840 36.7180 10 0 0 0 14 14 Q1 PSEUD 0 0.0000 29.6617 6.4730 36.6437 0 0 0 0 0 15 C38 C_BYL 0 0.0000 30.0910 7.1540 33.9040 9 16 40 0 0 16 N39 N_AMO 0 0.0000 29.6350 7.9310 32.9040 15 17 39 0 0 17 C40 C_ALI 0 0.0000 30.4790 8.4020 31.8030 16 18 26 38 0 18 C43 C_ALI 0 0.0000 30.8950 9.8650 32.0780 17 19 23 24 0 19 C44 C_ALI 0 0.0000 31.7800 10.4030 30.8840 18 20 21 28 0 20 H441 H_ALI 0 0.0000 31.9780 11.4720 31.0520 19 0 0 0 22 21 H442 H_ALI 0 0.0000 32.7070 9.8110 30.8620 19 0 0 0 22 22 Q2 PSEUD 0 0.0000 32.3425 10.6415 30.9570 0 0 0 0 0 23 H431 H_ALI 0 0.0000 29.9940 10.4890 32.1740 18 0 0 0 25 24 H432 H_ALI 0 0.0000 31.4770 9.9080 33.0100 18 0 0 0 25 25 Q3 PSEUD 0 0.0000 30.7355 10.1985 32.5920 0 0 0 0 0 26 C47 C_ALI 0 0.0000 29.7070 8.2950 30.4680 17 27 35 36 0 27 C46 C_ALI 0 0.0000 30.5680 8.7980 29.2790 26 28 32 33 0 28 C45 C_ALI 0 0.0000 31.0860 10.2440 29.5070 19 27 29 30 0 29 H451 H_ALI 0 0.0000 30.2310 10.9340 29.4630 28 0 0 0 31 30 H452 H_ALI 0 0.0000 31.8260 10.4680 28.7250 28 0 0 0 31 31 Q4 PSEUD 0 0.0000 31.0285 10.7010 29.0940 0 0 0 0 0 32 H461 H_ALI 0 0.0000 29.9510 8.7850 28.3680 27 0 0 0 34 33 H462 H_ALI 0 0.0000 31.4400 8.1340 29.1840 27 0 0 0 34 34 Q5 PSEUD 0 0.0000 30.6955 8.4595 28.7760 0 0 0 0 0 35 H471 H_ALI 0 0.0000 29.4400 7.2420 30.2940 26 0 0 0 37 36 H472 H_ALI 0 0.0000 28.8050 8.9210 30.5350 26 0 0 0 37 37 Q6 PSEUD 0 0.0000 29.1225 8.0815 30.4145 0 0 0 0 0 38 H40 H_ALI 0 0.0000 31.3830 7.7790 31.7290 17 0 0 0 0 39 H39 H_AMI 0 0.0000 28.6720 8.2000 32.9130 16 0 0 0 0 40 O41 O_BYL 0 0.0000 31.2560 6.7770 34.0420 15 0 0 0 0 41 H20 H_ALI 0 0.0000 28.2220 7.5640 34.9250 9 0 0 0 0 42 H22 H_AMI 0 0.0000 27.5980 5.3100 35.1310 8 0 0 0 0 43 H211 H_ALI 0 0.0000 28.9600 3.6590 35.0920 7 0 0 0 45 44 H212 H_ALI 0 0.0000 30.0390 4.5080 33.9340 7 0 0 0 45 45 Q7 PSEUD 0 0.0000 29.4995 4.0835 34.5130 0 0 0 0 0 46 H4 H_ALI 0 0.0000 27.3850 3.0790 33.3450 4 0 0 0 0 47 C5 C_ALI 0 0.0000 28.5600 1.5640 31.3760 3 48 62 63 0 48 C13 C_ARO 0 0.0000 29.2090 0.2240 31.1020 47 49 53 0 0 49 C14 C_ARO 0 0.0000 28.4280 -0.9650 31.0890 48 50 52 0 0 50 C15 C_ARO 0 0.0000 29.0350 -2.2200 30.8350 49 51 55 0 0 51 H15 H_ALI 0 0.0000 28.4350 -3.1180 30.8260 50 0 0 0 60 52 H14 H_ALI 0 0.0000 27.3650 -0.9110 31.2740 49 0 0 0 59 53 C18 C_ARO 0 0.0000 30.6090 0.1360 30.8570 48 54 58 0 0 54 C17 C_ARO 0 0.0000 31.2140 -1.1170 30.6050 53 55 57 0 0 55 C16 C_ARO 0 0.0000 30.4270 -2.2960 30.5930 50 54 56 0 0 56 H16 H_ALI 0 0.0000 30.8900 -3.2520 30.3990 55 0 0 0 0 57 H17 H_ALI 0 0.0000 32.2770 -1.1760 30.4210 54 0 0 0 60 58 H18 H_ALI 0 0.0000 31.2120 1.0320 30.8640 53 0 0 0 59 59 Q16 PSEUD 0 0.0000 29.2885 