REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = N-BENZOYL-L-PHENYLALANYL-4-[(5S)-1,1-DIOXIDO-3-OXOISOTHIAZOLIDIN-5-YL]-L-PHENYLALANINAMIDE RESIDUE F20 17 80 1 80 1 CHI1 0 0 0.0000 8 1 2 3 7 2 CHI2 0 0 0.0000 1 2 3 4 4 3 CHI3 0 0 0.0000 2 1 8 9 12 4 CHI4 0 0 0.0000 1 8 9 10 10 5 PHI1 0 0 0.0000 2 1 14 19 0 6 PHI2 0 0 0.0000 16 23 27 31 0 7 PHI3 0 0 0.0000 23 27 31 39 0 8 CHI5 0 0 0.0000 27 31 32 33 37 9 CHI6 0 0 0.0000 31 32 34 35 37 10 PHI4 0 0 0.0000 27 31 39 41 0 11 PHI5 0 0 0.0000 31 39 41 43 0 12 PHI6 0 0 0.0000 39 41 43 63 0 13 CHI7 0 0 0.0000 41 43 44 45 61 14 CHI8 0 0 0.0000 43 44 45 46 56 15 PHI7 0 0 0.0000 41 43 63 65 0 16 PHI8 0 0 0.0000 43 63 65 67 0 17 PHI9 0 0 0.0000 63 65 67 76 0 1 C1 C_ALI 0 0.0000 -4.5490 -1.5600 0.9230 2 8 13 14 0 2 C2 C_ALI 0 0.0000 -4.3780 -2.5870 -0.2270 1 3 5 6 0 3 C3 C_BYL 0 0.0000 -5.5420 -2.4560 -1.1630 2 4 9 0 0 4 O9 O_BYL 0 0.0000 -5.4800 -2.8880 -2.2950 3 0 0 0 0 5 H2C1 H_ALI 0 0.0000 -3.4520 -2.3850 -0.7650 2 0 0 0 7 6 H2C2 H_ALI 0 0.0000 -4.3490 -3.5960 0.1830 2 0 0 0 7 7 Q1 PSEUD 0 0.0000 -3.9005 -2.9905 -0.2910 0 0 0 0 0 8 S5 S_XXX 0 0.0000 -6.3750 -1.3460 0.8540 1 9 11 12 0 9 N4 N_AMO 0 0.0000 -6.6550 -1.8520 -0.7190 3 8 10 0 0 10 H4 H_AMI 0 0.0000 -7.4760 -1.7300 -1.2200 9 0 0 0 0 11 O6 O_XXX 0 0.0000 -7.0570 -2.3150 1.6370 8 0 0 0 0 12 O7 O_XXX 0 0.0000 -6.7520 0.0240 0.8300 8 0 0 0 0 13 H1 H_ALI 0 0.0000 -4.2320 -1.9760 1.8800 1 0 0 0 0 14 C11 C_ARO 0 0.0000 -3.8310 -0.2700 0.6230 1 15 19 0 0 15 C16 C_ARO 0 0.0000 -4.1070 0.4200 -0.5430 14 16 18 0 0 16 C15 C_ARO 0 0.0000 -3.4510 1.6050 -0.8170 15 17 23 0 0 17 H15 H_ALI 0 0.0000 -3.6670 2.1440 -1.7270 16 0 0 0 25 18 H16 H_ALI 0 0.0000 -4.8380 0.0350 -1.2380 15 0 0 0 24 19 C12 C_ARO 0 0.0000 -2.8940 0.2230 1.5120 14 20 21 0 0 20 H12 H_ALI 0 0.0000 -2.6780 -0.3160 2.4230 19 0 0 0 24 21 C13 C_ARO 0 0.0000 -2.2350 1.4060 1.2360 19 22 23 0 0 22 H13 H_ALI 0 0.0000 -1.5030 1.7920 1.9310 21 0 0 0 25 23 C14 C_ARO 0 0.0000 -2.5110 2.0960 0.0700 16 21 27 0 0 24 Q5 PSEUD 0 0.0000 -3.7580 -0.1405 0.5925 0 0 0 0 26 25 Q6 PSEUD 0 0.0000 -2.5850 1.9680 0.1020 0 0 0 0 26 26 QQA PSEUD 0 0.0000 -3.1715 0.9138 0.3473 0 0 0 0 0 27 C21 C_ALI 0 0.0000 -1.7910 3.3850 -0.2310 23 28 29 31 0 28 H211 H_ALI 0 0.0000 -1.5370 3.8860 0.7030 27 0 0 0 30 29 H212 H_ALI 0 0.0000 -2.4370 4.0320 -0.8250 27 0 0 0 30 30 Q2 PSEUD 0 0.0000 -1.9870 3.9590 -0.0610 0 0 0 0 0 31 C22 C_ALI 0 0.0000 -0.5120 3.0850 -1.0140 27 32 38 39 0 32 C25 C_BYL 0 0.0000 0.1440 4.3790 -1.4210 31 33 34 0 0 33 O26 O_BYL 0 0.0000 1.2680 4.6340 -1.0440 32 0 0 0 0 34 N27 N_AMO 0 0.0000 -0.5190 5.2530 -2.2040 32 35 36 0 0 35 H271 H_AMI 0 0.0000 -0.0970 6.0860 -2.4660 34 0 0 0 37 36 H272 H_AMI 0 0.0000 -1.4170 5.0470 -2.5090 34 0 0 0 37 37 Q3 PSEUD 0 0.0000 -0.7570 5.5665 -2.4875 0 0 0 0 0 38 H22 H_ALI 0 0.0000 -0.7580 2.5060 -1.9040 31 0 0 0 0 39 N45 N_AMI 0 0.0000 0.4070 2.3160 -0.1710 31 40 41 0 0 40 H45 H_AMI 0 0.0000 0.3490 2.3810 0.7950 39 0 0 0 0 41 C47 C_BYL 0 0.0000 1.3340 1.5180 -0.7380 39 42 43 0 0 42 O49 O_BYL 0 0.0000 1.4070 1.4370 -1.9450 41 0 0 0 0 43 C48 C_ALI 0 0.0000 2.2800 0.7280 0.1290 41 44 62 63 0 44 C4 C_ALI 0 0.0000 3.0980 1.6860 0.9980 43 45 59 60 0 45 C5 C_ARO 0 0.0000 3.9540 0.8930 1.9510 44 46 50 0 0 46 C30 C_ARO 0 0.0000 5.2290 0.5090 1.5790 45 47 49 0 0 47 C31 C_ARO 0 0.0000 6.0140 -0.2180 2.4540 46 48 52 0 0 48 H31 H_ALI 0 0.0000 7.0100 -0.5190 2.1630 47 0 0 0 57 49 H30 H_ALI 0 0.0000 5.6110 0.7770 0.6060 46 0 0 0 56 50 C34 C_ARO 0 0.0000 3.4670 0.5540 3.2000 45 51 55 0 0 51 C33 C_ARO 0 0.0000 4.2510 -0.1770 4.0720 50 52 54 0 0 52 C6 C_ARO 0 0.0000 5.5250 -0.5620 3.7000 47 51 53 0 0 53 H6 H_ALI 0 0.0000 6.1390 -1.1310 4.3830 52 0 0 0 0 54 H33 H_ALI 0 0.0000 3.8680 -0.4460 5.0460 51 0 0 0 57 55 H34 H_ALI 0 0.0000 2.4710 0.8540 3.4900 50 0 0 0 56 56 Q7 PSEUD 0 0.0000 4.0410 0.8155 2.0480 0 0 0 0 58 57 Q8 PSEUD 0 0.0000 5.4390 -0.4825 3.6045 0 0 0 0 58 58 QQB PSEUD 0 0.0000 4.7400 0.1665 2.8263 0 0 0 0 0 59 H4C1 H_ALI 0 0.0000 3.7350 2.2990 0.3610 44 0 0 0 61 60 H4C2 H_ALI 0 0.0000 2.4230 2.3280 1.5640 44 0 0 0 61 61 Q4 PSEUD 0 0.0000 3.0790 2.3135 0.9625 0 0 0 0 0 62 H48 H_ALI 0 0.0000 1.7090 0.0550 0.7690 43 0 0 0 0 63 N51 N_AMI 0 0.0000 3.1830 -0.0540 -0.7190 43 64 65 0 0 64 H51 H_AMI 0 0.0000 3.3710 0.2380 -1.6250 63 0 0 0 0 65 C67 C_BYL 0 0.0000 3.7520 -1.1780 -0.2410 63 66 67 0 0 66 O70 O_BYL 0 0.0000 3.5160 -1.5440 0.8940 65 0 0 0 0 67 C71 C_ARO 0 0.0000 4.6630 -1.9670 -1.0980 65 68 76 0 0 68 C74 C_ARO 0 0.0000 5.2540 -3.1320 -0.6060 67 69 75 0 0 69 C75 C_ARO 0 0.0000 6.1030 -3.8640 -1.4100 68 70 74 0 0 70 C76 C_ARO 0 0.0000 6.3690 -3.4450 -2.7020 69 71 73 0 0 71 C77 C_ARO 0 0.0000 5.7870 -2.2910 -3.1950 70 72 76 0 0 72 H77 H_ALI 0 0.0000 5.9990 -1.9690 -4.2040 71 0 0 0 79 73 H76 H_ALI 0 0.0000 7.0350 -4.0210 -3.3270 70 0 0 0 0 74 H75 H_ALI 0 0.0000 6.5610 -4.7650 -1.0310 69 0 0 0 79 75 H74 H_ALI 0 0.0000 5.0470 -3.4600 0.4020 68 0 0 0 78 76 C78 C_ARO 0 0.0000 4.9310 -1.5530 -2.4030 67 71 77 0 0 77 H78 H_ALI 0 0.0000 4.4770 -0.6530 -2.7900 76 0 0 0 78 78 Q9 PSEUD 0 0.0000 4.7620 -2.0565 -1.1940 0 0 0 0 80 79 Q10 PSEUD 0 0.0000 6.2800 -3.3670 -2.6175 0 0 0 0 80 80 QQC PSEUD 0 0.0000 5.5210 -2.7118 -1.9058 0 0 0 0 0