REMARK This residue is converted from PDB Protein Databank automatically.The original name of this chemical component in PDB is = "2,2'-[(1,4-DIOXOBUTANE-1,4-DIYL)BIS(OXY)]BIS(N,N,N-TRIMETHYLETHANAMINIUM)" RESIDUE SCK 17 64 1 64 1 CHI1 0 0 0.0000 1 2 3 4 28 2 CHI2 0 0 0.0000 2 3 4 5 28 3 CHI3 0 0 0.0000 3 4 5 6 25 4 CHI4 0 0 0.0000 4 5 6 7 21 5 CHI5 0 0 0.0000 5 6 7 8 11 6 CHI6 0 0 0.0000 5 6 12 13 16 7 CHI7 0 0 0.0000 5 6 17 18 21 8 PHI1 0 0 0.0000 1 2 29 33 0 9 PHI2 0 0 0.0000 2 29 33 37 0 10 PHI3 0 0 0.0000 29 33 37 39 0 11 PHI4 0 0 0.0000 33 37 39 40 0 12 PHI5 0 0 0.0000 37 39 40 44 0 13 PHI6 0 0 0.0000 39 40 44 48 0 14 PHI7 0 0 0.0000 40 44 48 59 0 15 CHI8 0 0 0.0000 44 48 49 50 53 16 CHI9 0 0 0.0000 44 48 54 55 58 17 PHI8 0 0 0.0000 44 48 59 62 0 1 O13 O_BYL 0 0.0000 -1.5670 -1.8090 0.6380 2 0 0 0 0 2 C12 C_BYL 0 0.0000 -1.8020 -0.6240 0.6480 1 3 29 0 0 3 O14 O_EST 0 0.0000 -3.0720 -0.1910 0.6520 2 4 0 0 0 4 C15 C_ALI 0 0.0000 -4.1650 -1.1470 0.6430 3 5 26 27 0 5 C16 C_ALI 0 0.0000 -5.4990 -0.3970 0.6500 4 6 23 24 0 6 N17 N_AMO 0 0.0000 -5.6650 0.3170 -0.6240 5 7 12 17 0 7 C20 C_ALI 0 0.0000 -5.5490 -0.6350 -1.7370 6 8 9 10 0 8 H201 H_ALI 0 0.0000 -4.5660 -1.1060 -1.7100 7 0 0 0 11 9 H202 H_ALI 0 0.0000 -6.3210 -1.3980 -1.6440 7 0 0 0 11 10 H203 H_ALI 0 0.0000 -5.6720 -0.1050 -2.6820 7 0 0 0 11 11 Q1 PSEUD 0 0.0000 -5.5197 -0.8697 -2.0120 0 0 0 0 22 12 C19 C_ALI 0 0.0000 -4.6250 1.3460 -0.7480 6 13 14 15 0 13 H191 H_ALI 0 0.0000 -4.8740 2.0170 -1.5700 12 0 0 0 16 14 H192 H_ALI 0 0.0000 -4.5640 1.9150 0.1790 12 0 0 0 16 15 H193 H_ALI 0 0.0000 -3.6640 0.8700 -0.9460 12 0 0 0 16 16 Q2 PSEUD 0 0.0000 -4.3673 1.6007 -0.7790 0 0 0 0 22 17 C18 C_ALI 0 0.0000 -6.9890 0.9520 -0.6590 6 18 19 20 0 18 H181 H_ALI 0 0.0000 -7.7610 0.1880 -0.5670 17 0 0 0 21 19 H182 H_ALI 0 0.0000 -7.0760 1.6580 0.1670 17 0 0 0 21 20 H183 H_ALI 0 0.0000 -7.1130 1.4820 -1.6040 17 0 0 0 21 21 Q3 PSEUD 0 0.0000 -7.3167 1.1093 -0.6680 0 0 0 0 22 22 QQA PSEUD 0 0.0000 -5.7346 0.6134 -1.1530 0 0 0 0 0 23 H161 H_ALI 0 0.0000 -5.5090 0.3190 1.4710 5 0 0 0 25 24 H162 H_ALI 0 0.0000 -6.3150 -1.1080 0.7770 5 0 0 0 25 25 Q4 PSEUD 0 0.0000 -5.9120 -0.3945 1.1240 0 0 0 0 0 26 