REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = "3-[[N-[4-METHYL-PIPERAZINYL]CARBONYL]-PHENYLALANINYL-AMINO]-5-PHENYL-PENTANE-1-SULFONIC ACID BENZYLOXY-AMIDE" RESIDUE VS4 24 107 1 107 1 CHI1 0 0 0.0000 25 1 2 3 24 2 CHI2 0 0 0.0000 1 2 3 4 10 3 CHI3 0 0 0.0000 2 3 4 5 7 4 CHI4 0 0 0.0000 1 2 11 12 24 5 CHI5 0 0 0.0000 2 11 12 13 21 6 CHI6 0 0 0.0000 11 12 13 14 18 7 CHI7 0 0 0.0000 12 13 14 15 18 8 PHI1 0 0 0.0000 2 1 26 28 0 9 PHI2 0 0 0.0000 1 26 28 48 0 10 CHI8 0 0 0.0000 26 28 29 30 46 11 CHI9 0 0 0.0000 28 29 30 31 41 12 PHI3 0 0 0.0000 26 28 48 50 0 13 PHI4 0 0 0.0000 28 48 50 52 0 14 PHI5 0 0 0.0000 48 50 52 76 0 15 CHI10 0 0 0.0000 50 52 53 54 74 16 CHI11 0 0 0.0000 52 53 54 55 71 17 CHI12 0 0 0.0000 53 54 55 56 66 18 PHI6 0 0 0.0000 50 52 76 106 0 19 CHI13 0 0 0.0000 52 76 77 78 104 20 CHI14 0 0 0.0000 76 77 78 79 101 21 CHI15 0 0 0.0000 77 78 79 80 99 22 CHI16 0 0 0.0000 78 79 80 81 98 23 CHI17 0 0 0.0000 79 80 81 82 98 24 CHI18 0 0 0.0000 80 81 82 83 93 1 C8 C_BYL 0 0.0000 -1.5630 -0.3190 3.5950 2 25 26 0 0 2 N3 N_AMO 0 0.0000 -2.3250 0.4950 4.3520 1 3 11 0 0 3 C39 C_ALI 0 0.0000 -3.0120 -0.0060 5.5530 2 4 8 9 0 4 C40 C_ALI 0 0.0000 -2.7220 0.9530 6.7120 3 5 6 13 0 5 H401 H_ALI 0 0.0000 -1.6550 0.9410 6.9340 4 0 0 0 7 6 H402 H_ALI 0 0.0000 -3.2800 0.6360 7.5930 4 0 0 0 7 7 Q1 PSEUD 0 0.0000 -2.4675 0.7885 7.2635 0 0 0 0 0 8 H391 H_ALI 0 0.0000 -2.6410 -1.0010 5.7990 3 0 0 0 10 9 H392 H_ALI 0 0.0000 -4.0860 -0.0480 5.3710 3 0 0 0 10 10 Q2 PSEUD 0 0.0000 -3.3635 -0.5245 5.5850 0 0 0 0 0 11 C48 C_ALI 0 0.0000 -2.4970 1.9140 4.0030 2 12 22 23 0 12 C49 C_ALI 0 0.0000 -2.2390 2.7550 5.2580 11 13 19 20 0 13 N4 N_AMO 0 0.0000 -3.1290 2.3120 6.3380 4 12 14 0 0 14 C33 C_ALI 0 0.0000 -2.8460 3.1710 7.4960 13 15 16 17 0 15 H331 H_ALI 0 0.0000 -3.1330 4.1970 7.2650 14 0 0 0 18 16 H332 H_ALI 0 0.0000 -3.4150 2.8190 8.3560 14 0 0 0 18 17 H333 H_ALI 0 0.0000 -1.7810 3.1340 7.7240 14 0 0 0 18 18 Q3 PSEUD 0 0.0000 -2.7763 3.3833 7.7817 0 0 0 0 0 19 H491 H_ALI 0 0.0000 -2.4310 3.8050 5.0370 12 0 0 0 21 20 H492 H_ALI 0 0.0000 -1.2020 2.6330 5.5690 12 0 0 0 21 21 Q4 PSEUD 0 0.0000 -1.8165 3.2190 5.3030 0 0 0 0 0 22 H481 H_ALI 0 0.0000 -1.7860 2.1890 3.2240 11 0 0 0 24 23 H482 H_ALI 0 0.0000 -3.5140 2.0850 3.6500 11 0 0 0 24 24 Q5 PSEUD 0 0.0000 -2.6500 2.1370 3.4370 0 0 0 0 0 25 O2 O_BYL 0 0.0000 -1.3500 -1.4610 