REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = N-ethyl-N-[(4-methylpiperazin-1-yl)carbonyl]-D-phenylalanyl-N-[(1S,2S,4R)-4-(butylcarbamoyl)-1-(cyclohexylmethyl)-2-hydroxy-5-methylhexyl]-L-norleucinamide RESIDUE A70 43 152 1 152 1 CHI1 0 0 0.0000 10 1 2 3 9 2 CHI2 0 0 0.0000 1 2 3 4 6 3 CHI3 0 0 0.0000 2 1 10 11 23 4 CHI4 0 0 0.0000 1 10 11 12 20 5 CHI5 0 0 0.0000 10 11 12 13 17 6 CHI6 0 0 0.0000 11 12 13 14 17 7 PHI1 0 0 0.0000 2 1 24 26 0 8 PHI2 0 0 0.0000 1 24 26 49 0 9 CHI7 0 0 0.0000 24 26 27 28 48 10 CHI8 0 0 0.0000 26 27 28 29 29 11 CHI9 0 0 0.0000 26 27 30 31 47 12 CHI10 0 0 0.0000 27 30 31 32 42 13 PHI3 0 0 0.0000 24 26 49 53 0 14 PHI4 0 0 0.0000 26 49 53 57 0 15 PHI5 0 0 0.0000 49 53 57 58 0 16 PHI6 0 0 0.0000 53 57 58 77 0 17 CHI11 0 0 0.0000 57 58 59 60 75 18 CHI12 0 0 0.0000 58 59 60 61 72 19 CHI13 0 0 0.0000 59 60 61 62 69 20 CHI14 0 0 0.0000 60 61 62 63 66 21 PHI7 0 0 0.0000 57 58 77 79 0 22 PHI8 0 0 0.0000 58 77 79 81 0 23 PHI9 0 0 0.0000 77 79 81 109 0 24 CHI15 0 0 0.0000 79 81 82 83 107 25 CHI16 0 0 0.0000 81 82 83 84 104 26 CHI17 0 0 0.0000 82 83 84 85 91 27 CHI18 0 0 0.0000 83 84 85 86 88 28 CHI19 0 0 0.0000 82 83 92 93 103 29 CHI20 0 0 0.0000 83 92 93 94 100 30 CHI21 0 0 0.0000 92 93 94 95 97 31 PHI10 0 0 0.0000 79 81 109 113 0 32 CHI22 0 0 0.0000 81 109 110 111 111 33 PHI11 0 0 0.0000 81 109 113 117 0 34 PHI12 0 0 0.0000 109 113 117 132 0 35 CHI23 0 0 0.0000 113 117 118 119 130 36 CHI24 0 0 0.0000 117 118 119 120 123 37 CHI25 0 0 0.0000 117 118 124 125 128 38 PHI13 0 0 0.0000 113 117 132 134 0 39 PHI14 0 0 0.0000 117 132 134 136 0 40 PHI15 0 0 0.0000 132 134 136 140 0 41 PHI16 0 0 0.0000 134 136 140 144 0 42 PHI17 0 0 0.0000 136 140 144 148 0 43 PHI18 0 0 0.0000 140 144 148 151 0 1 N1 N_AMI 0 0.0000 6.4820 -0.8190 -0.0150 2 10 24 0 0 2 C2 C_ALI 0 0.0000 7.8280 -1.3160 0.3100 1 3 7 8 0 3 C3 C_ALI 0 0.0000 8.3440 -2.1360 -0.8770 2 4 5 12 0 4 H31 H_ALI 0 0.0000 9.3810 -2.4200 -0.6990 3 0 0 0 6 5 H32 H_ALI 0 0.0000 7.7360 -3.0340 -0.9900 3 0 0 0 6 6 Q1 PSEUD 0 0.0000 8.5585 -2.7270 -0.8445 0 0 0 0 0 7 H21 H_ALI 0 0.0000 8.4950 -0.4730 