H151 H_ALI 0 0.0000 -4.1000 -1.7800 1.5280 4 0 0 0 28 27 H152 H_ALI 0 0.0000 -4.1000 -1.7650 -0.2520 4 0 0 0 28 28 Q5 PSEUD 0 0.0000 -4.1000 -1.7725 0.6380 0 0 0 0 0 29 C11 C_ALI 0 0.0000 -0.6670 0.3690 0.6570 2 30 31 33 0 30 H111 H_ALI 0 0.0000 -0.7320 1.0020 -0.2280 29 0 0 0 32 31 H112 H_ALI 0 0.0000 -0.7320 0.9870 1.5520 29 0 0 0 32 32 Q6 PSEUD 0 0.0000 -0.7320 0.9945 0.6620 0 0 0 0 0 33 C6 C_ALI 0 0.0000 0.6660 -0.3810 0.6500 29 34 35 37 0 34 H61 H_ALI 0 0.0000 0.7310 -1.0150 1.5350 33 0 0 0 36 35 H62 H_ALI 0 0.0000 0.7310 -1.0000 -0.2450 33 0 0 0 36 36 Q7 PSEUD 0 0.0000 0.7310 -1.0075 0.6450 0 0 0 0 0 37 C5 C_BYL 0 0.0000 1.8010 0.6110 0.6590 33 38 39 0 0 38 O7 O_BYL 0 0.0000 1.5660 1.7960 0.6700 37 0 0 0 0 39 O4 O_EST 0 0.0000 3.0710 0.1780 0.6560 37 40 0 0 0 40 C3 C_ALI 0 0.0000 4.1640 1.1340 0.6640 39 41 42 44 0 41 H31 H_ALI 0 0.0000 4.0990 1.7670 -0.2200 40 0 0 0 43 42 H32 H_ALI 0 0.0000 4.0990 1.7520 1.5590 40 0 0 0 43 43 Q8 PSEUD 0 0.0000 4.0990 1.7595 0.6695 0 0 0 0 0 44 C2 C_ALI 0 0.0000 5.4980 0.3840 0.6580 40 45 46 48 0 45 H21 H_ALI 0 0.0000 6.3140 1.0920 0.8000 44 0 0 0 47 46 H22 H_ALI 0 0.0000 5.5070 -0.3480 1.4650 44 0 0 0 47 47 Q9 PSEUD 0 0.0000 5.9105 0.3720 1.1325 0 0 0 0 0 48 N1 N_AMI 0 0.0000 5.6660 -0.3050 -0.6290 44 49 54 59 0 49 C8 C_ALI 0 0.0000 5.5150 0.6620 -1.7250 48 50 51 52 0 50 H81 H_ALI 0 0.0000 6.2700 1.4420 -1.6280 49 0 0 0 53 51 H82 H_ALI 0 0.0000 5.6400 0.1510 -2.6800 49 0 0 0 53 52 H83 H_ALI 0 0.0000 4.5220 1.1100 -1.6800 49 0 0 0 53 53 Q10 PSEUD 0 0.0000 5.4773 0.9010 -1.9960 0 0 0 0 0 54 C9 C_ALI 0 0.0000 7.0040 -0.9080 -0.6900 48 55 56 57 64 55 H91 H_ALI 0 0.0000 7.1160 -1.6250 0.1230 54 0 0 0 58 56 H92 H_ALI 0 0.0000 7.1290 -1.4190 -1.6450 54 0 0 0 58 57 H93 H_ALI 0 0.0000 7.7590 -0.1280 -0.5930 54 0 0 0 58 58 Q11 PSEUD 0 0.0000 7.3347 -1.0573 -0.7050 0 0 0 0 0 59 C10 C_ALI 0 0.0000 4.6480 -1.3560 -0.7590 48 60 61 62 64 60 H101 H_ALI 0 0.0000 3.6640 -0.8980 -0.8630 59 0 0 0 63 61 H102 H_ALI 0 0.0000 4.8620 -1.9610 -1.6400 59 0 0 0 63 62 H103 H_ALI 0 0.0000 4.6630 -1.9870 0.1290 59 0 0 0 63 63 Q12 PSEUD 0 0.0000 4.3963 -1.6153 -0.7913 0 0 0 0 0 64 QQB PSEUD 0 0.0000 NaN -0.7547 -0.4830 0 0 0 0 64