REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = "2,5-DIBENZYLOXY-3,4-DIHYDROXY-HEXANEDIOIC ACID 2-CHLORO-6-FLUORO-BENZYLAMIDE (2-HYDROXY-INDAN-1- YL)-AMIDE" RESIDUE MSC 19 96 1 96 1 CHI1 0 0 0.0000 4 1 2 3 3 2 CHI2 0 0 0.0000 2 1 4 5 51 3 CHI3 0 0 0.0000 1 4 5 6 23 4 CHI4 0 0 0.0000 4 5 6 7 23 5 CHI5 0 0 0.0000 5 6 7 8 18 6 CHI6 0 0 0.0000 1 4 24 25 50 7 CHI7 0 0 0.0000 4 24 26 27 50 8 CHI8 0 0 0.0000 24 26 27 28 49 9 CHI9 0 0 0.0000 27 41 46 47 47 10 PHI1 0 0 0.0000 2 1 53 57 0 11 CHI10 0 0 0.0000 1 53 54 55 55 12 PHI2 0 0 0.0000 1 53 57 78 0 13 CHI11 0 0 0.0000 53 57 58 59 76 14 CHI12 0 0 0.0000 57 58 59 60 76 15 CHI13 0 0 0.0000 58 59 60 61 71 16 PHI3 0 0 0.0000 53 57 78 80 0 17 PHI4 0 0 0.0000 57 78 80 82 0 18 PHI5 0 0 0.0000 78 80 82 86 0 19 PHI6 0 0 0.0000 80 82 86 95 0 1 C01 C_ALI 0 0.0000 -0.8090 -0.1610 -0.2560 2 4 52 53 0 2 O02 O_HYD 0 0.0000 -1.1430 0.5070 -1.4740 1 3 0 0 0 3 H021 H_OXY 0 0.0000 -0.6100 0.1010 -2.1710 2 0 0 0 0 4 C03 C_ALI 0 0.0000 -1.1300 -1.6510 -0.3870 1 5 24 51 0 5 O04 O_EST 0 0.0000 -0.6830 -2.3400 0.7820 4 6 0 0 0 6 C05 C_ALI 0 0.0000 -0.2950 -3.6510 0.3670 5 7 21 22 0 7 C06 C_ARO 0 0.0000 0.0850 -4.4680 1.5740 6 8 12 0 0 8 C07 C_ARO 0 0.0000 -0.8750 -5.2130 2.2350 7 9 11 0 0 9 C08 C_ARO 0 0.0000 -0.5270 -5.9630 3.3420 8 10 14 0 0 10 H081 H_ALI 0 0.0000 -1.2770 -6.5440 3.8590 9 0 0 0 19 11 H071 H_ALI 0 0.0000 -1.8970 -5.2080 1.8850 8 0 0 0 18 12 C11 C_ARO 0 0.0000 1.3940 -4.4780 2.0180 7 13 17 0 0 13 C10 C_ARO 0 0.0000 1.7410 -5.2250 3.1290 12 14 16 0 0 14 C09 C_ARO 0 0.0000 0.7810 -5.9690 3.7900 9 13 15 0 0 15 H091 H_ALI 0 0.0000 1.0530 -6.5540 4.6550 14 0 0 0 0 16 H101 H_ALI 0 0.0000 2.7630 -5.2290 3.4780 13 0 0 0 19 17 H111 H_ALI 0 0.0000 2.1430 -3.8970 1.5020 12 0 0 0 18 18 Q5 PSEUD 0 0.0000 0.1230 -4.5525 1.6935 0 0 0 0 20 19 Q6 PSEUD 0 0.0000 0.7430 -5.8865 3.6685 0 0 0 0 20 20 QQA PSEUD 0 0.0000 0.4330 -5.2195 2.6810 0 0 0 0 0 21 H051 H_ALI 0 0.0000 -1.1270 -4.1300 -0.1490 6 0 0 0 23 22 H052 H_ALI 0 0.0000 0.5580 -3.5800 -0.3070 6 0 0 0 23 23 Q1 PSEUD 0 0.0000 -0.2845 -3.8550 -0.2280 0 0 