==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER DETOXIFICATION ENZYME 02-SEP-97 1GSU . COMPND 2 MOLECULE: CLASS-MU GLUTATHIONE S-TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; . AUTHOR Y.-J.SUN,C.KUAN,M.F.TAM,C.-D.HSIAO . 434 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19476.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 298 68.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 3.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 15 3.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 57 13.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 176 40.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 1 0 0 3 0 2 4 0 0 0 0 1 1 0 0 0 0 0 0 2 0 0 2 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A V 0 0 122 0, 0.0 2,-0.3 0, 0.0 26,-0.3 0.000 360.0 360.0 360.0 153.1 31.3 14.2 66.2 2 2 A V E -a 27 0A 2 24,-2.3 26,-2.4 62,-0.1 2,-0.4 -0.751 360.0-132.3-104.4 154.6 29.9 12.1 63.4 3 3 A T E -aB 28 63A 22 60,-2.3 60,-2.1 -2,-0.3 2,-0.5 -0.961 14.9-166.1-115.4 126.9 30.6 8.4 63.4 4 4 A L E -aB 29 62A 0 24,-2.3 26,-3.0 -2,-0.4 2,-0.5 -0.964 9.3-163.9-110.4 124.5 31.8 6.5 60.3 5 5 A G E +aB 30 61A 0 56,-2.9 56,-1.8 -2,-0.5 2,-0.3 -0.947 29.1 124.4-114.1 130.8 31.6 2.7 60.5 6 6 A Y E -a 31 0A 25 24,-2.3 26,-1.5 -2,-0.5 -2,-0.0 -0.938 63.7 -69.7-168.0 167.0 33.5 0.4 58.1 7 7 A W E -a 32 0A 29 -2,-0.3 2,-3.2 24,-0.2 26,-0.2 -0.265 56.6 -99.5 -63.2 154.5 35.9 -2.5 58.3 8 8 A D S S+ 0 0 63 24,-2.0 2,-0.3 23,-0.1 -1,-0.1 -0.404 97.9 93.3 -76.4 71.3 39.4 -1.6 59.5 9 9 A I S S- 0 0 4 -2,-3.2 4,-0.2 1,-0.2 198,-0.2 -0.947 83.8-114.0-155.8 159.8 40.4 -1.6 55.8 10 10 A R S >> S+ 0 0 0 196,-2.5 3,-1.3 -2,-0.3 4,-0.7 1.000 71.9 111.2 -64.0 -74.8 40.7 0.9 53.0 11 11 A G G >4 S- 0 0 10 196,-2.0 3,-1.2 195,-0.4 4,-0.3 0.167 89.7 -11.1 39.8-142.4 38.0 -0.1 50.6 12 12 A L G 34 S+ 0 0 45 1,-0.2 4,-0.3 2,-0.1 -1,-0.2 0.510 129.0 65.1 -66.4 -6.1 34.8 1.9 49.9 13 13 A A G <> S+ 0 0 0 -3,-1.3 4,-2.5 -4,-0.2 5,-0.2 0.607 74.0 88.1 -95.6 -11.3 35.5 4.1 52.9 14 14 A H H S+ 0 0 2 -4,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.823 113.1 52.5 -62.0 -29.5 36.9 8.6 49.8 16 16 A I H > S+ 0 0 0 -4,-0.3 4,-2.4 -3,-0.2 -1,-0.2 0.892 108.9 48.3 -73.8 -38.2 34.6 9.2 52.8 17 17 A R H X S+ 0 0 1 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.902 