REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = "2ALPHA-PROPYL-1ALPHA,25-DIHYDROXYVITAMIN D3" RESIDUE C33 29 101 1 101 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 3 4 5 5 4 CHI4 0 0 0.0000 1 10 11 12 76 5 CHI5 0 0 0.0000 11 12 13 14 67 6 CHI6 0 0 0.0000 12 13 14 15 23 7 CHI7 0 0 0.0000 13 14 15 16 18 8 CHI8 0 0 0.0000 13 14 19 20 23 9 CHI9 0 0 0.0000 12 13 24 25 66 10 CHI10 0 0 0.0000 13 24 25 26 63 11 CHI11 0 0 0.0000 24 25 26 27 60 12 CHI12 0 0 0.0000 25 26 27 28 59 13 CHI13 0 0 0.0000 26 27 28 29 53 14 CHI14 0 0 0.0000 27 28 29 30 50 15 CHI15 0 0 0.0000 28 29 30 31 47 16 CHI16 0 0 0.0000 29 30 31 32 43 17 CHI17 0 0 0.0000 30 31 32 33 33 18 CHI18 0 0 0.0000 30 31 34 35 38 19 CHI19 0 0 0.0000 30 31 39 40 43 20 CHI20 0 0 0.0000 26 27 54 55 58 21 CHI21 0 0 0.0000 11 12 68 69 75 22 CHI22 0 0 0.0000 12 68 69 70 72 23 PHI1 0 0 0.0000 2 1 78 83 0 24 PHI2 0 0 0.0000 1 78 83 87 0 25 CHI23 0 0 0.0000 78 83 84 85 85 26 PHI3 0 0 0.0000 78 83 87 89 0 27 PHI4 0 0 0.0000 83 87 89 93 0 28 PHI5 0 0 0.0000 87 89 93 97 0 29 PHI6 0 0 0.0000 89 93 97 100 0 1 C5 C_BYL 0 0.0000 3.6890 0.3300 -0.5000 2 10 78 0 0 2 C4 C_ALI 0 0.0000 3.5800 -1.1000 -0.0100 1 3 7 8 0 3 C3 C_ALI 0 0.0000 4.9050 -1.4830 0.6580 2 4 6 87 0 4 O3 O_HYD 0 0.0000 4.8440 -2.8460 1.0830 3 5 0 0 0 5 HO3 H_OXY 0 0.0000 4.1080 -2.9130 1.7060 4 0 0 0 0 6 H3 H_ALI 0 0.0000 5.0730 -0.8420 1.5230 3 0 0 0 0 7 H41 H_ALI 0 0.0000 3.3890 -1.7630 -0.8530 2 0 0 0 9 8 H42 H_ALI 0 0.0000 2.7680 -1.1800 0.7130 2 0 0 0 9 9 Q1 PSEUD 0 0.0000 3.0785 -1.4715 -0.0700 0 0 0 0 0 10 C6 C_BYL 0 0.0000 2.7110 1.2320 -0.2730 1 11 77 0 0 11 C7 C_BYL 0 0.0000 1.5080 0.8380 0.4630 10 12 76 0 0 12 C8 C_BYL 0 0.0000 0.5420 1.7280 0.6870 11 13 68 0 0 13 C14 C_ALI 0 0.0000 -0.7140 1.3810 1.4290 12 14 24 67 0 14 C13 C_ALI 0 0.0000 -1.8790 1.6960 0.4560 13 15 19 26 0 15 C12 C_ALI 0 0.0000 -1.9050 3.1910 0.2390 14 16 17 69 0 16 H121 H_ALI 0 0.0000 -1.9110 3.7050 1.2010 15 0 0 0 18 17 H122 H_ALI 0 0.0000 -2.7900 3.4670 -0.3330 15 0 0 0 18 18 Q2 PSEUD 0 0.0000 -2.3505 3.5860 0.4340 0 0 0 0 0 19 C18 C_ALI 0 0.0000 -1.6180 0.9960 -0.8790 14 20 21 22 0 20 H181 H_ALI 0 0.0000 -0.6640 1.3330 -1.2850 19 0 0 0 23 21 H182 H_ALI 0 0.0000 -1.5860 -0.0820 -0.7240 19 0 0 0 23 22 H183 H_ALI 0 0.0000 -2.4170 