REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = "TRI166 (BIFUNCTIONAL BORONATE INHIBITOR)" RESIDUE T29 24 81 1 81 1 CHI1 0 0 0.0000 1 3 4 5 7 2 PHI1 0 0 0.0000 1 3 8 9 0 3 PHI2 0 0 0.0000 3 8 9 13 0 4 PHI3 0 0 0.0000 8 9 13 17 0 5 PHI4 0 0 0.0000 9 13 17 21 0 6 PHI5 0 0 0.0000 13 17 21 28 0 7 CHI2 0 0 0.0000 17 21 22 23 26 8 CHI3 0 0 0.0000 21 22 23 24 24 9 CHI4 0 0 0.0000 21 22 25 26 26 10 PHI6 0 0 0.0000 17 21 28 30 0 11 PHI7 0 0 0.0000 21 28 30 32 0 12 PHI8 0 0 0.0000 28 30 32 46 0 13 CHI5 0 0 0.0000 30 32 33 34 44 14 CHI6 0 0 0.0000 32 33 34 35 41 15 CHI7 0 0 0.0000 33 34 35 36 38 16 PHI9 0 0 0.0000 30 32 46 47 0 17 PHI10 0 0 0.0000 32 46 47 49 0 18 PHI11 0 0 0.0000 46 47 49 69 0 19 CHI8 0 0 0.0000 47 49 50 51 67 20 CHI9 0 0 0.0000 49 50 51 52 62 21 PHI12 0 0 0.0000 47 49 69 71 0 22 PHI13 0 0 0.0000 49 69 71 73 0 23 PHI14 0 0 0.0000 69 71 73 77 0 24 PHI15 0 0 0.0000 71 73 77 80 0 1 N1A N_AMI 0 0.0000 1.1620 1.8660 8.7740 2 3 0 0 0 2 HN1 H_AMI 0 0.0000 1.3110 2.5270 9.4680 1 0 0 0 0 3 C1 C_BYL 0 0.0000 1.4980 0.6220 8.9750 1 4 8 0 0 4 N1B N_AMO 0 0.0000 2.0630 0.2470 10.1710 3 5 6 0 0 5 HN11 H_AMI 0 0.0000 2.2110 0.9080 10.8660 4 0 0 0 7 6 HN12 H_AMI 0 0.0000 2.3120 -0.6780 10.3210 4 0 0 0 7 7 Q1 PSEUD 0 0.0000 2.2615 0.1150 10.5935 0 0 0 0 0 8 S2 S_RED 0 0.0000 1.2270 -0.5770 7.7130 3 9 0 0 0 9 C3 C_ALI 0 0.0000 0.4920 0.4710 6.4340 8 10 11 13 0 10 H31 H_ALI 0 0.0000 1.1970 1.2540 6.1570 9 0 0 0 12 11 H32 H_ALI 0 0.0000 -0.4220 0.9240 6.8180 9 0 0 0 12 12 Q2 PSEUD 0 0.0000 0.3875 1.0890 6.4875 0 0 0 0 0 13 C4 C_ALI 0 0.0000 0.1630 -0.3780 5.2050 9 14 15 17 0 14 H41 H_ALI 0 0.0000 -0.5410 -1.1610 5.4830 13 0 0 0 16 15 H42 H_ALI 0 0.0000 1.0770 -0.8310 4.8220 13 0 0 0 16 16 Q3 PSEUD 0 0.0000 0.2680 -0.9960 5.1525 0 0 0 0 0 17 C5 C_ALI 0 0.0000 -0.4580 0.5070 4.1240 13 18 19 21 0 18 H51 H_ALI 0 0.0000 0.2460 1.2910 3.8460 17 0 0 0 20 19 H52 H_ALI 0 0.0000 -1.3720 0.9610 4.5070 17 0 0 0 20 20 Q4 PSEUD 0 0.0000 -0.5630 1.1260 4.1765 0 0 0 0 0 21 C6 C_ALI 0 0.0000 -0.7870 -0.3410 2.8950 17 22 27 28 0 22 B X_XXX 0 0.0000 -1.8030 -1.4690 3.2950 21 23 25 0 0 23 O1A O_HYD 0 0.0000 -3.0740 -1.1250 3.8240 22 24 0 0 0 24 HO1A H_OXY 0 0.0000 -3.5380 -1.9550 4.0010 23 0 0 0 0 25 O1B O_HYD 0 0.0000 -1.4490 -2.8350 3.1280 22 26 0 0 0 26 HO1B H_OXY 0 0.0000 -0.5550 -2.8490 2.7600 25 0 0 0 0 27 H6 H_ALI 0 0.0000 0.1270 -0.7940 2.5110 21 0 0 0 0 28 N7 N_AMI 0 0.0000 -1.3820 0.5070 1.8600 21 29 30 0 0 29 HN7 H_AMI 0 0.0000 -1.9000 1.2870 2.1110 28 0 0 0 0 30 C8 C_BYL 0 0.0000 -1.2100 0.2030 0.5580 28 31 32 0 0 31 O8 O_BYL 0 0.0000 -0.5620 -0.7720 0.2430 30 0 0 0 0 32 C9 C_ALI 0 0.0000 -1.8230 1.0760 -0.5060 30 33 45 46 0 33 C9A C_ALI 0 0.0000 -3.3590 1.0820 -0.3600 32 34 42 43 0 34 C9B