113.3 48.6 -69.4 -36.4 37.5 9.5 55.3 18 18 A L H X S+ 0 0 0 -4,-2.3 4,-2.7 -5,-0.2 -1,-0.2 0.866 112.9 46.6 -69.5 -39.4 39.3 11.9 53.0 19 19 A L H X S+ 0 0 0 -4,-1.8 4,-2.7 -5,-0.2 6,-0.3 0.915 111.7 51.3 -69.6 -42.0 36.1 14.1 52.5 20 20 A L H <>S+ 0 0 0 -4,-2.4 5,-2.4 1,-0.2 -2,-0.2 0.895 114.3 45.8 -59.1 -41.9 35.4 14.0 56.2 21 21 A E H ><5S+ 0 0 10 -4,-2.1 3,-0.8 3,-0.2 -2,-0.2 0.902 114.6 45.5 -69.8 -42.3 39.0 15.2 56.7 22 22 A Y H 3<5S+ 0 0 75 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.944 112.0 49.0 -68.8 -49.7 39.0 17.9 54.0 23 23 A T T 3<5S- 0 0 13 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.347 113.1-120.8 -71.9 4.8 35.7 19.4 55.0 24 24 A E T < 5 + 0 0 138 -3,-0.8 -3,-0.2 1,-0.2 -4,-0.1 0.775 48.0 172.9 60.0 34.7 36.9 19.5 58.6 25 25 A T < - 0 0 17 -5,-2.4 2,-0.5 -6,-0.3 -1,-0.2 -0.597 35.6-123.8 -78.7 123.6 34.1 17.3 59.9 26 26 A P + 0 0 87 0, 0.0 -24,-2.3 0, 0.0 2,-0.3 -0.524 52.0 157.6 -65.0 118.4 34.5 16.3 63.5 27 27 A Y E -a 2 0A 43 -2,-0.5 2,-0.3 -26,-0.3 -24,-0.2 -0.962 36.3-159.7-148.1 164.0 34.4 12.5 63.4 28 28 A Q E -a 3 0A 102 -26,-2.4 -24,-2.3 -2,-0.3 2,-0.4 -0.866 23.8-130.8-132.6 162.1 35.3 9.2 65.0 29 29 A E E -a 4 0A 47 -2,-0.3 2,-0.8 -26,-0.2 -24,-0.2 -0.936 10.1-154.9-125.1 146.3 35.4 5.8 63.4 30 30 A R E -a 5 0A 99 -26,-3.0 -24,-2.3 -2,-0.4 2,-0.8 -0.967 22.4-172.7-112.3 104.6 34.1 2.4 64.2 31 31 A R E -a 6 0A 74 -2,-0.8 2,-0.3 -26,-0.2 -24,-0.2 -0.884 15.0-144.8-103.5 96.4 36.6 0.1 62.5 32 32 A Y E -a 7 0A 2 -26,-1.5 -24,-2.0 -2,-0.8 2,-0.2 -0.488 16.7-150.6 -66.2 121.9 35.3 -3.5 62.7 33 33 A K - 0 0 110 -2,-0.3 11,-0.4 -26,-0.2 12,-0.2 -0.498 5.8-125.8 -91.2 160.8 38.1 -6.0 63.0 34 34 A A - 0 0 30 -2,-0.2 -1,-0.1 1,-0.1 3,-0.1 -0.334 20.9-160.5 -96.5-179.5 38.3 -9.6 61.9 35 35 A G + 0 0 45 1,-0.2 2,-0.9 6,-0.1 -1,-0.1 0.328 52.8 21.5-128.3-109.7 39.1 -12.7 64.0 36 36 A P S > S- 0 0 78 0, 0.0 3,-2.2 0, 0.0 -1,-0.2 -0.631 81.3-114.7 -77.9 103.5 40.3 -16.3 63.5 37 37 A A T 3 S+ 0 0 91 -2,-0.9 0, 0.0 1,-0.3 0, 0.0 -0.478 87.7 20.3 -67.8 145.9 42.1 -16.7 60.1 38 38 A P T 3 S+ 0 0 133 0, 0.0 -1,-0.3 0, 0.0 0, 0.0 -0.561 107.1 72.5-113.8 56.0 41.3 -18.3 57.8 39 39 A D S < S- 0 0 96 -3,-2.2 -2,-0.1 2,-0.0 0, 0.0 0.294 94.2-106.6-115.0 17.3 37.6 -18.8 58.4 40 40 A F - 0 0 113 1,-0.2 3,-0.1 -4,-0.1 -3,-0.1 0.909 38.0-171.8 