0.4900 2 0 0 0 9 8 H22 H_ALI 0 0.0000 7.7810 -1.9450 1.1980 2 0 0 0 9 9 Q2 PSEUD 0 0.0000 8.1380 -1.2090 0.8440 0 0 0 0 0 10 C6 C_ALI 0 0.0000 6.2880 -0.1230 -1.2960 1 11 21 22 0 11 C5 C_ALI 0 0.0000 6.8660 -0.9860 -2.4170 10 12 18 19 0 12 N4 N_AMO 0 0.0000 8.2590 -1.3290 -2.1010 3 11 13 0 0 13 CM C_ALI 0 0.0000 8.9020 -2.0140 -3.2300 12 14 15 16 0 14 HM1 H_ALI 0 0.0000 8.4050 -2.9690 -3.4050 13 0 0 0 17 15 HM2 H_ALI 0 0.0000 8.8240 -1.3950 -4.1230 13 0 0 0 17 16 HM3 H_ALI 0 0.0000 9.9520 -2.1890 -2.9980 13 0 0 0 17 17 Q3 PSEUD 0 0.0000 9.0603 -2.1843 -3.5087 0 0 0 0 0 18 H51 H_ALI 0 0.0000 6.8310 -0.4350 -3.3570 11 0 0 0 20 19 H52 H_ALI 0 0.0000 6.2780 -1.9000 -2.5090 11 0 0 0 20 20 Q4 PSEUD 0 0.0000 6.5545 -1.1675 -2.9330 0 0 0 0 0 21 H61 H_ALI 0 0.0000 5.2230 0.0340 -1.4700 10 0 0 0 23 22 H62 H_ALI 0 0.0000 6.8040 0.8360 -1.2740 10 0 0 0 23 23 Q5 PSEUD 0 0.0000 6.0135 0.4350 -1.3720 0 0 0 0 0 24 C C_BYL 0 0.0000 5.4530 -1.0030 0.8350 1 25 26 0 0 25 O O_BYL 0 0.0000 5.4980 -1.8930 1.6610 24 0 0 0 0 26 N N_AMI 0 0.0000 4.3730 -0.1980 0.7700 24 27 49 0 0 27 C31 C_ALI 0 0.0000 3.1450 -0.5050 1.5180 26 28 30 48 0 28 C4 C_BYL 0 0.0000 1.9570 -0.2500 0.6300 27 29 57 0 0 29 O1 O_BYL 0 0.0000 0.8730 -0.6630 0.9810 28 0 0 0 0 30 C' C_ALI 0 0.0000 3.1580 -1.9740 1.9460 27 31 45 46 0 31 C1' C_ARO 0 0.0000 1.8770 -2.2970 2.6710 30 32 36 0 0 32 C2' C_ARO 0 0.0000 0.8430 -2.9230 2.0000 31 33 35 0 0 33 C3' C_ARO 0 0.0000 -0.3320 -3.2200 2.6640 32 34 38 0 0 34 H3' H_ALI 0 0.0000 -1.1410 -3.7080 2.1400 33 0 0 0 43 35 H2' H_ALI 0 0.0000 0.9530 -3.1790 0.9560 32 0 0 0 42 36 C6' C_ARO 0 0.0000 1.7380 -1.9740 4.0070 31 37 41 0 0 37 C5' C_ARO 0 0.0000 0.5620 -2.2670 4.6710 36 38 40 0 0 38 C4' C_ARO 0 0.0000 -0.4730 -2.8920 4.0000 33 37 39 0 0 39 H4' H_ALI 0 0.0000 -1.3910 -3.1230 4.5190 38 0 0 0 0 40 H5' H_ALI 0 0.0000 0.4510 -2.0100 5.7140 37 0 0 0 43 41 H6' H_ALI 0 0.0000 2.5480 -1.4890 4.5330 36 0 0 0 42 42 Q26 PSEUD 0 0.0000 1.7505 -2.3340 2.7445 0 0 0 0 44 43 Q27 PSEUD 0 0.0000 -0.3450 -2.8590 3.9270 0 0 0 0 44 44 QQB PSEUD 0 0.0000 0.7028 -2.5965 3.3358 0 0 0 0 0 45 H'1 H_ALI 