REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = N,N-[2,5-O-[DI-4-PYRIDIN-3-YL-BENZYL]-GLUCARYL]-DI-[VALYL-AMIDO-METHANE] RESIDUE BEJ 31 124 1 124 1 CHI1 0 0 0.0000 3 8 9 10 18 2 PHI1 0 0 0.0000 2 1 24 28 0 3 PHI2 0 0 0.0000 1 24 28 29 0 4 PHI3 0 0 0.0000 24 28 29 59 0 5 CHI2 0 0 0.0000 28 29 30 31 57 6 CHI3 0 0 0.0000 29 30 32 33 57 7 CHI4 0 0 0.0000 30 32 33 34 56 8 CHI5 0 0 0.0000 32 33 34 35 46 9 CHI6 0 0 0.0000 33 34 35 36 39 10 CHI7 0 0 0.0000 33 34 40 41 44 11 CHI8 0 0 0.0000 32 33 47 48 55 12 CHI9 0 0 0.0000 33 47 49 50 55 13 CHI10 0 0 0.0000 47 49 50 51 54 14 PHI4 0 0 0.0000 28 29 59 63 0 15 CHI11 0 0 0.0000 29 59 60 61 61 16 PHI5 0 0 0.0000 29 59 63 67 0 17 CHI12 0 0 0.0000 59 63 64 65 65 18 PHI6 0 0 0.0000 59 63 67 97 0 19 CHI13 0 0 0.0000 63 67 68 69 95 20 CHI14 0 0 0.0000 67 68 70 71 95 21 CHI15 0 0 0.0000 68 70 71 72 94 22 CHI16 0 0 0.0000 70 71 72 73 84 23 CHI17 0 0 0.0000 71 72 73 74 77 24 CHI18 0 0 0.0000 71 72 78 79 82 25 CHI19 0 0 0.0000 70 71 85 86 93 26 CHI20 0 0 0.0000 71 85 87 88 93 27 CHI21 0 0 0.0000 85 87 88 89 92 28 PHI7 0 0 0.0000 63 67 97 98 0 29 PHI8 0 0 0.0000 67 97 98 102 0 30 PHI9 0 0 0.0000 97 98 102 107 0 31 PHI10 0 0 0.0000 104 111 115 123 0 1 C01 C_ARO 0 0.0000 4.1870 1.2490 -0.4940 2 6 24 0 0 2 C02 C_ARO 0 0.0000 4.5390 2.2700 -1.3580 1 3 5 0 0 3 C03 C_ARO 0 0.0000 5.3900 2.0210 -2.4150 2 4 8 0 0 4 H3 H_ALI 0 0.0000 5.6640 2.8190 -3.0890 3 0 0 0 22 5 H2 H_ALI 0 0.0000 4.1460 3.2650 -1.2050 2 0 0 0 21 6 C06 C_ARO 0 0.0000 4.6910 -0.0250 -0.6790 1 7 20 0 0 7 C05 C_ARO 0 0.0000 5.5390 -0.2870 -1.7360 6 8 19 0 0 8 C04 C_ARO 0 0.0000 5.8960 0.7370 -2.6100 3 7 9 0 0 9 C45 C_ARO 0 0.0000 6.8120 0.4630 -3.7450 8 10 14 0 0 10 C46 C_ARO 0 0.0000 7.9110 -0.3850 -3.5820 9 11 13 0 0 11 C47 C_ARO 0 0.0000 8.7350 -0.6090 -4.6710 10 12 16 0 0 12 H47 H_ALI 0 0.0000 9.5940 -1.2580 -4.5820 11 0 0 0 0 13 H46 H_ALI 0 0.0000 8.1130 -0.8530 -2.6300 10 0 0 0 0 14 C50 C_ARO 0 0.0000 6.5870 1.0410 -4.9920 9 15 18 0 0 15 N49 N_AMO 0 0.0000 7.4030 0.8030 -5.9990 14 16 0 0 0 16 C48 C_ARO 0 0.0000 8.4470 0.0080 -5.8750 11 15 17 0 0 17 H48 H_ALI 0 0.0000 9.0880 -0.1650 -6.7270 16 0 0 0 0 18 H50 H_ALI 0 0.0000 5.7420 1.6990 -5.1320 14 0 0 0 0 19 H5 H_ALI 0 0.0000 5.9280 -1.2840 -1.8830 7 0 0 0 22 20 H6 H_ALI 0 0.0000 4.4140 -0.8190 -0.0010 6 0 0 0 21 21 Q9 PSEUD 0 0.0000 4.2800 1.2230 -0.6030 0 0 0 0 23 22 Q10 PSEUD 0 0.0000 5.7960 0.7675 -2.4860 0 0 0 0 23 23 QQC PSEUD 0 0.0000 5.0380 0.9952 -1.5445 0 0 0 0 0 24 C31 C_ALI 0 0.0000 3.2560 1.5280 0.6590 1 25 26 28 0 25 H311 H_ALI 0 0.0000 3.3800 2.5610 0.9840 24 0 0 0 27 26 H312 H_ALI 0 0.0000 3.4900 0.8560 1.4850 24 0 0 0 27 27 Q1 PSEUD 0 0.0000 3.4350 1.7085 1.2345 0 0 0 0 0 28 O30 O_EST 0 0.0000 1.9060 1.3180 0.2410 24 29 0 0 0 29 C18 C_ALI 0 0.0000 1.0760 1.5970 1.3710 28 30 58 59 0 30 C19 C_BYL 0 0.0000 0.6970 3.0560 1.3680 29 31 32 0 0 31 O20 O_BYL 0 0.0000 1.0210 3.7650 0.4390 30 0 0 0 0 32 N21 N_AMO 0 0.0000 -0.0020 3.5720 2.3980 30 33 57 0 0 33 C22 C_ALI 0 0.0000 -0.3710 4.9900 2.3960 32 34 47 56 0 34 C23 C_ALI 0 0.0000 -1.6700 5.1780 1.6100 33 35 40 46 0 35 C24 C_ALI 0 0.0000 -1.4700 4.7000 0.1710 34 36 37 38 0 36 H241 H_ALI 0 0.0000 -2.3960 4.8340 -0.3890 35 0 0 0 39 37 H242 H_ALI 0 0.0000 -0.6750 5.2810 -0.2970 35 0 0 0 39 38 H243 H_ALI 0 0.0000 -1.1950 3.6450 0.1730 35 0 0 0 39 39 Q2 PSEUD 0 0.0000 -1.4220 4.5867 -0.1710 0 0 0 0 45 40 C25 C_ALI 0 0.0000 -2.7850 4.3620 2.2680 34 41 42 43 0 41 H251 H_ALI 0 0.0000 -2.9280 4.7020 3.2930 40 0 0 0 44 42 H252 H_ALI 0 0.0000 -3.7110 4.4960 1.7080 40 0 0 0 44 43 H253 H_ALI 0 0.0000 -2.5110 3.3070 2.2700 40 0 0 0 44 44 Q3 PSEUD 0 0.0000 -3.0500 4.1683 2.4237 0 0 0 0 45 45 QQA PSEUD 0 0.0000 -2.2360 4.3775 1.1263 0 0 0 0 0 46 H23 H_ALI 0 0.0000 -1.9440 6.2330 1.6090 34 0 0 0 0 47 C26 C_BYL 0 0.0000 -0.5680 5.4600 3.8140 33 48 49 0 0 48 O27 O_BYL 0 0.0000 -0.4160 4.6870 4.7360 47 0 0 0 0 49 N28 N_AMO 0 0.0000 -0.9140 6.7400 4.0570 47 50 55 0 0 50 C29 C_ALI 0 0.0000 -1.1060 7.1970 5.4360 49 51 52 53 0 51 H291 H_ALI 0 0.0000 -1.3800 8.2520 5.4340 50 0 0 0 54 52 H292 H_ALI 0 0.0000 -1.9000 6.6160 5.9040 50 0 0 0 54 53 H293 H_ALI 0 0.0000 -0.1800 