0 0 0 24 C12 C_BYL 0 0.0000 -2.6190 -1.8330 -0.5390 4 25 26 0 0 25 O13 O_BYL 0 0.0000 -3.2500 -2.4090 0.3210 24 0 0 0 0 26 N14 N_AMO 0 0.0000 -3.2480 -1.3540 -1.6310 24 27 50 0 0 27 C15 C_ALI 0 0.0000 -4.6950 -1.5300 -1.7780 26 28 41 49 0 28 C16 C_ARO 0 0.0000 -5.4370 -0.4000 -1.0860 27 29 33 0 0 29 C17 C_ARO 0 0.0000 -5.2260 0.1850 0.1520 28 30 32 0 0 30 C18 C_ARO 0 0.0000 -6.0400 1.2150 0.5810 29 31 35 0 0 31 H181 H_ALI 0 0.0000 -5.8730 1.6700 1.5470 30 0 0 0 39 32 H171 H_ALI 0 0.0000 -4.4230 -0.1650 0.7830 29 0 0 0 38 33 C21 C_ARO 0 0.0000 -6.4650 0.0490 -1.8930 28 34 42 0 0 34 C20 C_ARO 0 0.0000 -7.2800 1.0820 -1.4600 33 35 37 0 0 35 C19 C_ARO 0 0.0000 -7.0690 1.6640 -0.2260 30 34 36 0 0 36 H191 H_ALI 0 0.0000 -7.7060 2.4700 0.1080 35 0 0 0 0 37 H201 H_ALI 0 0.0000 -8.0840 1.4330 -2.0910 34 0 0 0 39 38 Q7 PSEUD 0 0.0000 -4.4230 -0.1650 0.7830 0 0 0 0 40 39 Q8 PSEUD 0 0.0000 -6.9785 1.5515 -0.2720 0 0 0 0 40 40 QQB PSEUD 0 0.0000 -5.7007 0.6933 0.2555 0 0 0 0 0 41 C23 C_ALI 0 0.0000 -5.1040 -1.4230 -3.2630 27 42 46 48 0 42 C22 C_ALI 0 0.0000 -6.4880 -0.7450 -3.1820 33 41 43 44 0 43 H221 H_ALI 0 0.0000 -6.6330 -0.0790 -4.0330 42 0 0 0 45 44 H222 H_ALI 0 0.0000 -7.2760 -1.4960 -3.1490 42 0 0 0 45 45 Q2 PSEUD 0 0.0000 -6.9545 -0.7875 -3.5910 0 0 0 0 0 46 O24 O_HYD 0 0.0000 -4.1800 -0.6080 -3.9860 41 47 0 0 0 47 H241 H_OXY 0 0.0000 -4.5130 -0.5450 -4.8920 46 0 0 0 0 48 H231 H_ALI 0 0.0000 -5.1830 -2.4110 -3.7150 41 0 0 0 0 49 H151 H_ALI 0 0.0000 -5.0020 -2.4920 -1.3670 27 0 0 0 0 50 H141 H_AMI 0 0.0000 -2.7430 -0.8930 -2.3180 26 0 0 0 0 51 H031 H_ALI 0 0.0000 -0.6240 -2.0560 -1.2630 4 0 0 0 0 52 H011 H_ALI 0 0.0000 -1.3890 0.2650 0.5630 1 0 0 0 0 53 C31 C_ALI 0 0.0000 0.6840 0.0150 0.0290 1 54 56 57 0 54 O32 O_HYD 0 0.0000 1.4440 -0.5910 -1.0180 53 55 0 0 0 55 H321 H_OXY 0 0.0000 1.1960 -0.1440 -1.8380 54 0 0 0 0 56 H311 H_ALI 0 0.0000 0.9300 -0.4590 0.9790 53 0 0 0 0 57 C33 C_ALI 0 0.0000 1.0160 1.5070 0.1030 53 58 77 78 0 58 O34 O_EST 0 0.0000 0.1670 2.1380 1.0630 57 59 0 0 0 59 C35 C_ALI 0 0.0000 -0.0320 3.4820 0.6200 58 60 74 75 0 60 