==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 06-MAR-00 1EK2 . COMPND 2 MOLECULE: EPOXIDE HYDROLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR M.A.ARGIRIADI,C.MORISSEAU,M.H.GOODROW,D.L.DOWDY,B.D.HAMMOCK, . 1028 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 40125.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 700 68.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 95 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 22 2.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 0.3 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 . 87 8.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 158 15.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 298 29.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 13 1.3 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 6 4 1 9 4 1 4 1 0 6 4 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 2 2 7 4 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 . 4 2 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 ANTIPARALLEL BRIDGES PER LADDER . 3 1 0 2 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 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 4 A R 0 0 157 0, 0.0 62,-2.0 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0-175.3 -10.5 -84.3 -31.4 2 5 A V E -ab 63 125A 7 122,-1.1 124,-1.7 60,-0.3 2,-0.4 -0.894 360.0-150.2-128.8 157.2 -11.4 -84.1 -35.1 3 6 A A E -ab 64 126A 2 60,-2.5 62,-1.4 -2,-0.3 2,-0.4 -0.981 11.5-165.0-129.5 123.5 -10.8 -86.2 -38.2 4 7 A A E -ab 65 127A 0 122,-3.5 124,-0.5 -2,-0.4 2,-0.4 -0.885 5.1-169.7-112.0 138.0 -10.5 -84.8 -41.7 5 8 A F E -ab 66 128A 0 60,-1.9 62,-1.1 -2,-0.4 124,-0.2 -0.979 14.6-146.1-131.9 133.4 -10.8 -86.7 -45.0 6 9 A D - 0 0 0 122,-2.5 62,-0.2 -2,-0.4 123,-0.1 -0.052 9.3-156.3 -72.9-171.7 -10.1 -85.9 -48.6 7 10 A L > + 0 0 8 3,-0.1 4,-0.7 60,-0.1 3,-0.5 0.532 68.5 96.4-137.9 -37.6 -12.3 -87.6 -51.2 8 11 A D T 4 S- 0 0 22 1,-0.3 121,-0.1 2,-0.1 60,-0.0 0.700 125.6 -25.2 -31.4 -29.7 -10.3 -87.7 -54.5 9 12 A G T 4 S+ 0 0 2 6,-0.1 -1,-0.3 4,-0.1 6,-0.2 0.172 124.0 84.2 178.3 38.4 -9.4 -91.2 -53.3 10 13 A V T 4 S+ 0 0 0 -3,-0.5 -3,-0.1 118,-0.1 -2,-0.1 0.481 109.7 18.6-123.0 -18.1 -9.7 -91.5 -49.5 11 14 A L S < S+ 