C_ALI 0 0.0000 -3.8500 1.0750 -1.8320 33 35 39 40 0 35 C9C C_ALI 0 0.0000 -2.7760 0.1900 -2.5140 34 36 37 46 0 36 H9C1 H_ALI 0 0.0000 -2.7170 0.4190 -3.5780 35 0 0 0 38 37 H9C2 H_ALI 0 0.0000 -3.0030 -0.8640 -2.3640 35 0 0 0 38 38 Q5 PSEUD 0 0.0000 -2.8600 -0.2225 -2.9710 0 0 0 0 0 39 H9B1 H_ALI 0 0.0000 -3.8490 2.0820 -2.2490 34 0 0 0 41 40 H9B2 H_ALI 0 0.0000 -4.8380 0.6220 -1.9120 34 0 0 0 41 41 Q6 PSEUD 0 0.0000 -4.3435 1.3520 -2.0805 0 0 0 0 0 42 H9A1 H_ALI 0 0.0000 -3.6970 1.9810 0.1540 33 0 0 0 44 43 H9A2 H_ALI 0 0.0000 -3.6970 0.1870 0.1620 33 0 0 0 44 44 Q7 PSEUD 0 0.0000 -3.6970 1.0840 0.1580 0 0 0 0 0 45 H9 H_ALI 0 0.0000 -1.4380 2.0920 -0.4180 32 0 0 0 0 46 N10 N_AMI 0 0.0000 -1.5130 0.5450 -1.8410 32 35 47 0 0 47 C11 C_BYL 0 0.0000 -0.2790 0.4000 -2.3620 46 48 49 0 0 48 O11 O_BYL 0 0.0000 0.6930 0.7260 -1.7160 47 0 0 0 0 49 C12 C_ALI 0 0.0000 -0.1070 -0.1660 -3.7480 47 50 68 69 0 50 C13 C_ALI 0 0.0000 -0.1270 0.9710 -4.7710 49 51 65 66 0 51 C21 C_ARO 0 0.0000 0.0440 0.4040 -6.1560 50 52 56 0 0 52 C22 C_ARO 0 0.0000 -1.0650 0.0330 -6.8930 51 53 55 0 0 53 C23 C_ARO 0 0.0000 -0.9070 -0.4860 -8.1640 52 54 58 0 0 54 H23 H_ALI 0 0.0000 -1.7740 -0.7770 -8.7400 53 0 0 0 63 55 H22 H_ALI 0 0.0000 -2.0540 0.1490 -6.4760 52 0 0 0 62 56 C26 C_ARO 0 0.0000 1.3100 0.2610 -6.6930 51 57 61 0 0 57 C25 C_ARO 0 0.0000 1.4670 -0.2620 -7.9620 56 58 60 0 0 58 C24 C_ARO 0 0.0000 0.3580 -0.6340 -8.6990 53 57 59 0 0 59 H24 H_ALI 0 0.0000 0.4810 -1.0410 -9.6920 58 0 0 0 0 60 H25 H_ALI 0 0.0000 2.4560 -0.3780 -8.3800 57 0 0 0 63 61 H26 H_ALI 0 0.0000 2.1760 0.5520 -6.1170 56 0 0 0 62 62 Q11 PSEUD 0 0.0000 0.0610 0.3505 -6.2965 0 0 0 0 64 63 Q12 PSEUD 0 0.0000 0.3410 -0.5775 -8.5600 0 0 0 0 64 64 QQA PSEUD 0 0.0000 0.2010 -0.1135 -7.4282 0 0 0 0 0 65 H131 H_ALI 0 0.0000 -1.0790 1.4990 -4.7090 50 0 0 0 67 66 H132 H_ALI 0 0.0000 0.6860 1.6640 -4.5580 50 0 0 0 67 67 Q8 PSEUD 0 0.0000 -0.1965 1.5815 -4.6335 0 0 0 0 0 68 H12 H_ALI 0 0.0000 -0.9210 -0.8590 -3.9600 49 0 0 0 0 69 N14 N_AMI 0 0.0000 1.1710 -0.8750 -3.8310 49 70 71 0 0 70 HN4 H_AMI 0 0.0000 1.1890 -1.8200 -4.0490 69 0 0 0 0 71 C15 C_BYL 0 0.0000 2.3240 -0.2140 -3.6050 69 72 73 0 0 72 O15 O_BYL 0 0.0000 2.3020 0.9670 -3.3320 71 0 0 0 0 73 C16 C_ALI 0 0.0000 3.6400 -0.9430 -3.6900 71 74 75 77 0 74 H161 H_ALI 0 0.0000 3.7640 -1.3530 -4.6920 73 0 0 0 76 75 H162 H_ALI 0 0.0000 3.6540 -1.7540 -2.9610 73 0 0 0 76 76 Q9 PSEUD 0 0.0000 3.7090 -1.5535 -3.8265 0 0 0 0 0 77 C17 C_ALI 0 0.0000 4.7820 0.0290 -3.3920 73 78 79 80 0 78 H171 H_ALI 0 0.0000 5.7340 -0.4980 -3.4540 77 0 0 0 81 79 H172 H_ALI 0 0.0000 4.7680 0.8390 -4.1200 77 0 0 0 81 80 H173 H_ALI 0 0.0000 4.6580 0.4390 -2.3900 77 0 0 0 81 81 Q10 PSEUD 0 0.0000 5.0533 0.2600 -3.3213 0 0 0 0 0