0.0605 31.0690 0 0 0 0 61 60 Q17 PSEUD 0 0.0000 30.3560 -2.1470 30.6235 0 0 0 0 61 61 QQB PSEUD 0 0.0000 29.8223 -1.0433 30.8463 0 0 0 0 0 62 H5C1 H_ALI 0 0.0000 27.5030 1.3860 31.6240 47 0 0 0 64 63 H5C2 H_ALI 0 0.0000 28.6930 2.1760 30.4720 47 0 0 0 64 64 Q8 PSEUD 0 0.0000 28.0980 1.7810 31.0480 0 0 0 0 0 65 H3 H_ALI 0 0.0000 30.1660 2.7200 32.1750 3 0 0 0 0 66 H2 H_AMI 0 0.0000 28.5500 0.9800 34.0580 2 0 0 0 0 67 O6 O_BYL 0 0.0000 31.5040 2.0170 34.2240 1 0 0 0 0 68 C7 C_ARO 0 0.0000 30.5720 0.0470 35.2150 1 69 75 0 0 69 C8 C_ARO 0 0.0000 30.1530 -1.2290 34.7310 68 70 74 0 0 70 C9 C_ARO 0 0.0000 30.1760 -2.3610 35.5830 69 71 73 0 0 71 C10 C_ARO 0 0.0000 30.6110 -2.2340 36.9210 70 72 77 0 0 72 H10 H_ALI 0 0.0000 30.6250 -3.0970 37.5700 71 0 0 0 0 73 H9 H_ALI 0 0.0000 29.8600 -3.3230 35.2080 70 0 0 0 79 74 H8 H_ALI 0 0.0000 29.8170 -1.3320 33.7100 69 0 0 0 78 75 C12 C_ARO 0 0.0000 31.0110 0.1680 36.5650 68 76 77 0 0 76 H12 H_ALI 0 0.0000 31.3300 1.1270 36.9450 75 0 0 0 78 77 C11 C_ARO 0 0.0000 31.0290 -0.9730 37.4100 71 75 81 0 0 78 Q14 PSEUD 0 0.0000 30.5735 -0.1025 35.3275 0 0 0 0 80 79 Q15 PSEUD 0 0.0000 29.8600 -3.3230 35.2080 0 0 0 0 80 80 QQA PSEUD 0 0.0000 30.2168 -1.7127 35.2677 0 0 0 0 0 81 S23 S_XXX 0 0.0000 31.5550 -0.8330 39.1000 77 82 103 104 0 82 C60 C_ALI 0 0.0000 32.9950 -1.8910 39.1700 81 83 100 101 0 83 C61 C_ALI 0 0.0000 33.5530 -1.8840 40.6000 82 84 97 98 0 84 C64 C_ALI 0 0.0000 34.7870 -2.7790 40.7760 83 85 94 95 0 85 C67 C_ALI 0 0.0000 35.3160 -2.7550 42.2180 84 86 91 92 0 86 C70 C_ALI 0 0.0000 36.5490 -3.6500 42.4020 85 87 88 89 0 87 H701 H_ALI 0 0.0000 36.9970 -3.8640 41.4210 86 0 0 0 90 88 H702 H_ALI 0 0.0000 37.2850 -3.1340 43.0360 86 0 0 0 90 89 H703 H_ALI 0 0.0000 36.2490 -4.5930 42.8810 86 0 0 0 90 90 Q9 PSEUD 0 0.0000 36.8437 -3.8637 42.4460 0 0 0 0 0 91 H671 H_ALI 0 0.0000 35.5940 -1.7210 42.4710 85 0 0 0 93 92 H672 H_ALI 0 0.0000 34.5210 -3.1360 42.8760 85 0 0 0 93 93 Q10 PSEUD 0 0.0000 35.0575 -2.4285 42.6735 0 0 0 0 0 94 H641 H_ALI 0 0.0000 34.5110 -3.8130 40.5210 84 0 0 0 96 95 H642 H_ALI 0 0.0000 35.5800 -2.3990 40.1160 84 0 0 0 96 96 Q11 PSEUD 0 0.0000 35.0455 -3.1060 40.3185 0 0 0 0 0 97 H611 H_ALI 0 0.0000 33.8380 -0.8520 40.8520 83 0 0 0 99 98 H612 H_ALI 0 0.0000 32.7660 -2.2780 41.2600 83 0 0 0 99 99 Q12 PSEUD 0 0.0000 33.3020 -1.5650 41.0560 0 0 0 0 0 100 H601 H_ALI 0 0.0000 32.7140 -2.9170 38.8890 82 0 0 0 102 101 H602 H_ALI 0 0.0000 33.7610 -1.5220 38.4710 82 0 0 0 102 102 Q13 PSEUD 0 0.0000 33.2375 -2.2195 38.6800 0 0 0 0 0 103 O76 O_XXX 0 0.0000 30.5300 -1.4170 39.9240 81 0 0 0 0 104 O77 O_XXX 0 0.0000 31.9300 0.5250 39.3430 81 0 0 0 0