7.0630 5.9950 50 0 0 0 54 54 Q4 PSEUD 0 0.0000 -1.1533 7.3103 5.7777 0 0 0 0 0 55 H28 H_AMI 0 0.0000 -1.0350 7.3580 3.3200 49 0 0 0 0 56 H22 H_ALI 0 0.0000 0.4240 5.5710 1.9280 33 0 0 0 0 57 H21 H_AMI 0 0.0000 -0.2610 3.0050 3.1410 32 0 0 0 0 58 H18 H_ALI 0 0.0000 1.6200 1.3650 2.2870 29 0 0 0 0 59 C17 C_ALI 0 0.0000 -0.1900 0.7410 1.2980 29 60 62 63 0 60 O32 O_HYD 0 0.0000 -1.0190 1.0200 2.4280 59 61 0 0 0 61 H32 H_OXY 0 0.0000 -0.5020 0.8010 3.2150 60 0 0 0 0 62 H17 H_ALI 0 0.0000 -0.7330 0.9730 0.3820 59 0 0 0 0 63 C16 C_ALI 0 0.0000 0.1950 -0.7400 1.3010 59 64 66 67 0 64 O33 O_HYD 0 0.0000 1.0070 -1.0190 2.4430 63 65 0 0 0 65 H33 H_OXY 0 0.0000 0.4770 -0.8010 3.2220 64 0 0 0 0 66 H16 H_ALI 0 0.0000 0.7530 -0.9720 0.3930 63 0 0 0 0 67 C15 C_ALI 0 0.0000 -1.0720 -1.5960 1.3530 63 68 96 97 0 68 C34 C_BYL 0 0.0000 -0.6920 -3.0550 1.3560 67 69 70 0 0 69 O35 O_BYL 0 0.0000 -1.0020 -3.7630 0.4220 68 0 0 0 0 70 N36 N_AMO 0 0.0000 -0.0090 -3.5710 2.3970 68 71 95 0 0 71 C37 C_ALI 0 0.0000 0.3590 -4.9890 2.3990 70 72 85 94 0 72 C38 C_ALI 0 0.0000 1.6710 -5.1770 1.6350 71 73 78 84 0 73 C39 C_ALI 0 0.0000 1.4590 -4.8170 0.1630 72 74 75 76 0 74 H391 H_ALI 0 0.0000 1.1390 -3.7780 0.0850 73 0 0 0 77 75 H392 H_ALI 0 0.0000 2.3940 -4.9500 -0.3820 73 0 0 0 77 76 H393 H_ALI 0 0.0000 0.6940 -5.4660 -0.2640 73 0 0 0 77 77 Q5 PSEUD 0 0.0000 1.4090 -4.7313 -0.1870 0 0 0 0 0 78 C40 C_ALI 0 0.0000 2.7450 -4.2660 2.2330 72 79 80 81 83 79 H401 H_ALI 0 0.0000 2.3930 -3.2340 2.2230 78 0 0 0 82 80 H402 H_ALI 0 0.0000 2.9490 -4.5700 3.2600 78 0 0 0 82 81 H403 H_ALI 0 0.0000 3.6580 -4.3440 1.6430 78 0 0 0 82 82 Q6 PSEUD 0 0.0000 3.0000 -4.0493 2.3753 0 0 0 0 0 83 QQB PSEUD 0 0.0000 2.6792 -0.8263 1.1165 0 0 0 0 83 84 H38 H_ALI 0 0.0000 1.9910 -6.2160 1.7120 72 0 0 0 0 85 C41 C_BYL 0 0.0000 0.5340 -5.4600 3.8200 71 86 87 0 0 86 O42 O_BYL 0 0.0000 0.7750 -4.6600 4.6990 85 0 0 0 0 87 N43 N_AMO 0 0.0000 0.4240 -6.7710 4.1140 85 88 93 0 0 88 C44 C_ALI 0 0.0000 0.4820 -7.2160 5.5090 87 89 90 91 0 89 H441 H_ALI 0 0.0000 0.3750 -8.3000 5.5490 88 0 0 0 92 90 H442 H_ALI 