57.0 102.3 35.8 -15.4 57.8 41 41 A D > + 0 0 21 1,-0.1 3,-0.6 2,-0.0 -1,-0.2 -0.632 21.3 158.4-129.3 71.2 34.9 -14.1 61.2 42 42 A P T >> + 0 0 42 0, 0.0 4,-2.5 0, 0.0 3,-2.0 0.467 37.8 118.4 -72.8 -2.5 32.7 -11.0 60.7 43 43 A S H 3> + 0 0 69 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.672 63.4 62.6 -35.0 -41.7 31.3 -11.4 64.2 44 44 A D H <4 S+ 0 0 52 -3,-0.6 -1,-0.3 -11,-0.4 -10,-0.1 0.928 119.4 28.2 -56.2 -41.7 32.6 -8.0 65.4 45 45 A W H X> S+ 0 0 17 -3,-2.0 4,-2.4 -12,-0.2 3,-1.4 0.869 119.3 56.7 -83.7 -46.5 30.3 -6.4 62.8 46 46 A T H 3< S+ 0 0 79 -4,-2.5 4,-0.5 1,-0.3 -2,-0.2 0.799 102.0 55.9 -55.3 -36.6 27.7 -9.1 62.8 47 47 A N T 3< S+ 0 0 115 -4,-3.0 -1,-0.3 -5,-0.2 -2,-0.2 0.566 120.9 32.6 -74.2 -8.9 27.1 -8.8 66.6 48 48 A E T X4 S+ 0 0 50 -3,-1.4 3,-1.7 -5,-0.2 -2,-0.2 0.631 91.7 90.0-123.1 -18.9 26.3 -5.1 65.9 49 49 A K G >< S+ 0 0 60 -4,-2.4 3,-0.6 1,-0.3 5,-0.3 0.851 93.3 41.5 -49.2 -48.3 24.7 -4.9 62.4 50 50 A E G 3 S+ 0 0 132 -4,-0.5 -1,-0.3 1,-0.2 -4,-0.1 0.032 107.9 62.7 -94.5 28.7 21.1 -5.3 63.5 51 51 A K G < S+ 0 0 149 -3,-1.7 -1,-0.2 1,-0.0 -2,-0.1 0.096 78.2 79.2-139.5 27.5 21.3 -3.1 66.6 52 52 A L S < S- 0 0 30 -3,-0.6 -2,-0.1 2,-0.1 -3,-0.1 0.525 96.7-114.7-113.2 -5.7 22.1 0.4 65.2 53 53 A G + 0 0 55 1,-0.3 2,-0.2 -4,-0.1 -3,-0.1 0.701 61.2 153.0 78.7 21.8 18.7 1.5 64.0 54 54 A L - 0 0 17 -5,-0.3 -1,-0.3 1,-0.1 -2,-0.1 -0.573 44.1-141.5 -84.0 146.5 19.8 1.6 60.4 55 55 A D S S+ 0 0 90 1,-0.3 303,-0.2 13,-0.3 -1,-0.1 0.807 98.5 17.5 -77.5 -35.3 17.0 1.1 57.8 56 56 A F S S- 0 0 3 2,-0.0 -1,-0.3 302,-0.0 15,-0.0 -0.783 93.3-143.5-135.0 79.8 19.1 -1.0 55.4 57 57 A P + 0 0 16 0, 0.0 2,-0.3 0, 0.0 13,-0.1 -0.142 43.1 123.7 -47.5 140.6 22.1 -2.1 57.6 58 58 A N - 0 0 55 -9,-0.1 -2,-0.0 13,-0.0 -4,-0.0 -0.974 53.7 -59.4 179.8 176.5 25.4 -2.3 55.7 59 59 A L S S+ 0 0 15 -2,-0.3 -53,-0.1 1,-0.1 2,-0.1 -0.993 104.5 37.2-128.6 131.6 29.0 -1.0 55.6 60 60 A P S S+ 0 0 2 0, 0.0 11,-1.0 0, 0.0 2,-0.3 0.410 75.3 161.2 -84.9 164.2 29.9 1.7 55.4 61 61 A Y E -BC 5 70A 3 -56,-1.8 -56,-2.9 9,-0.2 2,-0.3 -0.911 21.7-154.6-134.5 163.5 27.4 3.7 57.5 62 62 A L E -BC 4 69A 3 7,-1.9 7,-2.2 -2,-0.3 2,-0.5 -0.987 2.9-157.8-144.0 129.9 27.6 7.2 59.1 63 63 A I E +BC 3 68A 38 -60,-2.1 -60,-2.3 -2,-0.3 2,-0.3 -0.951 17.0 167.6-113.1 128.0 25.7 8.3 62.2 64 64 A D E > - C 0 67A 40 3,-2.9 3,-1.9 -2,-0.5 2,-0.3 -0.743 68.0 -63.7-140.8 84.9 25.1 12.1 62.7 65 65 A G T 3 S- 0 0 59 -64,-0.3 -1,-0.2 1,-0.3 0, 0.0 -0.570 120.9 -14.3 71.0-128.2 22.6 12.7 65.4 66 66 A D T 3 S+ 0 0 163 -2,-0.3 2,-0.6 -3,-0.1 -1,-0.3 0.326 115.8 103.1 -86.9 5.9 19.4 11.2 64.1 67 67 A V E < +C 64 0A 30 -3,-1.9 -3,-2.9 2,-0.0 2,-0.5 -0.826 46.8 174.2 -91.6 118.2 20.8 11.0 60.6 68 68 A K E +C 63 0A 73 -2,-0.6 2,-0.3 -5,-0.2 -13,-0.3 -0.969 6.2 174.2-129.0 112.9 21.7 7.4 59.9 69 69 A L E -C 62 0A 8 -7,-2.2 -7,-1.9 -2,-0.5 2,-0.3 -0.882 17.0-176.4-123.3 152.5 22.8 6.5 56.5 70 70 A T E +C 61 0A 4 -2,-0.3 -9,-0.2 -9,-0.2 250,-0.1 -0.864 51.6 76.5-132.7 164.4 24.2 3.5 54.6 71 71 A Q S >> S- 0 0 17 -11,-1.0 4,-1.6 -2,-0.3 3,-1.6 0.814 71.3-128.7 90.6 97.2 25.4 3.4 51.0 72 72 A S H 3> S+ 0 0 13 1,-0.3 4,-2.2 2,-0.2 5,-0.1 0.775 107.4 52.5 -41.7 -45.4 28.8 5.1 50.4 73 73 A N H 3> S+ 0 0 4 1,-0.2 4,-2.4 2,-0.2 -1,-0.3 0.876 110.0 50.1 -63.1 -36.4 27.6 7.3 47.6 74 74 A A H <> S+ 0 0 1 -3,-1.6 4,-1.1 2,-0.2 -2,-0.2 0.783 108.1 52.3 -70.3 -33.1 24.7 8.6 49.8 75 75 A I H X S+ 0 0 0 -4,-1.6 4,-2.7 2,-0.2 5,-0.2 0.942 111.0 48.8 -70.2 -42.9 27.1 9.3 52.7 76 76 A L H X S+ 0 0 2 -4,-2.2 4,-3.6 1,-0.3 5,-0.3 0.941 110.5 48.1 -60.5 -55.1 29.3 11.3 50.3 77 77 A R H X S+ 0 0 18 -4,-2.4 4,-1.6 1,-0.2 -1,-0.3 0.803 111.7 53.7 -55.8 -29.6 26.4 13.3 48.9 78 78 A Y H X S+ 0 0 14 -4,-1.1 4,-0.9 2,-0.2 -2,-0.2 0.974 113.7 38.7 -72.1 -51.4 25.3 13.9 52.4 79 79 A I H >< S+ 0 0 1 -4,-2.7 3,-0.9 1,-0.2 4,-0.3 0.924 116.1 53.8 -61.1 -48.3 28.7 15.3 53.5 80 80 A A H ><>S+ 0 0 0 -4,-3.6 5,-2.5 1,-0.2 3,-1.4 0.842 101.3 58.7 -57.2 -37.9 29.1 17.2 50.2 81 81 A R H ><5S+ 0 0 56 -4,-1.6 3,-0.7 1,-0.3 -1,-0.2 0.782 98.4 59.3 -65.3 -26.7 25.7 19.0 50.5 82 82 A K T <<5S+ 0 0 104 -3,-0.9 -1,-0.3 -4,-0.9 -2,-0.2 0.537 117.9 31.7 -78.6 -5.8 26.8 20.6 53.8 83 83 A H T < 5S- 0 0 77 -3,-1.4 -1,-0.2 -4,-0.3 -2,-0.2 0.060 111.9-111.8-136.6 21.2 29.7 22.2 52.0 84 84 A N T < 5 + 0 0 74 -3,-0.7 -3,-0.2 1,-0.1 -4,-0.1 0.930 68.8 142.6 43.6 57.3 28.2 22.7 48.6 85 85 A M < + 0 0 12 -5,-2.5 69,-2.3 -8,-0.1 70,-0.3 -0.039 45.6 84.7-114.7 28.2 30.6 20.2 47.0 86 86 A C S S- 0 0 23 1,-0.3 7,-0.1 -6,-0.3 6,-0.0 -0.489 98.7 -69.4-109.3-178.8 28.0 18.8 44.7 87 87 A G - 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