REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = N-{1-BENZYL-(2R,3S)-2,3-DIHYDROXY-4-[3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRYLAMINO]-5-PHENYL-PENTYL}-3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHYL-UREIDO)-BUTYRAMIDE RESIDUE A77 33 134 1 134 1 CHI1 0 0 0.0000 2 1 3 4 22 2 CHI2 0 0 0.0000 1 3 4 5 8 3 CHI3 0 0 0.0000 1 3 9 10 22 4 CHI4 0 0 0.0000 3 9 10 11 19 5 PHI1 0 0 0.0000 2 1 23 25 0 6 PHI2 0 0 0.0000 1 23 25 40 0 7 CHI5 0 0 0.0000 23 25 26 27 38 8 CHI6 0 0 0.0000 25 26 27 28 31 9 CHI7 0 0 0.0000 25 26 32 33 36 10 PHI3 0 0 0.0000 23 25 40 42 0 11 PHI4 0 0 0.0000 25 40 42 44 0 12 PHI5 0 0 0.0000 40 42 44 64 0 13 CHI8 0 0 0.0000 42 44 45 46 62 14 CHI9 0 0 0.0000 44 45 46 47 57 15 PHI6 0 0 0.0000 42 44 64 68 0 16 CHI10 0 0 0.0000 44 64 65 66 66 17 PHI7 0 0 0.0000 44 64 68 72 0 18 CHI11 0 0 0.0000 64 68 69 70 70 19 PHI8 0 0 0.0000 64 68 72 92 0 20 CHI12 0 0 0.0000 68 72 73 74 90 21 CHI13 0 0 0.0000 72 73 74 75 85 22 PHI9 0 0 0.0000 68 72 92 94 0 23 PHI10 0 0 0.0000 72 92 94 96 0 24 PHI11 0 0 0.0000 92 94 96 111 0 25 CHI14 0 0 0.0000 94 96 97 98 109 26 CHI15 0 0 0.0000 96 97 98 99 102 27 CHI16 0 0 0.0000 96 97 103 104 107 28 PHI12 0 0 0.0000 94 96 111 113 0 29 PHI13 0 0 0.0000 96 111 113 115 0 30 PHI14 0 0 0.0000 111 113 115 121 0 31 CHI17 0 0 0.0000 113 115 116 117 120 32 PHI15 0 0 0.0000 113 115 121 125 0 33 PHI16 0 0 0.0000 115 121 125 129 0 1 C1 C_BYL 0 0.0000 -0.9850 1.5380 -6.6330 2 3 23 0 0 2 O2 O_BYL 0 0.0000 -1.3510 2.6540 -6.3200 1 0 0 0 0 3 N3 N_AMO 0 0.0000 -0.9690 1.1730 -7.9300 1 4 9 0 0 4 C4 C_ALI 0 0.0000 -1.4090 2.1150 -8.9620 3 5 6 7 0 5 H12 H_ALI 0 0.0000 -1.6240 3.0810 -8.5040 4 0 0 0 8 6 H13 H_ALI 0 0.0000 -0.6220 2.2330 -9.7060 4 0 0 0 8 7 H14 H_ALI 0 0.0000 -2.3090 1.7330 -9.4430 4 0 0 0 8 8 Q1 PSEUD 0 0.0000 -1.5183 2.3490 -9.2177 0 0 0 0 0 9 C5 C_ALI 0 0.0000 -0.5120 -0.1660 -8.3090 3 10 20 21 0 10 C6 C_ARO 0 0.0000 -1.6840 -1.1130 -8.3170 9 11 15 0 0 11 C7 C_ARO 0 0.0000 -1.4870 -2.4400 -8.6480 10 12 14 0 0 12 C9 C_ARO 0 0.0000 -2.5710 -3.3040 -8.6520 11 13 17 0 0 13 H18 H_ALI 0 0.0000 -2.4480 -4.3460 -8.9070 12 0 0 0 0 14 H17 H_ALI 0 0.0000 -0.5000 -2.8010 -8.9000 11 0 0 0 0 15 N8 N_AMO 0 0.0000 -2.8840 -0.6670 -8.0040 10 16 0 0 0 16 C10 C_ARO 0 0.0000 -3.9390 -1.4580 -8.0020 15 17 19 0 0 17 C11 C_ARO 0 0.0000 -3.8190 -2.7970 -8.3220 12 16 18 0 0 18 H20 H_ALI 0 0.0000 -4.6870 -3.4410 -8.3160 17 0 0 0 0 19 H19 H_ALI 0 0.0000 -4.9080 -1.0560 -7.7440 16 0 0 0 0 20 H15 H_ALI 0 0.0000 -0.0660 -0.1300 -9.3030 9 0 0 0 22 21 H16 H_ALI 0 0.0000 0.2300 -0.5130 -7.5900 9 0 0 0 22 22 Q2 PSEUD 0 0.0000 0.0820 -0.3215 -8.4465 0 0 0 0 0 23 N21 N_AMI 0 0.0000 -0.5940 0.6660 -5.6830 1 24 25 0 0 24 H28 H_AMI 0 0.0000 -0.2290 -0.1950 -5.9360 23 0 0 0 0 25 C22 C_ALI 0 0.0000 -0.7200 1.0200 -4.2670 23 26 39 40 0 26 C25 C_ALI 0 0.0000 -2.0900 0.5750 -3.7500 25 27 32 38 0 27 C26 C_ALI 0 0.0000 -3.1880 1.3460 -4.4870 26 28 29 30 0 28 H31 H_ALI 0 0.0000 -4.1640 1.0290 -4.1190 27 0 0 0 31 29 H32 H_ALI 0 0.0000 -3.0630 2.4140 -4.3100 27 0 0 0 31 30 H33 H_ALI 0 0.0000 -3.1190 1.1430 -5.5560 27 0 0 0 31 31 Q3 PSEUD 0 0.0000 -3.4487 1.5287 -4.6617 0 0 0 0 37 32 C27 C_ALI 0 0.0000 -2.2660 -0.9240 -3.9970 26 33 34 35 0 33 H34 H_ALI 0 0.0000 -2.2570 -1.1190 -5.0700 32 0 0 0 36 34 H35 H_ALI 0 0.0000 -1.4500 -1.4680 -3.5220 32 0 0 0 36 35 H36 H_ALI 0 0.0000 -3.2160 -1.2520 -3.5770 32 0 0 0 36 36 Q4 PSEUD 0 0.0000 -2.3077 -1.2797 -4.0563 0 0 0 0 37 37 QQA PSEUD 0 0.0000 -2.8782 0.1245 -4.3590 0 0 0 0 0 38 H30 H_ALI 0 0.0000 -2.1590 0.7770 -2.6810 26 0 0 0 0 39 H29 H_ALI 0 0.0000 -0.6220 2.0990 -4.1520 25 0 0 0 0 40 C23 C_BYL 0 0.0000 0.3610 0.3300 -3.4770 25 41 42 0 0 41 O24 O_BYL 0 0.0000 0.8900 -0.6680 -3.9180 40 0 0 0 0 42 N37 N_AMI 0 0.0000 0.7420 0.8230 -2.2820 40 43 44 0 0 43 H59 H_AMI 0 0.0000 0.2720 1.5790 -1.8970 42 0 0 0 0 44 C38 C_ALI 0 0.0000 1.8660 0.2160 -1.5640 42 45 63 64 0 45 C39 C_ALI 0 0.0000 3.1670 0.9080 -1.9760 44 46 60 61 0 46 C40 C_ARO 0 0.0000 3.3740 0.7460 -3.4600 45 47 51 0 0 47 C41 C_ARO 0 0.0000 2.8670 1.6890 -4.3350 46 48 50 0 0 48 C42 C_ARO 0 0.0000 3.0560 1.5410 -5.6960 47 49 53 0 0 49 H64 H_ALI 0 0.0000 2.6590 2.2770 -6.3800 48 0 0 0 58 50 H63 H_ALI 0 0.0000 2.3220 2.5410 -3.9550 47 0 0 0 57 51 C45 C_ARO 0 0.0000 4.0750 -0.3410 -3.9470 46 52 56 0 0 52 C44 C_ARO 0 0.0000 4.2600 -0.4910 -5.3080 51 53 55 0 0 53 C43 C_ARO 0 0.0000 3.7520 0.4510 -6.1830 48 52 54 0 0 54 H65 H_ALI 0 0.0000 3.9000 0.3350 -7.2470 53 0 0 0 0 55 H66 H_ALI 0 0.0000 4.8040 -1.3430 -5.6880 52 0 0 0 58 56 H67 