REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = N-[2-HYDROXY-1-INDANYL]-5-[(2-TERTIARYBUTYLAMINOCARBONYL)-4(BENZO[1,3]DIOXOL-5-YLMETHYL)-PIPERAZINO]-4-HYDROXY-2-(1-PHENYLETHYL)-PENTANAMIDE
RESIDUE XN2 25 115 1 115
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 28
4 CHI4 0 0 0.0000 1 10 11 12 25
5 PHI1 0 0 0.0000 2 1 29 33 0
6 PHI2 0 0 0.0000 1 29 33 56 0
7 CHI5 0 0 0.0000 29 33 34 35 54
8 CHI6 0 0 0.0000 33 34 36 37 54
9 CHI7 0 0 0.0000 34 36 37 38 52
10 CHI8 0 0 0.0000 36 37 38 39 42
11 CHI9 0 0 0.0000 36 37 43 44 47
12 CHI10 0 0 0.0000 36 37 48 49 52
13 PHI3 0 0 0.0000 29 33 56 57 0
14 PHI4 0 0 0.0000 33 56 57 61 0
15 PHI5 0 0 0.0000 56 57 61 65 0
16 CHI11 0 0 0.0000 57 61 62 63 63
17 PHI6 0 0 0.0000 57 61 65 69 0
18 PHI7 0 0 0.0000 61 65 69 95 0
19 CHI12 0 0 0.0000 65 69 70 71 93
20 CHI13 0 0 0.0000 69 70 72 73 93
21 CHI14 0 0 0.0000 70 72 73 74 92
22 CHI15 0 0 0.0000 73 74 75 76 76
23 PHI8 0 0 0.0000 65 69 95 111 0
24 CHI16 0 0 0.0000 69 95 96 97 107
25 PHI9 0 0 0.0000 69 95 111 114 0
1 N1 N_AMI 0 0.0000 -0.4810 2.5170 -4.3090 2 10 29 0 0
2 C9 C_ALI 0 0.0000 0.2370 2.5850 -3.0310 1 3 7 8 0
3 C8 C_ALI 0 0.0000 -0.7180 2.2520 -1.8850 2 4 5 56 0
4 H81 H_ALI 0 0.0000 -1.5660 2.9370 -1.9090 3 0 0 0 6
5 H82 H_ALI 0 0.0000 -0.1950 2.3550 -0.9350 3 0 0 0 6
6 Q1 PSEUD 0 0.0000 -0.8805 2.6460 -1.4220 0 0 0 0 0
7 H91 H_ALI 0 0.0000 0.6340 3.5910 -2.8910 2 0 0 0 9
8 H92 H_ALI 0 0.0000 1.0580 1.8690 -3.0390 2 0 0 0 9
9 Q2 PSEUD 0 0.0000 0.8460 2.7300 -2.9650 0 0 0 0 0
10 C31 C_ALI 0 0.0000 0.5160 2.7290 -5.3670 1 11 26 27 0
11 C32 C_ARO 0 0.0000 1.4820 1.5720 -5.3840 10 12 16 0 0
12 C33 C_ARO 0 0.0000 1.2200 0.4670 -6.1720 11 13 15 0 0
13 C37 C_ARO 0 0.0000 2.1030 -0.5960 -6.1920 12 14 18 0 0
14 H37 H_ALI 0 0.0000 1.8960 -1.4580 -6.8080 13 0 0 0 0
15 H33 H_ALI 0 0.0000 0.3230 0.4330 -6.7730 12 0 0 0 0
16 C36 C_ARO 0 0.0000 2.6300 1.6220 -4.6170 11 17 25 0 0
17 C35 C_ARO 0 0.0000 3.5180 0.5570 -4.6280 16 18 20 0 0
18 C34 C_ARO 0 0.0000 3.2540 -0.5550 -5.4210 13 17 19 0 0
19 O5 O_EST 0 0.0000 4.2690 -1.4540 -5.2630 18 21 0 0 0
20 O6 O_EST 0 0.0000 4.6980 0.3570 -3.9730 17 21 0 0 0
21 C38 C_ALI 0 0.0000 4.9490 -1.0580 -4.0580 19 20 22 23 0
22 H381 H_ALI 0 0.0000 4.5290 -1.5740 -3.1940 21 0 0 0 24
23 H382 H_ALI 0 0.0000 6.0180 -1.2530 -4.1390 21 0 0 0 24
24 Q3 PSEUD 0 0.0000 5.2735 -1.4135 -3.6665 0 0 0 0 0
25 H36 H_ALI 0 0.0000 2.8350 2.4890 -4.0070 16 0 0 0 0
26 H311 H_ALI 0 0.0000 0.0130 2.7970 -6.3320 10 0 0 0 28
27 H312 H_ALI 0 0.0000 1.0590 3.6530 -5.1730 10 0 0 0 28