0 0.0000 3.2470 -2.6080 1.0640 30 0 0 0 47 46 H'2 H_ALI 0 0.0000 4.0050 -2.1510 2.6090 30 0 0 0 47 47 Q6 PSEUD 0 0.0000 3.6260 -2.3795 1.8365 0 0 0 0 0 48 H3 H_ALI 0 0.0000 3.0850 0.1340 2.3990 27 0 0 0 0 49 C1 C_ALI 0 0.0000 4.3760 1.0230 -0.0530 26 50 51 53 0 50 H11 H_ALI 0 0.0000 5.3470 1.1410 -0.5330 49 0 0 0 52 51 H12 H_ALI 0 0.0000 4.1680 1.8890 0.5740 49 0 0 0 52 52 Q7 PSEUD 0 0.0000 4.7575 1.5150 0.0205 0 0 0 0 0 53 C21 C_ALI 0 0.0000 3.2870 0.8830 -1.1180 49 54 55 57 0 54 H211 H_ALI 0 0.0000 3.1160 1.8520 -1.5860 53 0 0 0 56 55 H221 H_ALI 0 0.0000 3.6160 0.1720 -1.8770 53 0 0 0 56 56 Q8 PSEUD 0 0.0000 3.3660 1.0120 -1.7315 0 0 0 0 0 57 N2 N_AMI 0 0.0000 2.0430 0.4090 -0.5270 28 53 58 0 0 58 C11 C_ALI 0 0.0000 0.7990 0.6750 -1.2530 57 59 76 77 0 59 C22 C_ALI 0 0.0000 0.1150 -0.6500 -1.5960 58 60 73 74 0 60 C32 C_ALI 0 0.0000 0.9910 -1.4390 -2.5700 59 61 70 71 0 61 C41 C_ALI 0 0.0000 0.3070 -2.7640 -2.9130 60 62 67 68 0 62 C51 C_ALI 0 0.0000 1.1830 -3.5540 -3.8870 61 63 64 65 0 63 H511 H_ALI 0 0.0000 1.3270 -2.9730 -4.7980 62 0 0 0 66 64 H521 H_ALI 0 0.0000 2.1510 -3.7530 -3.4260 62 0 0 0 66 65 H53 H_ALI 0 0.0000 0.6960 -4.4970 -4.1310 62 0 0 0 66 66 Q9 PSEUD 0 0.0000 1.3913 -3.7410 -4.1183 0 0 0 0 0 67 H41 H_ALI 0 0.0000 0.1630 -3.3450 -2.0010 61 0 0 0 69 68 H42 H_ALI 0 0.0000 -0.6600 -2.5650 -3.3740 61 0 0 0 69 69 Q10 PSEUD 0 0.0000 -0.2485 -2.9550 -2.6875 0 0 0 0 0 70 H311 H_ALI 0 0.0000 1.1350 -0.8590 -3.4810 60 0 0 0 72 71 H321 H_ALI 0 0.0000 1.9590 -1.6380 -2.1090 60 0 0 0 72 72 Q11 PSEUD 0 0.0000 1.5470 -1.2485 -2.7950 0 0 0 0 0 73 H212 H_ALI 0 0.0000 -0.0290 -1.2300 -0.6840 59 0 0 0 75 74 H222 H_ALI 0 0.0000 -0.8530 -0.4510 -2.0560 59 0 0 0 75 75 Q12 PSEUD 0 0.0000 -0.4410 -0.8405 -1.3700 0 0 0 0 0 76 H1 H_ALI 0 0.0000 1.0230 1.2170 -2.1720 58 0 0 0 0 77 C7 C_BYL 0 0.0000 -0.1170 1.5060 -0.3920 58 78 79 0 0 78 O2 O_BYL 0 0.0000 0.2340 1.8420 0.7190 77 0 0 0 0 79 N21 N_AMI 0 0.0000 -1.3280 1.8750 -0.8560 77 80 81 0 0 80 HN22 H_AMI 0 0.0000 -1.6090 1.6060 -1.7450 79 0 0 0 0 81 C23 C_ALI 0 0.0000 -2.2180 2.6820 -0.0190 79 82 108 109 0 82 C33 C_ALI 0 