REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = "2ALPHA-(3-HYDROXYPROPYL)-1ALPHA,25-DIHYDROXYVITAMIN D3" RESIDUE O1C 30 102 1 102 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 97 101 0 30 PHI7 0 0 0.0000 93 97 101 102 0 1 C5 C_BYL 0 0.0000 -3.6660 1.5070 -0.1390 2 10 78 0 0 2 C4 C_ALI 0 0.0000 -4.9570 1.8620 0.5720 1 3 7 8 0 3 C3 C_ALI 0 0.0000 -5.5200 0.5900 1.2140 2 4 6 87 0 4 O2 O_HYD 0 0.0000 -6.7650 0.8890 1.8470 3 5 0 0 0 5 HO2 H_OXY 0 0.0000 -6.5840 1.5620 2.5180 4 0 0 0 0 6 H3 H_ALI 0 0.0000 -4.8150 0.2180 1.9580 3 0 0 0 0 7 H41 H_ALI 0 0.0000 -4.7580 2.6060 1.3430 2 0 0 0 9 8 H42 H_ALI 0 0.0000 -5.6740 2.2600 -0.1460 2 0 0 0 9 9 Q1 PSEUD 0 0.0000 -5.2160 2.4330 0.5985 0 0 0 0 0 10 C6 C_BYL 0 0.0000 -2.5530 2.2550 0.0000 1 11 77 0 0 11 C7 C_BYL 0 0.0000 -1.3240 1.8790 -0.7040 10 12 76 0 0 12 C8 C_BYL 0 0.0000 -0.2240 2.6190 -0.5660 11 13 68 0 0 13 C14 C_ALI 0 0.0000 1.0620 2.2830 -1.2610 12 14 24 67 0 14 C13 C_ALI 0 0.0000 2.1270 2.1190 -0.1390 13 15 19 26 0 15 C12 C_ALI 0 0.0000 2.3140 3.4620 0.5170 14 16 17 69 0 16 H121 H_ALI 0 0.0000 2.5230 4.2110 -0.2460 15 0 0 0 18 17 H122 H_ALI 0 0.0000 3.1420 3.4140 1.2260 15 0 0 0 18 18 Q2 PSEUD 0 0.0000 2.8325 3.8125 0.4900 0 0 0 0 0 19 C18 C_ALI 0 0.0000 1.5750 1.1280 0.8880 14 20 21 22 0 20 H181 H_ALI 0 0.0000 0.6230 1.4940 1.2710 19 0 0 0 23 21 H182 H_ALI 0 0.0000 1.4270 0.1580 0.4130 19 0 0 0 23 22 H183 H_ALI 0 0.0000 2.2830 1.0250 1.7110 19 0 0 0 23 23 Q3 PSEUD 0 0.0000 1.4443 0.8923 1.1317 0 0 0 0 0 24 C15 C_ALI 0 0.0000 1.1360 0.9180 -1.9480 13 25 64 65 0 25 C16 C_ALI 0 0.0000 2.6660 0.6450 -2.0060 24 26 61 62 0 26 C17 C_ALI 0 0.0000 3.3010 1.4830 -0.8660 14 25 27 60 0 27 C20 C_ALI 0 0.0000 4.0880 0.5780 0.0830 26 28 54 59 0 28 C22 C_ALI 0 0.0000 5.2420 -0.0790 -0.6770 27 29 51 52 0 29 C23 C_ALI 0 0.0000 5.9520 -1.0780 0.2380 28 30 48 49 0 30 C24 C_ALI 0 0.0000 7.1060 -1.7350 -0.5220 29 31 45 46 0 31 C25 C_ALI 0 0.0000 7.8170 -2.7340 0.3930 30 32 34 39 0 32 O25 O_HYD 0 0.0000 8.3290 -2.0510 1.5390 31 33 0 0 0 33 H25 H_OXY 0 0.0000 8.9480 -1.3840 1.2120 32 0 0 0 0 34 C27 C_ALI 0 0.0000 6.8250 -3.8090 0.8420 31 35 36 37 0 35 H271 H_ALI 0 0.0000 6.4340 -4.3310 -0.0320 34 0 0 0 38 36 H272 H_ALI 0 0.0000 7.3310 -4.5210 1.4940 34 0 0 0 38 37 H273 H_ALI 0 0.0000 6.0030 -3.3410 1.3840 34 0 0 0 38 38 Q4 PSEUD 0 0.0000 6.5893 -4.0643 0.9487 0 0 0 0 44 39 C26 C_ALI 0 0.0000 8.9710 -3.3910 -0.3670 31 40 41 42 0 40 H261 H_ALI 0 0.0000 9.6770 -2.6250 -0.6870 39 0 0 0 43 41 H262 H_ALI 0 0.0000 9.4770 -4.1030 0.2850 39 0 0 0 43 42 H263 H_ALI 0 0.0000 8.5800 -3.9130 -1.2410 39 0 0 0 43 43 Q5 PSEUD 0 0.0000 9.2447 -3.5470 -0.5477 0 0 0 0 44 44 QQA PSEUD 0 0.0000 7.9170 -3.8057 0.2005 0 0 0 0 0 45 H241 H_ALI 0 0.0000 6.7160 -2.2570 -1.3960 30 0 0 0 47 46 H242 H_ALI 0 0.0000 7.8130 -0.9690 -0.8420 30 0 0 0 47 47 Q6 PSEUD 0 0.0000 7.2645 -1.6130 -1.1190 0 0 0 0 0 48 H231 H_ALI 0 0.0000 6.3430 -0.5570 1.1120 29 0 0 0 50 49 H232 H_ALI 0 0.0000 5.2460 -1.8440 0.5580 29 0 0 0 50 50 Q7 PSEUD 0 0.0000 5.7945 -1.2005 0.8350 0 0 0 0 0 51 H221 H_ALI 0 0.0000 4.8510 -0.6010 -1.5510 28 0 0 0 53 52 H222 H_ALI 0 0.0000 5.9490 0.6870 -0.9970 28 0 0 0 53 53 Q8 PSEUD 0 0.0000 5.4000 0.0430 -1.2740 0 0 0 0 0 54 C21 C_ALI 0 0.0000 4.6470 1.4120 1.2380 27 55 56 57 0 55 H211 H_ALI 0 0.0000 5.3070 2.1840 0.8410 54 0 0 0 58 56 H212 H_ALI 0 0.0000 3.8250 1.8800 1.7790 54 0 0 0 58 57 H213 H_ALI 0 0.0000 5.2070 0.7670 1.9140 54 0 0 0 58 58 Q9 PSEUD 0 0.0000 4.7797 1.6103 1.5113 0 0 0 0 0 59 H20 H_ALI 0 0.0000 3.4280 -0.1940 0.4800 27 0 0 0 0 60 H17 H_ALI 0 0.0000 3.9520 2.2530 -1.2800 26 0 0 0 0 61 H161 H_ALI 0 0.0000 3.0650 0.9610 -2.9700 25 0 0 0 63 62 H162 H_ALI 0 0.0000 2.8630 -0.4150 -1.8470 25 0 0 0 63 63 Q10 PSEUD 0 0.0000 2.9640 0.2730 -2.4085 0 0 0 0 0 64 H151 H_ALI 0 0.0000 0.7130 0.9670 -2.9510 24 0 0 0 66 65 H152 H_ALI 0 0.0000 0.6310 0.1580 -1.3510 24 0 0 0 66 66 Q11 PSEUD 0 0.0000 0.6720 0.5625 -2.1510 0 0 0 0 0 67 H14 H_ALI 0 0.0000 1.3450 3.0780 -1.9510 13 0 0 0 0 68 C9 