REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = (5R,6R)-5-BENZYL-6-HYDROXY-2,4-BIS(4-HYDROXY-3-METHOXYBENZYL)-1-[3-(4-HYDROXYPHENYL)PROPANOYL]-1,2,4-TRIAZEPAN-3-ONE RESIDUE AAU 24 100 1 100 1 PHI1 0 0 0.0000 2 1 6 7 0 2 PHI2 0 0 0.0000 1 6 7 98 0 3 CHI1 0 0 0.0000 8 9 10 11 92 4 CHI2 0 0 0.0000 9 10 11 12 89 5 CHI3 0 0 0.0000 10 11 12 13 31 6 CHI4 0 0 0.0000 11 12 13 14 30 7 CHI5 0 0 0.0000 12 13 14 15 25 8 CHI6 0 0 0.0000 10 11 32 33 89 9 CHI7 0 0 0.0000 11 32 33 34 88 10 CHI8 0 0 0.0000 32 33 34 35 67 11 CHI9 0 0 0.0000 33 34 35 36 42 12 CHI10 0 0 0.0000 34 35 36 37 39 13 CHI11 0 0 0.0000 35 36 37 38 38 14 CHI12 0 0 0.0000 33 34 43 44 67 15 CHI13 0 0 0.0000 34 43 45 46 67 16 CHI14 0 0 0.0000 43 45 46 47 64 17 CHI15 0 0 0.0000 45 46 47 48 59 18 CHI16 0 0 0.0000 49 54 55 56 56 19 CHI17 0 0 0.0000 32 33 68 69 88 20 CHI18 0 0 0.0000 33 68 69 70 85 21 CHI19 0 0 0.0000 71 76 77 78 78 22 CHI20 0 0 0.0000 74 75 79 80 84 23 CHI21 0 0 0.0000 75 79 80 81 84 24 PHI3 0 0 0.0000 7 98 99 100 0 1 C1 C_ALI 0 0.0000 -2.6000 1.7240 -3.7900 2 3 4 6 0 2 H11A H_ALI 0 0.0000 -2.8710 2.7120 -4.1620 1 0 0 0 5 3 H12A H_ALI 0 0.0000 -1.9190 1.8280 -2.9450 1 0 0 0 5 4 H13A H_ALI 0 0.0000 -2.1110 1.1590 -4.5830 1 0 0 0 5 5 Q1 PSEUD 0 0.0000 -2.3003 1.8997 -3.8967 0 0 0 0 0 6 O2 O_EST 0 0.0000 -3.7790 1.0340 -3.3690 1 7 0 0 0 7 C3 C_ARO 0 0.0000 -3.3800 -0.1850 -2.9180 6 8 98 0 0 8 C4 C_ARO 0 0.0000 -2.0370 -0.5270 -2.9350 7 9 97 0 0 9 C5 C_ARO 0 0.0000 -1.6330 -1.7670 -2.4760 8 10 93 0 0 10 C6 C_ALI 0 0.0000 -0.1730 -2.1370 -2.4950 9 11 90 91 0 11 N7 N_AMO 0 0.0000 0.4810 -1.6100 -1.2950 10 12 32 0 0 12 C8 C_ALI 0 0.0000 0.6050 -2.5230 -0.1650 11 13 31 36 0 13 C9 C_ALI 0 0.0000 -0.3960 -2.1240 0.9210 12 14 28 29 0 14 C10 C_ARO 0 0.0000 -0.9440 -3.3640 1.5790 13 15 19 0 0 15 C11 C_ARO 0 0.0000 -0.3420 -3.8660 2.7180 14 16 18 0 0 16 C12 C_ARO 0 0.0000 -0.8450 -5.0030 3.3220 15 17 21 0 0 17 H12 H_ALI 0 0.0000 -0.3740 -5.3960 4.2110 16 0 0 0 26 18 H11 H_ALI 0 0.0000 0.5210 -3.3690 3.1360 15 0 0 0 25 19 C15 C_ARO 0 0.0000 -2.0520 -3.9970 1.0470 14 20 24 0 0 20 C14 C_ARO 0 0.0000 -2.5520 -5.1370 1.6480 19 21 23 0 0 21 C13 C_ARO 0 0.0000 -1.9500 -5.6390 2.7870 16 20 22 0 0 22 H13 H_ALI 0 0.0000 -2.3420 -6.5280 3.2580 21 0 0 0 0 23 H14 H_ALI 0 0.0000 -3.4150 -5.6340 1.2300 20 0 0 0 26 24 H15 H_ALI 0 0.0000 -2.5220 -3.6050 0.1580 19 0 0 0 25 25 Q9 PSEUD 0 0.0000 -1.0005 -3.4870 1.6470 0 0 0 0 27 26 Q10 PSEUD 0 0.0000 -1.8945 -5.5150 2.7205 0 0 0 0 27 27 QQA PSEUD 0 0.0000 -1.4475 -4.5010 2.1837 0 0 0 0 0 28 H91 H_ALI 0 0.0000 0.1040 -1.5070 1.6680 13 0 0 0 30 29 H92 H_ALI 0 0.0000 -1.2130 -1.5600 0.4720 13 0 0 0 30 30 Q2 PSEUD 0 0.0000 -0.5545 -1.5335 1.0700 0 0 0 0 0 31 H8 H_ALI 0 0.0000 0.3910 -3.5390 -0.4970 12 0 0 0 0 32 C31 C_BYL 0 0.0000 0.8990 -0.3620 -1.3510 11 33 89 0 0 33 N20 N_AMO 0 0.0000 1.3500 0.3510 -0.2970 32 34 68 0 0 34 N19 N_AMO 0 0.0000 1.2580 -0.1870 0.9970 33 35 43 0 0 35 C18 C_ALI 0 0.0000 2.1170 -1.2910 1.3800 34 36 40 41 0 36 C16 C_ALI 0 0.0000 2.0270 -2.4680 0.4170 12 35 37 39 0 37 O17 O_HYD 0 0.0000 2.3080 -3.6840 1.1130 36 38 0 0 0 38 H17 H_OXY 0 0.0000 3.2070 -3.6060 1.4600 37 0 0 0 0 39 H16 H_ALI 0 0.0000 2.7470 -2.3350 -0.3910 36 0 0 0 0 40 H181 H_ALI 0 0.0000 1.8330 -1.6300 2.3760 35 0 0 0 42 41 H182 H_ALI 0 0.0000 3.1490 -0.9400 1.4110 35 0 0 0 42 42 Q3 PSEUD 0 0.0000 2.4910 -1.2850 1.8935 0 0 0 0 0 43 C33 C_BYL 0 0.0000 0.3750 0.3210 1.8790 34 44 45 0 0 44 O34 O_BYL 0 0.0000 0.2970 -0.1460 2.9960 43 0 0 0 0 45 C35 C_ALI 0 0.0000 -0.5160 1.4680 1.4780 43 46 65 66 0 46 C36 C_ALI 0 0.0000 -1.4170 1.8490 2.6550 45 47 62 63 0 47 C37 C_ARO 0 0.0000 -2.3080 2.9970 2.2540 46 48 52 0 0 48 C38 C_ARO 0 0.0000 -3.5450 2.7450 1.6880 47 49 51 0 0 49 C39 C_ARO 0 0.0000 -4.3630 3.7950 1.3190 48 50 54 0 0 50 H39 H_ALI 0 0.0000 -5.3280 3.5990 0.8760 49 0 0 0 60 51 H38 H_ALI 0 0.0000 -3.8700 1.7270 1.5340 48 0 0 0 59 52 C43 C_ARO 0 0.0000 -1.8910 4.2990 2.4580 47 53 58 0 0 53 C42 C_ARO 0 0.0000 -2.7030 5.3520 2.0860 52 54 57 0 0 54 C40 C_ARO 0 0.0000 -3.9440 5.1030 1.5180 49 53 55 0 0 55 O41 O_HYD 0 0.0000 -4.7470 6.1380 1.1560 54 56 0 0 0 56 H41 H_OXY 0 0.0000 -5.2970 6.3460 1.9240 55 0 0 0 0 57 H42 H_ALI 0 0.0000 -2.3740 6.3690 2.2410 53 0 0 0 60 58 H43 H_ALI 0 0.0000 -0.9250 4.4920 2.9010 52 0 0 0 59 59 Q11 PSEUD 0 0.0000 -2.3975 3.1095 2.2175 0 0 0 0 61 60 Q12 PSEUD 0 0.0000 -3.8510 4.9840 1.5585 0 0 0 0 61 61 QQB PSEUD 0 0.0000 -3.1242 4.0468 