H_ALI 0 0.0000 4.4710 -1.0770 -3.2630 51 0 0 0 57 57 Q11 PSEUD 0 0.0000 3.3965 0.7320 -3.6090 0 0 0 0 59 58 Q12 PSEUD 0 0.0000 3.7315 0.4670 -6.0340 0 0 0 0 59 59 QQC PSEUD 0 0.0000 3.5640 0.5995 -4.8215 0 0 0 0 0 60 H61 H_ALI 0 0.0000 3.1090 1.9680 -1.7310 45 0 0 0 62 61 H62 H_ALI 0 0.0000 4.0030 0.4560 -1.4420 45 0 0 0 62 62 Q5 PSEUD 0 0.0000 3.5560 1.2120 -1.5865 0 0 0 0 0 63 H60 H_ALI 0 0.0000 1.9240 -0.8430 -1.8100 44 0 0 0 0 64 C46 C_ALI 0 0.0000 1.6560 0.3800 -0.0580 44 65 67 68 0 65 O47 O_HYD 0 0.0000 1.5800 1.7700 0.2640 64 66 0 0 0 66 H69 H_OXY 0 0.0000 2.4180 2.1670 -0.0110 65 0 0 0 0 67 H68 H_ALI 0 0.0000 0.7290 -0.1110 0.2350 64 0 0 0 0 68 C49 C_ALI 0 0.0000 2.8300 -0.2520 0.6910 64 69 71 72 0 69 O48 O_HYD 0 0.0000 2.9060 -1.6430 0.3690 68 70 0 0 0 70 H70 H_OXY 0 0.0000 2.0690 -2.0400 0.6450 69 0 0 0 0 71 H71 H_ALI 0 0.0000 3.7570 0.2390 0.3980 68 0 0 0 0 72 C51 C_ALI 0 0.0000 2.6210 -0.0890 2.1980 68 73 91 92 0 73 C52 C_ALI 0 0.0000 3.7940 -0.7220 2.9480 72 74 88 89 0 74 C53 C_ARO 0 0.0000 3.5880 -0.5610 4.4320 73 75 79 0 0 75 C54 C_ARO 0 0.0000 2.9090 -1.5310 5.1450 74 76 78 0 0 76 C55 C_ARO 0 0.0000 2.7200 -1.3830 6.5060 75 77 81 0 0 77 H77 H_ALI 0 0.0000 2.1890 -2.1410 7.0630 76 0 0 0 86 78 H76 H_ALI 0 0.0000 2.5260 -2.4050 4.6380 75 0 0 0 85 79 C58 C_ARO 0 0.0000 4.0820 0.5540 5.0820 74 80 84 0 0 80 C57 C_ARO 0 0.0000 3.8890 0.7040 6.4420 79 81 83 0 0 81 C56 C_ARO 0 0.0000 3.2100 -0.2650 7.1550 76 80 82 0 0 82 H78 H_ALI 0 0.0000 3.0610 -0.1490 8.2180 81 0 0 0 0 83 H79 H_ALI 0 0.0000 4.2720 1.5780 6.9490 80 0 0 0 86 84 H80 H_ALI 0 0.0000 4.6140 1.3120 4.5250 79 0 0 0 85 85 Q13 PSEUD 0 0.0000 3.5700 -0.5465 4.5815 0 0 0 0 87 86 Q14 PSEUD 0 0.0000 3.2305 -0.2815 7.0060 0 0 0 0 87 87 QQD PSEUD 0 0.0000 3.4002 -0.4140 5.7937 0 0 0 0 0 88 H74 H_ALI 0 0.0000 3.8520 -1.7830 2.7020 73 0 0 0 90 89 H75 H_ALI 0 0.0000 4.7210 -0.2300 2.6540 73 0 0 0 90 90 Q6 PSEUD 0 0.0000 4.2865 -1.0065 2.6780 0 0 0 0 0 91 H73 H_ALI 0 0.0000 2.5620 0.9710 2.4440 72 0 0 0 0 92 N50 N_AMI 0 0.0000 1.3750 -0.7510 2.5930 72 93 94 0 0 93 H72 H_AMI 0 0.0000 1.0600 -1.5250 2.1010 92 0 0 0 0 94 C83 C_BYL 0 0.0000 0.6650 -0.2830 3.6390 92 95 96 0 0 95 O84 O_BYL 0 0.0000 1.0080 0.7370 4.1970 94 0 0 0 0 96 C82 C_ALI 0 0.0000 -0.5530 -1.0290 