28 Q4 PSEUD 0 0.0000 0.5360 3.2250 -5.7525 0 0 0 0 0
29 C1 C_ALI 0 0.0000 -0.9640 1.1390 -4.4540 1 30 31 33 0
30 H11A H_ALI 0 0.0000 -1.4870 1.0350 -5.4050 29 0 0 0 32
31 H12 H_ALI 0 0.0000 -0.1170 0.4530 -4.4310 29 0 0 0 32
32 Q5 PSEUD 0 0.0000 -0.8020 0.7440 -4.9180 0 0 0 0 0
33 C2 C_ALI 0 0.0000 -1.9200 0.8050 -3.3080 29 34 55 56 0
34 C3 C_BYL 0 0.0000 -2.4690 -0.5840 -3.5010 33 35 36 0 0
35 O1 O_BYL 0 0.0000 -2.2760 -1.4340 -2.6580 34 0 0 0 0
36 N2 N_AMO 0 0.0000 -3.1730 -0.8830 -4.6110 34 37 54 0 0
37 C4 C_ALI 0 0.0000 -3.7070 -2.2340 -4.7980 36 38 43 48 0
38 C5 C_ALI 0 0.0000 -4.4600 -2.3050 -6.1280 37 39 40 41 0
39 H51 H_ALI 0 0.0000 -4.8570 -3.3110 -6.2670 38 0 0 0 42
40 H52 H_ALI 0 0.0000 -5.2810 -1.5880 -6.1190 38 0 0 0 42
41 H53 H_ALI 0 0.0000 -3.7780 -2.0670 -6.9450 38 0 0 0 42
42 Q6 PSEUD 0 0.0000 -4.6387 -2.3220 -6.4437 0 0 0 0 53
43 C6 C_ALI 0 0.0000 -2.5540 -3.2400 -4.8100 37 44 45 46 0
44 H61 H_ALI 0 0.0000 -1.8730 -3.0020 -5.6270 43 0 0 0 47
45 H62 H_ALI 0 0.0000 -2.0180 -3.1900 -3.8630 43 0 0 0 47
46 H63 H_ALI 0 0.0000 -2.9510 -4.2460 -4.9500 43 0 0 0 47
47 Q7 PSEUD 0 0.0000 -2.2807 -3.4793 -4.8133 0 0 0 0 53
48 C7 C_ALI 0 0.0000 -4.6630 -2.5680 -3.6520 37 49 50 51 0
49 H71 H_ALI 0 0.0000 -5.4840 -1.8510 -3.6430 48 0 0 0 52
50 H72 H_ALI 0 0.0000 -5.0600 -3.5740 -3.7910 48 0 0 0 52
51 H73 H_ALI 0 0.0000 -4.1270 -2.5180 -2.7040 48 0 0 0 52
52 Q8 PSEUD 0 0.0000 -4.8903 -2.6477 -3.3793 0 0 0 0 53
53 QQA PSEUD 0 0.0000 -3.9366 -2.8163 -4.8788 0 0 0 0 0
54 HN2 H_AMI 0 0.0000 -3.3270 -0.2030 -5.2850 36 0 0 0 0
55 H2 H_ALI 0 0.0000 -2.7410 1.5220 -3.3010 33 0 0 0 0
56 N3 N_AMI 0 0.0000 -1.2010 0.8730 -2.0300 3 33 57 0 0
57 C10 C_ALI 0 0.0000 -2.1990 0.6620 -0.9730 56 58 59 61 0
58 H101 H_ALI 0 0.0000 -2.5770 -0.3580 -1.0290 57 0 0 0 60
59 H102 H_ALI 0 0.0000 -3.0230 1.3620 -1.1060 57 0 0 0 60
60 Q9 PSEUD 0 0.0000 -2.8000 0.5020 -1.0675 0 0 0 0 0
61 C11 C_ALI 0 0.0000 -1.5500 0.8910 0.3930 57 62 64 65 0
62 O2 O_HYD 0 0.0000 -1.2590 2.2810 0.5550 61 63 0 0 0
63 HO2 H_OXY 0 0.0000 -2.1080 2.7440 0.5720 62 0 0 0 0
64 H11 H_ALI 0 0.0000 -0.6260 0.3160 0.4570 61 0 0 0 0
65 C12 C_ALI 0 0.0000 -2.5100 0.4390 1.4950 61 66 67 69 0
66 H121 H_ALI 0 0.0000 -2.7980 -0.5970 1.3240 65 0 0 0 68
67 H122 H_ALI 0 0.0000 -3.3990 1.0700 1.4840 65 0 0 0 68
68 Q10 PSEUD 0 0.0000 -3.0985 0.2365 1.4040 0 0 0 0 0
69 C13 C_ALI 0 0.0000 -1.8180 0.5580 2.8550 65 70 94 95 0
70 C21 C_BYL 0 0.0000 -0.6990 -0.4480 2.9390 69 71 72 0 0
71 O3 O_BYL 0 0.0000 -0.4780 -1.1880 2.0030 70 0 0 0 0