0 0.0000 1.4400 -6.9290 5.9420 88 0 0 0 92 91 H443 H_ALI 0 0.0000 -0.3260 -6.7510 6.0730 88 0 0 0 92 92 Q7 PSEUD 0 0.0000 0.4963 -7.3267 5.8547 0 0 0 0 0 93 H43 H_AMI 0 0.0000 0.3060 -7.4190 3.4020 87 0 0 0 0 94 H37 H_ALI 0 0.0000 -0.4280 -5.5700 1.9180 71 0 0 0 0 95 H36 H_AMI 0 0.0000 0.2380 -3.0050 3.1440 70 0 0 0 0 96 H15 H_ALI 0 0.0000 -1.6290 -1.3640 2.2610 67 0 0 0 0 97 O14 O_EST 0 0.0000 -1.8830 -1.3170 0.2110 67 98 0 0 0 98 C13 C_ALI 0 0.0000 -3.2400 -1.5270 0.6070 97 99 100 102 0 99 H131 H_ALI 0 0.0000 -3.3690 -2.5600 0.9300 98 0 0 0 101 100 H132 H_ALI 0 0.0000 -3.4860 -0.8550 1.4290 98 0 0 0 101 101 Q8 PSEUD 0 0.0000 -3.4275 -1.7075 1.1795 0 0 0 0 0 102 C07 C_ARO 0 0.0000 -4.1520 -1.2470 -0.5600 98 103 107 0 0 103 C12 C_ARO 0 0.0000 -4.6530 0.0270 -0.7530 102 104 106 0 0 104 C11 C_ARO 0 0.0000 -5.4850 0.2900 -1.8230 103 105 111 0 0 105 H11 H_ALI 0 0.0000 -5.8720 1.2870 -1.9760 104 0 0 0 113 106 H12 H_ALI 0 0.0000 -4.3870 0.8200 -0.0700 103 0 0 0 112 107 C08 C_ARO 0 0.0000 -4.4900 -2.2680 -1.4300 102 108 109 0 0 108 H8 H_ALI 0 0.0000 -4.1000 -3.2630 -1.2720 107 0 0 0 112 109 C09 C_ARO 0 0.0000 -5.3250 -2.0180 -2.5000 107 110 111 0 0 110 H9 H_ALI 0 0.0000 -5.5880 -2.8160 -3.1790 109 0 0 0 113 111 C10 C_ARO 0 0.0000 -5.8280 -0.7350 -2.7030 104 109 115 0 0 112 Q11 PSEUD 0 0.0000 -4.2435 -1.2215 -0.6710 0 0 0 0 114 113 Q12 PSEUD 0 0.0000 -5.7300 -0.7645 -2.5775 0 0 0 0 114 114 QQD PSEUD 0 0.0000 -4.9867 -0.9930 -1.6242 0 0 0 0 0 115 C51 C_ARO 0 0.0000 -6.7260 -0.4590 -3.8520 111 116 123 0 0 116 C52 C_ARO 0 0.0000 -7.8280 0.3880 -3.7050 115 117 122 0 0 117 C53 C_ARO 0 0.0000 -8.6340 0.6130 -4.8080 116 118 121 0 0 118 C54 C_ARO 0 0.0000 -8.3270 -0.0030 -6.0070 117 119 120 0 0 119 N55 N_AMO 0 0.0000 -7.2810 -0.7990 -6.1150 118 123 0 0 0 120 H54 H_ALI 0 0.0000 -8.9550 0.1690 -6.8690 118 0 0 0 0 121 H53 H_ALI 0 0.0000 -9.4940 1.2620 -4.7310 117 0 0 0 0 122 H52 H_ALI 0 0.0000 -8.0440 0.8560 -2.7560 116 0 0 0 0 123 C56 C_ARO 0 0.0000 -6.4810 -1.0370 -5.0950 115 119 124 0 0 124 H56 H_ALI 0 0.0000 -5.6340 -1.6950 -5.2230 123 0 0 0 0