3.9560 1 0 0 0 0 26 N1 N_AMI 0 0.0000 -1.0370 0.1310 2.4400 1 27 28 0 0 27 HN11 H_AMI 0 0.0000 -1.1400 1.0630 2.1900 26 0 0 0 0 28 C9 C_ALI 0 0.0000 -0.3080 -0.7850 1.5590 26 29 47 48 0 29 C10 C_ALI 0 0.0000 -1.2840 -1.4240 0.5690 28 30 44 45 0 30 C11 C_ARO 0 0.0000 -2.3410 -2.1870 1.3250 29 31 35 0 0 31 C12 C_ARO 0 0.0000 -3.5080 -1.5530 1.7110 30 32 34 0 0 32 C13 C_ARO 0 0.0000 -4.4770 -2.2530 2.4050 31 33 37 0 0 33 H131 H_ALI 0 0.0000 -5.3880 -1.7580 2.7060 32 0 0 0 42 34 H121 H_ALI 0 0.0000 -3.6620 -0.5120 1.4700 31 0 0 0 41 35 C16 C_ARO 0 0.0000 -2.1460 -3.5210 1.6290 30 36 40 0 0 36 C15 C_ARO 0 0.0000 -3.1130 -4.2200 2.3270 35 37 39 0 0 37 C14 C_ARO 0 0.0000 -4.2800 -3.5860 2.7130 32 36 38 0 0 38 H141 H_ALI 0 0.0000 -5.0370 -4.1330 3.2560 37 0 0 0 0 39 H151 H_ALI 0 0.0000 -2.9590 -5.2610 2.5680 36 0 0 0 42 40 H161 H_ALI 0 0.0000 -1.2340 -4.0160 1.3280 35 0 0 0 41 41 Q12 PSEUD 0 0.0000 -2.4480 -2.2640 1.3990 0 0 0 0 43 42 Q13 PSEUD 0 0.0000 -4.1735 -3.5095 2.6370 0 0 0 0 43 43 QQA PSEUD 0 0.0000 -3.3108 -2.8867 2.0180 0 0 0 0 0 44 H101 H_ALI 0 0.0000 -1.7570 -0.6450 -0.0280 29 0 0 0 46 45 H102 H_ALI 0 0.0000 -0.7420 -2.1060 -0.0850 29 0 0 0 46 46 Q6 PSEUD 0 0.0000 -1.2495 -1.3755 -0.0565 0 0 0 0 0 47 H91 H_ALI 0 0.0000 0.1630 -1.5640 2.1570 28 0 0 0 0 48 C17 C_BYL 0 0.0000 0.7470 -0.0220 0.8030 28 49 50 0 0 49 O3 O_BYL 0 0.0000 0.8790 1.1690 0.9810 48 0 0 0 0 50 N2 N_AMI 0 0.0000 1.5460 -0.6650 -0.0710 48 51 52 0 0 51 HN21 H_AMI 0 0.0000 1.4400 -1.6190 -0.2140 50 0 0 0 0 52 C18 C_ALI 0 0.0000 2.5730 0.0760 -0.8070 50 53 75 76 0 53 C19 C_ALI 0 0.0000 3.8770 0.0710 -0.0060 52 54 72 73 0 54 C20 C_ALI 0 0.0000 3.6440 0.7340 1.3510 53 55 69 70 0 55 C21 C_ARO 0 0.0000 4.9280 0.7300 2.1400 54 56 60 0 0 56 C22 C_ARO 0 0.0000 5.8080 1.7900 2.0330 55 57 59 0 0 57 C23 C_ARO 0 0.0000 6.9860 1.7860 2.7560 56 58 62 0 0 58 H231 H_ALI 0 0.0000 7.6750 2.6140 2.6720 57 0 0 0 67 59 H221 H_ALI 0 0.0000 5.5760 2.6210 1.3840 56 0 0 0 66 60 C26 C_ARO 0 0.0000 5.2230 -0.3310 2.9740 55 61 65 0 0 61 C25 C_ARO 0 0.0000 6.4030 -0.3370 3.6940 60 62 64 0 0 62 C24 C_ARO 0 0.0000 7.2840 0.7220 3.5870 57 61 63 0 0 63 H241 H_ALI 0 0.0000 8.2040 0.7180 4.1510 62 0 0 0 0 64 H251 H_ALI 0 0.0000 6.6350 -1.1690 4.3430 61 0 0 0 67 65 H261 H_ALI 0 0.0000 4.5340 -1.1590 3.0590 60 0 0 0 66 66 Q14 PSEUD 0 0.0000 5.0550 0.7310 2.2215 0 0 0 0 68 