1.8880 0 0 0 0 0 62 H361 H_ALI 0 0.0000 -2.0310 0.9930 2.9350 46 0 0 0 64 63 H362 H_ALI 0 0.0000 -0.8010 2.1470 3.5030 46 0 0 0 64 64 Q4 PSEUD 0 0.0000 -1.4160 1.5700 3.2190 0 0 0 0 0 65 H351 H_ALI 0 0.0000 0.0970 2.3240 1.1990 45 0 0 0 67 66 H352 H_ALI 0 0.0000 -1.1330 1.1700 0.6300 45 0 0 0 67 67 Q5 PSEUD 0 0.0000 -0.5180 1.7470 0.9145 0 0 0 0 0 68 C21 C_ALI 0 0.0000 1.9390 1.6770 -0.5040 33 69 86 87 0 69 C22 C_ARO 0 0.0000 3.3980 1.5300 -0.8510 68 70 74 0 0 70 C23 C_ARO 0 0.0000 3.7830 1.4070 -2.1730 69 71 73 0 0 71 C24 C_ARO 0 0.0000 5.1210 1.2720 -2.4970 70 72 76 0 0 72 H24 H_ALI 0 0.0000 5.4190 1.1760 -3.5300 71 0 0 0 0 73 H23 H_ALI 0 0.0000 3.0380 1.4160 -2.9550 70 0 0 0 0 74 C30 C_ARO 0 0.0000 4.3480 1.5250 0.1530 69 75 85 0 0 75 C27 C_ARO 0 0.0000 5.6900 1.3860 -0.1640 74 76 79 0 0 76 C25 C_ARO 0 0.0000 6.0780 1.2610 -1.4950 71 75 77 0 0 77 O26 O_HYD 0 0.0000 7.3940 1.1290 -1.8120 76 78 0 0 0 78 H26 H_OXY 0 0.0000 7.7420 2.0220 -1.9400 77 0 0 0 0 79 O28 O_EST 0 0.0000 6.6260 1.3750 0.8220 75 80 0 0 0 80 C29 C_ALI 0 0.0000 5.9240 1.5200 2.0590 79 81 82 83 0 81 H291 H_ALI 0 0.0000 6.6370 1.5170 2.8830 80 0 0 0 84 82 H292 H_ALI 0 0.0000 5.3750 2.4610 2.0570 80 0 0 0 84 83 H293 H_ALI 0 0.0000 5.2260 0.6910 2.1790 80 0 0 0 84 84 Q6 PSEUD 0 0.0000 5.7460 1.5563 2.3730 0 0 0 0 0 85 H30 H_ALI 0 0.0000 4.0450 1.6220 1.1840 74 0 0 0 0 86 H211 H_ALI 0 0.0000 1.4200 2.1810 -1.3190 68 0 0 0 88 87 H212 H_ALI 0 0.0000 1.8400 2.2650 0.4080 68 0 0 0 88 88 Q7 PSEUD 0 0.0000 1.6300 2.2230 -0.4555 0 0 0 0 0 89 O32 O_BYL 0 0.0000 0.8670 0.1930 -2.4320 32 0 0 0 0 90 H61 H_ALI 0 0.0000 -0.0730 -3.2220 -2.5160 10 0 0 0 92 91 H62 H_ALI 0 0.0000 0.2980 -1.7110 -3.3820 10 0 0 0 92 92 Q8 PSEUD 0 0.0000 0.1125 -2.4665 -2.9490 0 0 0 0 0 93 C44 C_ARO 0 0.0000 -2.5670 -2.6680 -1.9980 9 94 96 0 0 94 C45 C_ARO 0 0.0000 -3.9080 -2.3330 -1.9780 93 95 98 0 0 95 H45 H_ALI 0 0.0000 -4.6350 -3.0390 -1.6040 94 0 0 0 0 96 H44 H_ALI 0 0.0000 -2.2470 -3.6360 -1.6400 93 0 0 0 0 97 H4 H_ALI 0 0.0000 -1.3060 0.1750 -3.3080 8 0 0 0 0 98 C46 C_ARO 0 0.0000 -4.3190 -1.0900 -2.4310 7 94 99 0 0 99 O47 O_HYD 0 0.0000 -5.6380 -0.7590 -2.4120 98 100 0 0 0 100 H47 H_OXY 0 0.0000 -5.7930 -0.2770 -1.5880 99 0 0 0 0