4.1170 94 97 110 111 0 97 C85 C_ALI 0 0.0000 -1.7720 -0.5860 3.3060 96 98 103 109 0 98 C86 C_ALI 0 0.0000 -1.9360 0.9300 3.4190 97 99 100 101 0 99 H91 H_ALI 0 0.0000 -2.8040 1.2460 2.8410 98 0 0 0 102 100 H92 H_ALI 0 0.0000 -2.0760 1.2030 4.4650 98 0 0 0 102 101 H93 H_ALI 0 0.0000 -1.0430 1.4220 3.0310 98 0 0 0 102 102 Q7 PSEUD 0 0.0000 -1.9743 1.2903 3.4457 0 0 0 0 0 103 C87 C_ALI 0 0.0000 -1.5750 -0.9690 1.8380 97 104 105 106 108 104 H94 H_ALI 0 0.0000 -0.7390 -0.4050 1.4240 103 0 0 0 107 105 H95 H_ALI 0 0.0000 -1.3640 -2.0360 1.7660 103 0 0 0 107 106 H96 H_ALI 0 0.0000 -2.4810 -0.7400 1.2770 103 0 0 0 107 107 Q8 PSEUD 0 0.0000 -1.5280 -1.0603 1.4890 0 0 0 0 0 108 QQB PSEUD 0 0.0000 0.5192 0.8222 0.9190 0 0 0 0 108 109 H90 H_ALI 0 0.0000 -2.6650 -1.0780 3.6930 97 0 0 0 0 110 H89 H_ALI 0 0.0000 -0.3980 -2.1000 3.9840 96 0 0 0 0 111 N81 N_AMI 0 0.0000 -0.7780 -0.7400 5.5350 96 112 113 0 0 112 H88 H_AMI 0 0.0000 -0.5100 0.1150 5.9040 111 0 0 0 0 113 C97 C_BYL 0 0.0000 -1.3590 -1.6630 6.3270 111 114 115 0 0 114 O98 O_BYL 0 0.0000 -1.6310 -2.7610 5.8820 113 0 0 0 0 115 N99 N_AMI 0 0.0000 -1.6380 -1.3680 7.6120 113 116 121 0 0 116 C2 C_ALI 0 0.0000 -2.2910 -2.3630 8.4670 115 117 118 119 0 117 H1 H_ALI 0 0.0000 -2.3900 -3.3010 7.9210 116 0 0 0 120 118 H10 H_ALI 0 0.0000 -1.6890 -2.5250 9.3610 116 0 0 0 120 119 H11 H_ALI 0 0.0000 -3.2790 -2.0030 8.7540 116 0 0 0 120 120 Q9 PSEUD 0 0.0000 -2.4527 -2.6097 8.6787 0 0 0 0 0 121 C3 C_ALI 0 0.0000 -1.2890 -0.0530 8.1550 115 122 123 125 0 122 H2 H_ALI 0 0.0000 -1.0780 -0.1430 9.2200 121 0 0 0 124 123 H3 H_ALI 0 0.0000 -0.4070 0.3290 7.6410 121 0 0 0 124 124 Q10 PSEUD 0 0.0000 -0.7425 0.0930 8.4305 0 0 0 0 0 125 C8 C_ARO 0 0.0000 -2.4410 0.8960 7.9500 121 126 129 0 0 126 N10 N_AMO 0 0.0000 -3.5370 0.4720 7.3510 125 127 0 0 0 127 C14 C_ARO 0 0.0000 -4.5720 1.2660 7.1550 126 128 133 0 0 128 H6 H_ALI 0 0.0000 -5.4540 0.8810 6.6650 127 0 0 0 0 129 C12 C_ARO 0 0.0000 -2.3350 2.2030 8.3870 125 130 131 0 0 130 H4 H_ALI 0 0.0000 -1.4340 2.5460 8.8730 129 0 0 0 0 131 C13 C_ARO 0 0.0000 -3.4000 3.0690 8.1930 129 132 133 0 0 132 H5 H_ALI 0 0.0000 -3.3460 4.0950 8.5240 131 0 0 0 0 133 C15 C_ARO 0 0.0000 -4.5380 2.5850 7.5650 127 131 134 0 0 134 H7 H_ALI 0 0.0000 -5.3870 3.2310 7.3980 133 0 0 0 0