1.2390 -1.5790 19 0 0 0 23 23 Q3 PSEUD 0 0.0000 -1.5557 0.8300 -1.1960 0 0 0 0 0 24 C15 C_ALI 0 0.0000 -0.9420 -0.1020 1.7120 13 25 64 65 0 25 C16 C_ALI 0 0.0000 -2.4830 -0.1670 1.9070 24 26 61 62 0 26 C17 C_ALI 0 0.0000 -3.0710 1.0450 1.1400 14 25 27 60 0 27 C20 C_ALI 0 0.0000 -4.0890 0.5750 0.0980 26 28 54 59 0 28 C22 C_ALI 0 0.0000 -5.2790 -0.0770 0.8060 27 29 51 52 0 29 C23 C_ALI 0 0.0000 -6.2370 -0.6580 -0.2360 28 30 48 49 0 30 C24 C_ALI 0 0.0000 -7.4260 -1.3090 0.4720 29 31 45 46 0 31 C25 C_ALI 0 0.0000 -8.3840 -1.8900 -0.5700 30 32 34 39 0 32 O25 O_HYD 0 0.0000 -7.7350 -2.9510 -1.2740 31 33 0 0 0 33 H25 H_OXY 0 0.0000 -8.3720 -3.2890 -1.9190 32 0 0 0 0 34 C27 C_ALI 0 0.0000 -9.6330 -2.4300 0.1290 31 35 36 37 0 35 H271 H_ALI 0 0.0000 -10.1270 -1.6210 0.6660 34 0 0 0 38 36 H272 H_ALI 0 0.0000 -10.3150 -2.8440 -0.6130 34 0 0 0 38 37 H273 H_ALI 0 0.0000 -9.3450 -3.2110 0.8340 34 0 0 0 38 38 Q4 PSEUD 0 0.0000 -9.9290 -2.5587 0.2957 0 0 0 0 44 39 C26 C_ALI 0 0.0000 -8.7870 -0.7940 -1.5590 31 40 41 42 0 40 H261 H_ALI 0 0.0000 -7.8980 -0.4100 -2.0580 39 0 0 0 43 41 H262 H_ALI 0 0.0000 -9.4700 -1.2080 -2.3020 39 0 0 0 43 42 H263 H_ALI 0 0.0000 -9.2820 0.0150 -1.0230 39 0 0 0 43 43 Q5 PSEUD 0 0.0000 -8.8833 -0.5343 -1.7943 0 0 0 0 44 44 QQA PSEUD 0 0.0000 -9.4062 -1.5465 -0.7493 0 0 0 0 0 45 H241 H_ALI 0 0.0000 -7.0700 -2.1070 1.1220 30 0 0 0 47 46 H242 H_ALI 0 0.0000 -7.9490 -0.5610 1.0680 30 0 0 0 47 47 Q6 PSEUD 0 0.0000 -7.5095 -1.3340 1.0950 0 0 0 0 0 48 H231 H_ALI 0 0.0000 -6.5930 0.1410 -0.8870 29 0 0 0 50 49 H232 H_ALI 0 0.0000 -5.7140 -1.4060 -0.8320 29 0 0 0 50 50 Q7 PSEUD 0 0.0000 -6.1535 -0.6325 -0.8595 0 0 0 0 0 51 H221 H_ALI 0 0.0000 -4.9220 -0.8750 1.4570 28 0 0 0 53 52 H222 H_ALI 0 0.0000 -5.8010 0.6720 1.4020 28 0 0 0 53 53 Q8 PSEUD 0 0.0000 -5.3615 -0.1015 1.4295 0 0 0 0 0 54 C21 C_ALI 0 0.0000 -4.5750 1.7740 -0.7180 27 55 56 57 0 55 H211 H_ALI 0 0.0000 -3.7270 2.2380 -1.2220 54 0 0 0 58 56 H212 H_ALI 0 0.0000 -5.3000 1.4390 -1.4600 54 0 0 0 58 57 H213 H_ALI 0 0.0000 -5.0440 2.5000 -0.0530 54 0 0 0 58 58 Q9 PSEUD 0 0.0000 -4.6903 2.0590 -0.9117 0 0 0 0 0 59 H20 H_ALI 0 0.0000 -3.6200 -0.1510 -0.5660 27 0 0 0 0 60 H17 H_ALI 0 0.0000 -3.5370 1.7430 1.8350 26 0 0 0 0 61 H161 H_ALI 0 0.0000 -2.7290 -0.0950 2.9670 25 0 