67 Q15 PSEUD 0 0.0000 7.1550 0.7225 3.5075 0 0 0 0 68 68 QQB PSEUD 0 0.0000 6.1050 0.7268 2.8645 0 0 0 0 0 69 H201 H_ALI 0 0.0000 3.3130 1.7620 1.2020 54 0 0 0 71 70 H202 H_ALI 0 0.0000 2.8790 0.1830 1.8990 54 0 0 0 71 71 Q7 PSEUD 0 0.0000 3.0960 0.9725 1.5505 0 0 0 0 0 72 H191 H_ALI 0 0.0000 4.2080 -0.9560 0.1420 53 0 0 0 74 73 H192 H_ALI 0 0.0000 4.6410 0.6230 -0.5540 53 0 0 0 74 74 Q8 PSEUD 0 0.0000 4.4245 -0.1665 -0.2060 0 0 0 0 0 75 H181 H_ALI 0 0.0000 2.2420 1.1030 -0.9570 52 0 0 0 0 76 C27 C_ALI 0 0.0000 2.8070 -0.5870 -2.1660 52 77 105 106 0 77 C28 C_ALI 0 0.0000 1.5030 -0.5820 -2.9660 76 78 102 103 0 78 S1 S_XXX 0 0.0000 1.7790 -1.3690 -4.5770 77 79 100 101 0 79 N5 N_AMO 0 0.0000 0.2930 -1.2800 -5.3010 78 80 99 0 0 80 O6 O_EST 0 0.0000 -0.3080 -0.0190 -5.5290 79 81 0 0 0 81 C34 C_ALI 0 0.0000 -1.5670 -0.2700 -6.1590 80 82 96 97 0 82 C41 C_ARO 0 0.0000 -2.2620 1.0380 -6.4310 81 83 87 0 0 83 C42 C_ARO 0 0.0000 -2.0550 1.6950 -7.6290 82 84 86 0 0 84 C43 C_ARO 0 0.0000 -2.6930 2.8950 -7.8790 83 85 89 0 0 85 H431 H_ALI 0 0.0000 -2.5310 3.4090 -8.8150 84 0 0 0 94 86 H421 H_ALI 0 0.0000 -1.3950 1.2700 -8.3710 83 0 0 0 93 87 C46 C_ARO 0 0.0000 -3.1120 1.5790 -5.4840 82 88 92 0 0 88 C45 C_ARO 0 0.0000 -3.7460 2.7820 -5.7310 87 89 91 0 0 89 C44 C_ARO 0 0.0000 -3.5380 3.4390 -6.9300 84 88 90 0 0 90 H441 H_ALI 0 0.0000 -4.0360 4.3780 -7.1240 89 0 0 0 0 91 H451 H_ALI 0 0.0000 -4.4060 3.2070 -4.9900 88 0 0 0 94 92 H461 H_ALI 0 0.0000 -3.2740 1.0660 -4.5480 87 0 0 0 93 93 Q16 PSEUD 0 0.0000 -2.3345 1.1680 -6.4595 0 0 0 0 95 94 Q17 PSEUD 0 0.0000 -3.4685 3.3080 -6.9025 0 0 0 0 95 95 QQC PSEUD 0 0.0000 -2.9015 2.2380 -6.6810 0 0 0 0 0 96 H341 H_ALI 0 0.0000 -1.4040 -0.7970 -7.0990 81 0 0 0 98 97 H342 H_ALI 0 0.0000 -2.1860 -0.8810 -5.5020 81 0 0 0 98 98 Q9 PSEUD 0 0.0000 -1.7950 -0.8390 -6.3005 0 0 0 0 0 99 HN51 H_AMI 0 0.0000 -0.1650 -2.0920 -5.5680 79 0 0 0 0 100 O4 O_XXX 0 0.0000 2.5890 -0.5630 -5.4220 78 0 0 0 0 101 O5 O_XXX 0 0.0000 1.9840 -2.7690 -4.4480 78 0 0 0 0 102 H281 H_ALI 0 0.0000 0.7380 -1.1340 -2.4190 77 0 0 0 104 103 H282 H_ALI 0 0.0000 1.1720 0.4440 -3.1160 77 0 0 0 104 104 Q10 PSEUD 0 0.0000 0.9550 -0.3450 -2.7675 0 0 0 0 0 105 H271 H_ALI 0 0.0000 3.5710 -0.0350 -2.7130 76 0 0 0 107 106 H272 H_ALI 0 0.0000 3.1370 -1.6150 -2.0160 76 0 0 0 107 107 Q11 PSEUD 0 0.0000 3.3540 -0.8250 -2.3645 0 0 0 0 0