0 0 0 -4,-0.7 36,-0.9 1,-0.3 2,-0.3 0.107 131.0 44.4-138.3 16.6 -13.4 -92.2 -49.2 12 15 A A E S-E 46 0B 0 34,-0.3 -1,-0.3 -5,-0.2 34,-0.2 -0.920 77.8-130.8-163.4 134.5 -14.0 -93.3 -52.8 13 16 A L E S+E 45 0B 39 32,-2.2 32,-3.0 -2,-0.3 2,-0.2 -0.990 79.4 52.6-149.9 152.0 -12.1 -95.6 -55.1 14 17 A P S S- 0 0 80 0, 0.0 30,-0.1 0, 0.0 29,-0.0 0.396 86.8-143.4 -53.3 145.0 -10.9 -96.0 -57.8 15 18 A S 0 0 38 -2,-0.2 29,-0.1 -6,-0.2 -6,-0.1 0.799 360.0 360.0 -57.7-119.4 -9.2 -92.7 -57.1 16 19 A I 0 0 111 -7,-0.1 -1,-0.1 -3,-0.0 -7,-0.1 -0.291 360.0 360.0-176.3 360.0 -8.6 -90.3 -60.0 17 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 18 48 A G 0 0 69 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-167.8 -4.5 -73.7 -64.0 19 49 A P > + 0 0 104 0, 0.0 3,-1.8 0, 0.0 4,-0.2 0.929 360.0 41.2 -83.9 -53.5 -7.8 -72.8 -65.8 20 50 A T T 3> S+ 0 0 68 1,-0.3 4,-0.9 2,-0.2 8,-0.0 0.405 96.7 84.1 -73.7 5.4 -9.9 -75.8 -64.8 21 51 A E H 3> S+ 0 0 57 1,-0.2 4,-0.6 2,-0.2 -1,-0.3 0.428 88.1 53.7 -81.2 -2.9 -8.1 -75.1 -61.5 22 52 A Q H <>>S+ 0 0 65 -3,-1.8 4,-1.8 2,-0.2 5,-1.3 0.520 92.4 68.8-102.9 -18.4 -11.1 -72.7 -61.4 23 53 A L H 45S+ 0 0 18 2,-0.2 49,-0.5 1,-0.2 -2,-0.2 0.877 101.9 48.5 -66.2 -36.4 -13.4 -75.6 -62.0 24 54 A M H <5S+ 0 0 58 -4,-0.9 -1,-0.2 1,-0.2 -2,-0.2 0.932 108.5 52.2 -65.6 -49.1 -12.3 -76.7 -58.5 25 55 A K H <5S- 0 0 26 -4,-0.6 77,-0.5 74,-0.1 -2,-0.2 0.764 114.8-116.4 -61.2 -30.3 -12.9 -73.2 -57.1 26 56 A G T <5S+ 0 0 4 -4,-1.8 -3,-0.2 2,-0.2 942,-0.1 0.517 84.0 113.0 108.9 4.0 -16.5 -73.2 -58.5 27 57 A K S + 0 0 89 2,-0.0 3,-1.9 3,-0.0 4,-0.4 0.598 62.8 92.3-136.5 -33.2 -13.2 -89.0 -68.8 38 93 A S T >> S+ 0 0 5 1,-0.3 3,-2.5 2,-0.2 4,-0.6 0.832 78.7 62.5 -33.9 -66.8 -16.7 -88.8 -67.3 39 94 A Q H >> S+ 0 0 93 1,-0.3 3,-1.5 2,-0.2 4,-1.2 0.750 91.2 71.4 -33.8 -39.0 -17.3 -92.5 -66.8 40 95 A A H <> S+ 0 0 39 -3,-1.9 4,-1.0 1,-0.3 -1,-0.3 0.796 91.7 54.5 -53.2 -37.5 -14.4 -92.6 -64.3 41 96 A M H <4 S+ 0 0 2 -3,-2.5 -1,-0.3 -4,-0.4 -2,-0.2 0.701 108.9 50.7 -72.0 -19.5 -16.3 -90.6 -61.6 42 97 A A H << S+ 0 0 47 -3,-1.5 -2,-0.2 -4,-0.6 -1,-0.2 0.698 100.6 61.3 -89.7 -24.3 -19.1 -93.2 -61.8 43 98 A A H < S+ 0 0 67 -4,-1.2 -2,-0.2 -3,-0.2 2,-0.2 0.849 88.7 85.2 -72.0 -35.0 -16.8 -96.2 -61.4 44 99 A R < - 0 0 13 -4,-1.0 2,-0.2 -30,-0.1 3,-0.0 -0.447 58.4-179.2 -73.9 141.0 -15.6 -95.2 -58.0 45 100 A S E -E 13 0B 70 -32,-3.0 -32,-2.2 -2,-0.2 -2,-0.0 -0.693 38.5 -56.1-128.1-179.6 -17.6 -96.1 -54.8 46 101 A I E -E 12 0B 20 -34,-0.2 2,-1.4 -2,-0.2 -34,-0.3 -0.301 41.2-130.0 -65.5 143.7 -17.4 -95.5 -51.1 47 102 A N >> - 0 0 13 -36,-0.9 3,-2.1 1,-0.2 4,-1.7 -0.604 31.0-170.2 -93.6 70.6 -14.2 -96.7 -49.3 48 103 A R H 3> S+ 0 0 118 -2,-1.4 4,-3.3 1,-0.3 -1,-0.2 0.765 76.3 52.8 -31.5 -60.1 -16.2 -98.6 -46.6 49 104 A P H 3> S+ 0 0 43 0, 0.0 4,-3.1 0, 0.0 -1,-0.3 0.844 114.0 47.4 -54.2 -29.7 -13.4 -99.5 -44.2 50 105 A M H <> S+ 0 0 0 -3,-2.1 4,-1.4 2,-0.3 -2,-0.2 0.905 109.4 50.5 -75.2 -44.4 -12.5 -95.8 -44.2 51 106 A L H X S+ 0 0 8 -4,-1.7 4,-2.1 2,-0.2 5,-0.3 0.875 112.1 51.3 -60.1 -33.3 -16.1 -94.8 -43.7 52 107 A Q H X S+ 0 0 52 -4,-3.3 4,-2.5 -5,-0.3 -2,-0.3 1.000 102.7 55.8 -63.3 -63.0 -16.0 -97.3 -40.9 53 108 A A H X S+ 0 0 1 -4,-3.1 4,-1.3 1,-0.2 -1,-0.2 0.731 109.9 52.0 -40.1 -26.6 -12.9 -95.7 -39.5 54 109 A A H X S+ 0 0 0 -4,-1.4 4,-3.0 2,-0.2 3,-0.3 0.982 106.0 45.5 -78.1 -63.1 -15.0 -92.5 -39.4 55 110 A I H X S+ 0 0 17 -4,-2.1 4,-3.4 1,-0.2 5,-0.3 0.827 108.1 67.2 -48.1 -31.0 -18.2 -93.6 -37.6 56 111 A A H X S+ 0 0 30 -4,-2.5 4,-2.9 -5,-0.3 -1,-0.2 0.981 109.0 30.8 -51.4 -67.0 -15.6 -95.2 -35.3 57 112 A L H X>S+ 0 0 2 -4,-1.3 4,-0.9 -3,-0.3 5,-0.6 0.930 116.1 60.4 -58.8 -49.3 -14.3 -91.8 -34.1 58 113 A K H ><5S+ 0 0 60 -4,-3.0 3,-0.9 1,-0.3 4,-0.4 0.903 112.2 39.2 -44.5 -50.6 -17.7 -90.2 -34.6 59 114 A K H 3<5S+ 0 0 145 -4,-3.4 -1,-0.3 -5,-0.2 -2,-0.2 0.926 110.6 60.9 -66.0 -45.2 -19.0 -92.7 -32.0 60 115 A K H 3<5S- 0 0 85 -4,-2.9 -1,-0.2 -5,-0.3 -2,-0.2 0.500 127.4 -93.1 -61.9 -5.6 -15.9 -92.3 -29.9 61 116 A G T <<5S+ 0 0 56 -4,-0.9 2,-0.2 -3,-0.9 -3,-0.2 0.933 81.8 124.1 90.9 55.9 -16.5 -88.6 -29.4 62 117 A F < - 0 0 43 -5,-0.6 2,-0.6 -4,-0.4 -60,-0.3 -0.680 62.4-109.5-129.7-176.0 -14.7 -86.8 -32.2 63 118 A T E -a 2 0A 51 -62,-2.0 -60,-2.5 -2,-0.2 2,-0.1 -0.937 35.7-163.6-125.7 104.7 -15.6 -84.4 -34.9 64 119 A T E +a 3 0A 0 -2,-0.6 29,-1.5 -62,-0.2 30,-0.7 -0.409 17.3 155.5 -83.5 164.5 -15.4 -86.0 -38.3 65 120 A C E -ac 4 94A 