0.0000 -1.8680 4.1620 -0.1810 81 83 105 106 0 83 C1'1 C_ALI 0 0.0000 -0.4600 4.4160 0.3640 82 84 92 104 0 84 C2'1 C_ALI 0 0.0000 -0.0610 5.8670 0.0890 83 85 89 90 0 85 C3'1 C_ALI 0 0.0000 1.3460 6.1200 0.6340 84 86 87 94 0 86 H3'1 H_ALI 0 0.0000 2.0520 5.4500 0.1430 85 0 0 0 88 87 H3'2 H_ALI 0 0.0000 1.6310 7.1540 0.4380 85 0 0 0 88 88 Q13 PSEUD 0 0.0000 1.8415 6.3020 0.2905 0 0 0 0 0 89 H2'1 H_ALI 0 0.0000 -0.0730 6.0500 -0.9850 84 0 0 0 91 90 H2'2 H_ALI 0 0.0000 -0.7670 6.5370 0.5800 84 0 0 0 91 91 Q14 PSEUD 0 0.0000 -0.4200 6.2935 -0.2025 0 0 0 0 0 92 C6'1 C_ALI 0 0.0000 -0.4430 4.1590 1.8720 83 93 101 102 0 93 C5'1 C_ALI 0 0.0000 0.9640 4.4120 2.4160 92 94 98 99 0 94 C4'1 C_ALI 0 0.0000 1.3630 5.8630 2.1420 85 93 95 96 0 95 H4'1 H_ALI 0 0.0000 2.3660 6.0430 2.5300 94 0 0 0 97 96 H4'2 H_ALI 0 0.0000 0.6580 6.5330 2.6330 94 0 0 0 97 97 Q15 PSEUD 0 0.0000 1.5120 6.2880 2.5815 0 0 0 0 0 98 H5'1 H_ALI 0 0.0000 1.6700 3.7420 1.9250 93 0 0 0 100 99 H5'2 H_ALI 0 0.0000 0.9760 4.2280 3.4910 93 0 0 0 100 100 Q16 PSEUD 0 0.0000 1.3230 3.9850 2.7080 0 0 0 0 0 101 H6'1 H_ALI 0 0.0000 -1.1490 4.8290 2.3630 92 0 0 0 103 102 H6'2 H_ALI 0 0.0000 -0.7280 3.1250 2.0670 92 0 0 0 103 103 Q17 PSEUD 0 0.0000 -0.9385 3.9770 2.2150 0 0 0 0 0 104 H1' H_ALI 0 0.0000 0.2450 3.7460 -0.1270 83 0 0 0 0 105 H312 H_ALI 0 0.0000 -1.9020 4.4310 -1.2370 82 0 0 0 107 106 H322 H_ALI 0 0.0000 -2.5860 4.7690 0.3720 82 0 0 0 107 107 Q18 PSEUD 0 0.0000 -2.2440 4.6000 -0.4325 0 0 0 0 0 108 H2 H_ALI 0 0.0000 -2.0980 2.3920 1.0250 81 0 0 0 0 109 C12 C_ALI 0 0.0000 -3.6690 2.4520 -0.4470 81 110 112 113 0 110 O11 O_HYD 0 0.0000 -3.8270 2.8320 -1.8160 109 111 0 0 0 111 HO1 H_OXY 0 0.0000 -3.3210 2.2890 -2.4360 110 0 0 0 0 112 H121 H_ALI 0 0.0000 -4.3320 3.0530 0.1750 109 0 0 0 0 113 C13 C_ALI 0 0.0000 -4.0200 0.9710 -0.2850 109 114 115 117 0 114 H122 H_ALI 0 0.0000 -3.4360 0.3800 -0.9910 113 0 0 0 116 115 H13 H_ALI 0 0.0000 -3.7910 0.6530 0.7320 113 0 0 0 116 116 Q19 PSEUD 0 0.0000 -3.6135 0.5165 -0.1295 0 0 0 0 0 117 C24 C_ALI 0 0.0000 -5.5110 0.7670 -0.5610 113 118 131 132 0 118 C1'2 C_ALI 0 0.0000 -5.8030 