C36 C_ARO 0 0.0000 -0.8280 4.2380 1.6520 59 61 65 0 0 61 C37 C_ARO 0 0.0000 -0.1790 4.9140 2.6680 60 62 64 0 0 62 C38 C_ARO 0 0.0000 -0.9100 5.6080 3.6140 61 63 67 0 0 63 H381 H_ALI 0 0.0000 -0.4020 6.1350 4.4080 62 0 0 0 72 64 H371 H_ALI 0 0.0000 0.9000 4.9000 2.7220 61 0 0 0 71 65 C41 C_ARO 0 0.0000 -2.2090 4.2610 1.5790 60 66 70 0 0 66 C40 C_ARO 0 0.0000 -2.9400 4.9510 2.5270 65 67 69 0 0 67 C39 C_ARO 0 0.0000 -2.2900 5.6260 3.5440 62 66 68 0 0 68 H391 H_ALI 0 0.0000 -2.8610 6.1680 4.2830 67 0 0 0 0 69 H401 H_ALI 0 0.0000 -4.0180 4.9660 2.4730 66 0 0 0 72 70 H411 H_ALI 0 0.0000 -2.7160 3.7340 0.7840 65 0 0 0 71 71 Q9 PSEUD 0 0.0000 -0.9080 4.3170 1.7530 0 0 0 0 73 72 Q10 PSEUD 0 0.0000 -2.2100 5.5505 3.4405 0 0 0 0 73 73 QQC PSEUD 0 0.0000 -1.5590 4.9338 2.5968 0 0 0 0 0 74 H351 H_ALI 0 0.0000 0.9350 3.9650 0.4820 59 0 0 0 76 75 H352 H_ALI 0 0.0000 -0.5740 3.4760 -0.3250 59 0 0 0 76 76 Q3 PSEUD 0 0.0000 0.1805 3.7205 0.0785 0 0 0 0 0 77 H331 H_ALI 0 0.0000 0.8590 1.9630 -0.8750 57 0 0 0 0 78 C42 C_BYL 0 0.0000 2.4550 1.6820 0.5130 57 79 80 0 0 79 O43 O_BYL 0 0.0000 2.7240 2.2060 1.5730 78 0 0 0 0 80 N44 N_AMI 0 0.0000 3.4440 1.2540 -0.2980 78 81 82 0 0 81 H441 H_AMI 0 0.0000 3.2290 0.8350 -1.1450 80 0 0 0 0 82 C45 C_ALI 0 0.0000 4.8430 1.4240 0.1020 80 83 84 86 0 83 H451 H_ALI 0 0.0000 5.0560 2.4840 0.2400 82 0 0 0 85 84 H452 H_ALI 0 0.0000 5.0210 0.8930 1.0360 82 0 0 0 85 85 Q4 PSEUD 0 0.0000 5.0385 1.6885 0.6380 0 0 0 0 0 86 C46 C_ARO 0 0.0000 5.7430 0.8670 -0.9720 82 87 95 0 0 87 C51 C_ARO 0 0.0000 6.1370 -0.4570 -0.9260 86 88 94 0 0 88 C50 C_ARO 0 0.0000 6.9590 -0.9690 -1.9140 87 89 93 0 0 89 C49 C_ARO 0 0.0000 7.3950 -0.1550 -2.9420 88 90 92 0 0 90 C48 C_ARO 0 0.0000 7.0060 1.1710 -2.9870 89 91 95 0 0 91 H481 H_ALI 0 0.0000 7.3470 1.8070 -3.7910 90 0 0 0 0 92 H491 H_ALI 0 0.0000 8.0400 -0.5540 -3.7110 89 0 0 0 0 93 H501 H_ALI 0 0.0000 7.2640 -2.0050 -1.8800 88 0 0 0 0 94 CL C_XXX 0 0.0000 5.5910 -1.4810 0.3650 87 0 0 0 0 95 C47 C_ARO 0 0.0000 6.1790 1.6830 -2.0020 86 90 96 0 0 96 F X_XXX 0 0.0000 5.7990 2.9790 -2.0450 95 0 0 0 0