0 0 63 62 H162 H_ALI 0 0.0000 -2.8730 -1.0970 1.4940 25 0 0 0 63 63 Q10 PSEUD 0 0.0000 -2.8010 -0.5960 2.2305 0 0 0 0 0 64 H151 H_ALI 0 0.0000 -0.4240 -0.4060 2.6220 24 0 0 0 66 65 H152 H_ALI 0 0.0000 -0.6330 -0.7160 0.8670 24 0 0 0 66 66 Q11 PSEUD 0 0.0000 -0.5285 -0.5610 1.7445 0 0 0 0 0 67 H14 H_ALI 0 0.0000 -0.7940 1.9660 2.3460 13 0 0 0 0 68 C9 C_ALI 0 0.0000 0.6330 3.1690 0.2030 12 69 73 74 0 69 C11 C_ALI 0 0.0000 -0.6370 3.5680 -0.5460 15 68 70 71 0 70 H111 H_ALI 0 0.0000 -0.6280 4.6450 -0.7100 69 0 0 0 72 71 H112 H_ALI 0 0.0000 -0.6540 3.0630 -1.5110 69 0 0 0 72 72 Q12 PSEUD 0 0.0000 -0.6410 3.8540 -1.1105 0 0 0 0 0 73 H91 H_ALI 0 0.0000 0.7660 3.8280 1.0610 68 0 0 0 75 74 H92 H_ALI 0 0.0000 1.4890 3.2700 -0.4630 68 0 0 0 75 75 Q13 PSEUD 0 0.0000 1.1275 3.5490 0.2990 0 0 0 0 0 76 H7 H_ALI 0 0.0000 1.4030 -0.1750 0.8240 11 0 0 0 0 77 H6 H_ALI 0 0.0000 2.8160 2.2440 -0.6340 10 0 0 0 0 78 C10 C_BYL 0 0.0000 4.9180 0.6890 -1.2380 1 79 83 0 0 79 C19 C_BYL 0 0.0000 4.8770 1.4320 -2.3440 78 80 81 0 0 80 H191 H_ALI 0 0.0000 3.9290 1.7860 -2.7220 79 0 0 0 82 81 H192 H_ALI 0 0.0000 5.7910 1.6790 -2.8630 79 0 0 0 82 82 Q14 PSEUD 0 0.0000 4.8600 1.7325 -2.7925 0 0 0 0 0 83 C1 C_ALI 0 0.0000 6.2270 0.1740 -0.6740 78 84 86 87 0 84 O1 O_HYD 0 0.0000 6.5640 0.9050 0.5060 83 85 0 0 0 85 HO1 H_OXY 0 0.0000 6.6460 1.8330 0.2470 84 0 0 0 0 86 H1 H_ALI 0 0.0000 7.0170 0.2900 -1.4160 83 0 0 0 0 87 C2 C_ALI 0 0.0000 6.0550 -1.3100 -0.3340 3 83 88 89 0 88 H2 H_ALI 0 0.0000 5.8340 -1.8670 -1.2450 87 0 0 0 0 89 C28 C_ALI 0 0.0000 7.3470 -1.8430 0.2870 87 90 91 93 0 90 H281 H_ALI 0 0.0000 7.1980 -2.8740 0.6080 89 0 0 0 92 91 H282 H_ALI 0 0.0000 7.6160 -1.2300 1.1470 89 0 0 0 92 92 Q15 PSEUD 0 0.0000 7.4070 -2.0520 0.8775 0 0 0 0 0 93 C29 C_ALI 0 0.0000 8.4720 -1.7890 -0.7490 89 94 95 97 0 94 H291 H_ALI 0 0.0000 8.6210 -0.7580 -1.0700 93 0 0 0 96 95 H292 H_ALI 0 0.0000 8.2020 -2.4020 -1.6100 93 0 0 0 96 96 Q16 PSEUD 0 0.0000 8.4115 -1.5800 -1.3400 0 0 0 0 0 97 C30 C_ALI 0 0.0000 9.7640 -2.3220 -0.1280 93 98 99 100 0 98 H301 H_ALI 0 0.0000 10.0330 -1.7080 0.7320 97 0 0 0 101 99 H302 H_ALI 0 0.0000 9.6150 -3.3520 0.1930 97 0 0 0 101 100 H303 H_ALI 0 0.0000 10.5650 -2.2830 -0.8660 97 0 0 0 101 101 Q17 PSEUD 0 0.0000 10.0710 -2.4477 0.0197 0 0 0 0 0