1 -62,-1.4 -60,-1.9 27,-0.2 2,-0.4 -0.966 34.8-124.4-179.4 164.7 -15.3 -84.1 -41.6 66 121 A I E -ac 5 95A 2 28,-1.8 30,-3.0 -2,-0.3 2,-0.5 -0.988 14.0-178.5-128.3 129.4 -14.4 -83.9 -45.2 67 122 A V + 0 0 6 -62,-1.1 2,-0.3 -2,-0.4 30,-0.2 -0.876 27.6 161.8-124.8 92.0 -12.2 -81.2 -46.9 68 123 A T - 0 0 6 -2,-0.5 30,-2.7 28,-0.2 2,-1.5 -0.753 51.7-113.5-116.5 163.4 -12.1 -82.1 -50.5 69 124 A N - 0 0 11 -2,-0.3 28,-0.1 28,-0.2 35,-0.1 -0.704 56.4-179.0 -90.9 80.7 -11.3 -80.3 -53.8 70 125 A N - 0 0 13 -2,-1.5 2,-0.2 26,-0.2 -44,-0.1 0.319 17.7-163.8 -65.1-163.2 -14.9 -80.5 -55.0 71 126 A W - 0 0 35 -46,-0.1 2,-0.6 -45,-0.1 -47,-0.1 -0.837 30.9 -98.1 177.1 149.8 -16.5 -79.4 -58.3 72 127 A L - 0 0 1 -49,-0.5 2,-0.8 -44,-0.5 -42,-0.8 -0.742 34.6-153.8 -88.0 117.8 -20.0 -78.8 -59.5 73 128 A D + 0 0 2 -2,-0.6 5,-0.1 -44,-0.2 -44,-0.0 -0.791 34.1 153.8 -99.7 101.3 -21.4 -81.8 -61.4 74 129 A D + 0 0 6 -2,-0.8 -1,-0.1 760,-0.1 -45,-0.0 -0.134 41.6 134.5-108.3 31.4 -24.1 -81.0 -63.9 75 130 A G S > S- 0 0 5 1,-0.1 3,-0.6 2,-0.1 4,-0.1 0.032 74.0-105.2 -70.7-177.2 -23.0 -84.1 -65.9 76 131 A D T 3 S+ 0 0 131 1,-0.2 3,-0.1 2,-0.1 -1,-0.1 0.641 120.7 37.7 -85.7 -15.7 -25.3 -86.7 -67.3 77 132 A K T 3 S+ 0 0 65 1,-0.1 4,-0.4 2,-0.1 -1,-0.2 -0.379 73.2 119.2-132.1 53.1 -24.3 -89.1 -64.6 78 133 A R X> + 0 0 16 -3,-0.6 4,-1.8 1,-0.2 3,-0.6 0.765 55.0 87.7 -86.1 -28.4 -24.0 -86.9 -61.5 79 134 A D H 3> S+ 0 0 67 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.843 83.6 58.9 -34.0 -50.1 -26.7 -88.9 -59.7 80 135 A S H 3> S+ 0 0 22 1,-0.2 4,-2.5 2,-0.2 5,-0.3 0.943 102.9 49.4 -44.8 -64.3 -23.9 -91.2 -58.5 81 136 A L H <> S+ 0 0 7 -3,-0.6 4,-3.6 -4,-0.4 -1,-0.2 0.879 108.3 57.1 -43.4 -47.1 -22.1 -88.4 -56.7 82 137 A A H X S+ 0 0 0 -4,-1.8 4,-4.7 2,-0.2 5,-0.3 0.959 107.4 44.9 -49.7 -62.9 -25.4 -87.5 -55.1 83 138 A Q H X S+ 0 0 106 -4,-2.1 4,-1.4 1,-0.2 -2,-0.2 0.909 116.4 45.9 -49.6 -51.8 -25.9 -90.9 -53.6 84 139 A M H X S+ 0 0 8 -4,-2.5 4,-2.8 2,-0.2 5,-0.3 0.938 117.9 44.2 -57.8 -46.7 -22.4 -91.2 -52.4 85 140 A M H X S+ 0 0 25 -4,-3.6 4,-2.2 -5,-0.3 -2,-0.2 0.929 113.1 49.5 -62.8 -47.9 -22.6 -87.6 -51.1 86 141 A C H < S+ 0 0 14 -4,-4.7 4,-0.4 -5,-0.2 -1,-0.2 0.654 114.0 49.9 -66.4 -17.1 -26.0 -88.2 -49.6 87 142 A E H >< S+ 0 0 27 -4,-1.4 3,-0.6 -5,-0.3 -2,-0.2 0.895 111.6 42.6 -87.7 -46.8 -24.6 -91.3 -48.0 88 143 A L H >< S+ 0 0 0 -4,-2.8 3,-2.8 1,-0.2 -2,-0.2 0.826 97.8 84.8 -66.6 -30.1 -21.5 -89.9 -46.4 89 144 A S G >< S+ 0 0 19 -4,-2.2 3,-1.2 1,-0.3 -1,-0.2 0.833 84.2 52.6 -33.9 -58.5 -23.6 -86.9 -45.3 90 145 A Q G < S+ 0 0 42 -3,-0.6 -1,-0.3 -4,-0.4 -2,-0.1 0.589 103.7 58.1 -63.6 -13.1 -24.8 -88.6 -42.2 91 146 A H G < S+ 0 0 27 -3,-2.8 2,-0.3 -4,-0.2 -1,-0.3 0.054 98.4 58.3-112.1 28.9 -21.4 -89.4 -40.9 92 147 A F < - 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0 0 44 -2,-2.9 2,-0.3 6,-0.1 -2,-0.3 -0.390 57.0-163.3 -74.8 147.1 -10.4 -71.8 -52.1 104 159 A I > - 0 0 8 -2,-0.1 3,-2.3 -35,-0.1 6,-0.2 -0.949 30.0 -48.3-132.9 152.7 -8.9 -75.2 -53.1 105 160 A K T 3 S+ 0 0 8 1,-0.3 29,-0.1 -2,-0.3 -37,-0.0 -0.262 115.0 15.0 -58.6 142.1 -6.2 -77.5 -51.9 106 161 A P T 3 S+ 0 0 58 0, 0.0 -1,-0.3 0, 0.0 5,-0.0 -0.874 89.9 112.6-100.7 28.3 -3.4 -76.9 -51.2 107 162 A E X - 0 0 74 -3,-2.3 3,-2.9 1,-0.2 4,-0.4 -0.420 68.1-133.4 -61.5 103.2 -3.9 -73.1 -51.0 108 163 A P T 3> S+ 0 0 80 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.546 98.1 72.5 -30.8 -24.7 -3.4 -72.4 -47.2 109 164 A Q H 3> S+ 0 0 64 2,-0.2 4,-1.4 1,-0.2 -6,-0.1 0.846 93.8 53.2 -68.9 -32.2 -6.5 -70.2 -47.1 110 165 A I H X> S+ 0 0 1 -3,-2.9 4,-1.3 -6,-0.2 3,-0.8 0.983 109.0 49.3 -62.2 -57.3 -8.7 -73.2 -47.4 111 166 A Y H >> S+ 0 0 8 -4,-0.4 4,-1.5 1,-0.3 3,-0.6 0.880 108.8 51.1 -48.3 -47.8 -7.0 -74.9 -44.4 112 167 A N H 3X S+ 0 0 92 -4,-2.1 4,-1.5 1,-0.2 -1,-0.3 0.851 106.1 58.4 -61.3 -31.5 -7.3 -71.8 -42.3 113 168 A F H S+ 0 0 13 -4,-1.5 4,-2.5 1,-0.3 5,-1.6 0.859 112.6 61.2 -41.2 -39.3 -9.9 -75.0 -38.3 116 171 A D H 3<5S+ 0 0 114 -4,-1.5 -1,-0.3 -5,-0.3 -2,-0.2 0.908 112.9 31.4 -54.6 -51.9 -11.8 -71.7 -38.3 117 172 A T H <<5S+ 0 0 44 -4,-1.6 -2,-0.2 -3,-1.1 -1,-0.2 0.839 119.5 55.6 -77.3 -33.1 -15.2 -73.4 -38.6 118 173 A L H <5S- 0 0 15 -4,-3.8 -2,-0.2 -5,-0.2 -3,-0.2 0.767 99.3-138.9 -69.2 -27.0 -14.0 -76.5 -36.7 119 174 A K T <5 + 0 0 186 -4,-2.5 2,-0.3 -5,-0.4 -3,-0.2 0.930 58.1 125.5 66.4 47.0 -12.9 -74.2 -33.8 120 175 A A < - 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