C_ALI 0 0.0000 -0.1830 3.8640 0.3090 12 69 73 74 0 69 C11 C_ALI 0 0.0000 1.0140 3.8190 1.2570 15 68 70 71 0 70 H111 H_ALI 0 0.0000 1.1300 4.7950 1.7290 69 0 0 0 72 71 H112 H_ALI 0 0.0000 0.8280 3.0730 2.0290 69 0 0 0 72 72 Q12 PSEUD 0 0.0000 0.9790 3.9340 1.8790 0 0 0 0 0 73 H91 H_ALI 0 0.0000 -0.1050 4.7460 -0.3270 68 0 0 0 75 74 H92 H_ALI 0 0.0000 -1.1010 3.9230 0.8930 68 0 0 0 75 75 Q13 PSEUD 0 0.0000 -0.6030 4.3345 0.2830 0 0 0 0 0 76 H7 H_ALI 0 0.0000 -1.3100 1.0030 -1.3350 11 0 0 0 0 77 H6 H_ALI 0 0.0000 -2.5660 3.1320 0.6310 10 0 0 0 0 78 C10 C_BYL 0 0.0000 -3.6890 0.3050 -0.9980 1 79 83 0 0 79 C19 C_BYL 0 0.0000 -3.1180 0.2900 -2.2030 78 80 81 0 0 80 H191 H_ALI 0 0.0000 -3.1480 -0.6070 -2.8030 79 0 0 0 82 81 H192 H_ALI 0 0.0000 -2.6270 1.1750 -2.5790 79 0 0 0 82 82 Q14 PSEUD 0 0.0000 -2.8875 0.2840 -2.6910 0 0 0 0 0 83 C1 C_ALI 0 0.0000 -4.3900 -0.9200 -0.4340 78 84 86 87 0 84 O1 O_HYD 0 0.0000 -3.5930 -1.5040 0.5980 83 85 0 0 0 85 HO1 H_OXY 0 0.0000 -2.7570 -1.7660 0.1910 84 0 0 0 0 86 H1 H_ALI 0 0.0000 -4.5510 -1.6470 -1.2300 83 0 0 0 0 87 C2 C_ALI 0 0.0000 -5.7390 -0.4780 0.1420 3 83 88 89 0 88 H2 H_ALI 0 0.0000 -6.3580 -0.0680 -0.6560 87 0 0 0 0 89 C28 C_ALI 0 0.0000 -6.4450 -1.6850 0.7640 87 90 91 93 0 90 H281 H_ALI 0 0.0000 -5.7900 -2.1470 1.5030 89 0 0 0 92 91 H282 H_ALI 0 0.0000 -7.3650 -1.3580 1.2480 89 0 0 0 92 92 Q15 PSEUD 0 0.0000 -6.5775 -1.7525 1.3755 0 0 0 0 0 93 C29 C_ALI 0 0.0000 -6.7760 -2.7010 -0.3300 89 94 95 97 0 94 H291 H_ALI 0 0.0000 -7.4310 -2.2390 -1.0690 93 0 0 0 96 95 H292 H_ALI 0 0.0000 -5.8560 -3.0280 -0.8140 93 0 0 0 96 96 Q16 PSEUD 0 0.0000 -6.6435 -2.6335 -0.9415 0 0 0 0 0 97 C30 C_ALI 0 0.0000 -7.4820 -3.9080 0.2910 93 98 99 101 0 98 H301 H_ALI 0 0.0000 -6.8280 -4.3700 1.0300 97 0 0 0 100 99 H302 H_ALI 0 0.0000 -8.4020 -3.5810 0.7750 97 0 0 0 100 100 Q17 PSEUD 0 0.0000 -7.6150 -3.9755 0.9025 0 0 0 0 0 101 O31 O_HYD 0 0.0000 -7.7920 -4.8570 -0.7310 97 102 0 0 0 102 H31 H_OXY 0 0.0000 -8.2340 -5.6000 -0.2980 101 0 0 0 0