72 N4 N_AMO 0 0.0000 0.0540 -0.5260 4.0530 70 73 93 0 0
73 C22 C_ALI 0 0.0000 1.1410 -1.5050 4.1350 72 74 82 92 0
74 C23 C_ALI 0 0.0000 1.3750 -1.9240 5.6020 73 75 77 81 0
75 O4 O_HYD 0 0.0000 0.9740 -0.8850 6.4970 74 76 0 0 0
76 HO4 H_OXY 0 0.0000 1.1450 -1.2070 7.3930 75 0 0 0 0
77 C24 C_ALI 0 0.0000 2.9030 -2.1340 5.6460 74 78 79 83 0
78 H241 H_ALI 0 0.0000 3.2980 -1.8360 6.6170 77 0 0 0 80
79 H242 H_ALI 0 0.0000 3.1480 -3.1770 5.4420 77 0 0 0 80
80 Q11 PSEUD 0 0.0000 3.2230 -2.5065 6.0295 0 0 0 0 0
81 H23 H_ALI 0 0.0000 0.8490 -2.8520 5.8280 74 0 0 0 0
82 C30 C_ARO 0 0.0000 2.4450 -0.8810 3.6860 73 83 86 0 0
83 C25 C_ARO 0 0.0000 3.4580 -1.2410 4.5570 77 82 84 0 0
84 C26 C_ARO 0 0.0000 4.7470 -0.7820 4.3420 83 85 88 0 0
85 H26 H_ALI 0 0.0000 5.5380 -1.0640 5.0200 84 0 0 0 0
86 C29 C_ARO 0 0.0000 2.7240 -0.0600 2.6080 82 87 91 0 0
87 C28 C_ARO 0 0.0000 4.0100 0.3960 2.3950 86 88 90 0 0
88 C27 C_ARO 0 0.0000 5.0230 0.0350 3.2640 84 87 89 0 0
89 H27 H_ALI 0 0.0000 6.0290 0.3910 3.1000 88 0 0 0 0
90 H28 H_ALI 0 0.0000 4.2240 1.0360 1.5520 87 0 0 0 0
91 H29 H_ALI 0 0.0000 1.9330 0.2220 1.9290 86 0 0 0 0
92 H22 H_ALI 0 0.0000 0.9100 -2.3780 3.5240 73 0 0 0 0
93 HN4 H_AMI 0 0.0000 -0.1230 0.0650 4.8010 72 0 0 0 0
94 H13 H_ALI 0 0.0000 -1.4110 1.5630 2.9690 69 0 0 0 0
95 C14 C_ALI 0 0.0000 -2.8310 0.2890 3.9680 69 96 110 111 0
96 C15 C_ARO 0 0.0000 -2.1960 0.5710 5.3050 95 97 101 0 0
97 C16 C_ARO 0 0.0000 -2.0920 -0.4340 6.2480 96 98 100 0 0
98 C17 C_ARO 0 0.0000 -1.5090 -0.1740 7.4740 97 99 103 0 0
99 H17 H_ALI 0 0.0000 -1.4290 -0.9600 8.2110 98 0 0 0 108
100 H16 H_ALI 0 0.0000 -2.4670 -1.4220 6.0260 97 0 0 0 107
101 C20 C_ARO 0 0.0000 -1.7110 1.8350 5.5870 96 102 106 0 0
102 C19 C_ARO 0 0.0000 -1.1320 2.0950 6.8150 101 103 105 0 0
103 C18 C_ARO 0 0.0000 -1.0290 1.0900 7.7580 98 102 104 0 0
104 H18 H_ALI 0 0.0000 -0.5740 1.2930 8.7160 103 0 0 0 0
105 H19 H_ALI 0 0.0000 -0.7570 3.0840 7.0360 102 0 0 0 108
106 H20 H_ALI 0 0.0000 -1.7910 2.6210 4.8500 101 0 0 0 107
107 Q13 PSEUD 0 0.0000 -2.1290 0.5995 5.4380 0 0 0 0 109
108 Q14 PSEUD 0 0.0000 -1.0930 1.0620 7.6235 0 0 0 0 109
109 QQB PSEUD 0 0.0000 -1.6110 0.8307 6.5307 0 0 0 0 0
110 H141 H_ALI 0 0.0000 -3.1460 -0.7530 3.9290 95 0 0 0 0
111 C39 C_ALI 0 0.0000 -4.0490 1.1960 3.7800 95 112 113 114 0
112 H391 H_ALI 0 0.0000 -3.7440 2.2380 3.8790 111 0 0 0 115
113 H392 H_ALI 0 0.0000 -4.4730 1.0340 2.7900 111 0 0 0 115
114 H393 H_ALI 0 0.0000 -4.7960 0.9630 4.5390 111 0 0 0 115
115 Q12 PSEUD 0 0.0000 -4.3377 1.4117 3.7360 0 0 0 0 0