1.0620 -2.0330 117 119 124 130 0 119 C2'2 C_ALI 0 0.0000 -5.0120 0.0930 -2.9140 118 120 121 122 0 120 H2'3 H_ALI 0 0.0000 -5.3650 -0.9240 -2.7440 119 0 0 0 123 121 H2'4 H_ALI 0 0.0000 -5.1530 0.3570 -3.9620 119 0 0 0 123 122 H2'5 H_ALI 0 0.0000 -3.9530 0.1560 -2.6630 119 0 0 0 123 123 Q20 PSEUD 0 0.0000 -4.8237 -0.1370 -3.1230 0 0 0 0 129 124 C3'2 C_ALI 0 0.0000 -7.2990 0.8900 -2.3010 118 125 126 127 0 125 H3'3 H_ALI 0 0.0000 -7.8680 1.4520 -1.5610 124 0 0 0 128 126 H3'4 H_ALI 0 0.0000 -7.5350 1.2600 -3.2990 124 0 0 0 128 127 H3'5 H_ALI 0 0.0000 -7.5610 -0.1670 -2.2340 124 0 0 0 128 128 Q21 PSEUD 0 0.0000 -7.6547 0.8483 -2.3647 0 0 0 0 129 129 QQA PSEUD 0 0.0000 -6.2392 0.3557 -2.7438 0 0 0 0 0 130 H1'1 H_ALI 0 0.0000 -5.5080 2.0860 -2.2640 118 0 0 0 0 131 H24 H_ALI 0 0.0000 -6.0920 1.4430 0.0670 117 0 0 0 0 132 C8 C_BYL 0 0.0000 -5.8890 -0.6580 -0.2490 117 133 134 0 0 133 O3 O_BYL 0 0.0000 -5.0240 -1.4890 -0.0710 132 0 0 0 0 134 N3 N_AMI 0 0.0000 -7.1880 -1.0080 -0.1690 132 135 136 0 0 135 HN21 H_AMI 0 0.0000 -7.8790 -0.3590 -0.3740 134 0 0 0 0 136 C14 C_ALI 0 0.0000 -7.5560 -2.3700 0.2280 134 137 138 140 0 137 H111 H_ALI 0 0.0000 -7.1340 -3.0820 -0.4810 136 0 0 0 139 138 H123 H_ALI 0 0.0000 -7.1650 -2.5750 1.2250 136 0 0 0 139 139 Q22 PSEUD 0 0.0000 -7.1495 -2.8285 0.3720 0 0 0 0 0 140 C25 C_ALI 0 0.0000 -9.0800 -2.5030 0.2400 136 141 142 144 0 141 H213 H_ALI 0 0.0000 -9.5010 -1.7910 0.9500 140 0 0 0 143 142 H223 H_ALI 0 0.0000 -9.4700 -2.2970 -0.7560 140 0 0 0 143 143 Q23 PSEUD 0 0.0000 -9.4855 -2.0440 0.0970 0 0 0 0 0 144 C34 C_ALI 0 0.0000 -9.4640 -3.9240 0.6550 140 145 146 148 0 145 H313 H_ALI 0 0.0000 -9.0430 -4.6360 -0.0550 144 0 0 0 147 146 H323 H_ALI 0 0.0000 -9.0740 -4.1300 1.6510 144 0 0 0 147 147 Q24 PSEUD 0 0.0000 -9.0585 -4.3830 0.7980 0 0 0 0 0 148 C42 C_ALI 0 0.0000 -10.9880 -4.0580 0.6670 144 149 150 151 0 149 H411 H_ALI 0 0.0000 -11.2620 -5.0700 0.9620 148 0 0 0 152 150 H421 H_ALI 0 0.0000 -11.4100 -3.3460 1.3760 148 0 0 0 152 151 H43 H_ALI 0 0.0000 -11.3790 -3.8520 -0.3300 148 0 0 0 152 152 Q25 PSEUD 0 0.0000 -11.3503 -4.0893 0.6693 0 0 0 0 0