==== 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 OXIDOREDUCTASE 06-FEB-00 1EF3 . COMPND 2 MOLECULE: ALDOSE REDUCTASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.OKA,Y.MATSUMOTO,S.SUGIYAMA,N.TSURUTA,M.MATSUSHIMA . 630 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26358.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 413 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 69 11.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 20 3.2 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 . 4 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 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 . 33 5.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 89 14.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 171 27.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 2.2 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 0 0 1 0 3 4 3 1 0 4 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 6 3 2 3 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 PARALLEL BRIDGES PER LADDER . 6 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 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 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 A 0 0 87 0, 0.0 3,-0.1 0, 0.0 255,-0.1 0.000 360.0 360.0 360.0-157.3 -20.7 29.5 -35.1 2 2 A S + 0 0 79 1,-0.5 12,-1.5 12,-0.0 13,-0.4 0.375 360.0 25.1-124.2 -3.8 -20.0 29.0 -38.9 3 3 A R E S-A 13 0A 86 10,-0.3 -1,-0.5 11,-0.1 2,-0.2 -0.926 77.3-143.9-162.1 128.8 -17.6 26.1 -38.5 4 4 A L E -A 12 0A 21 8,-3.0 8,-2.3 -2,-0.3 2,-0.6 -0.648 18.3-116.4 -96.1 161.5 -17.6 23.6 -35.6 5 5 A L E -A 11 0A 41 6,-0.3 6,-0.3 -2,-0.2 2,-0.1 -0.884 25.5-151.6-106.8 121.5 -14.5 21.9 -34.0 6 6 A L > - 0 0 6 4,-2.7 3,-2.0 -2,-0.6 2,-1.2 -0.430 33.2-100.5 -84.7 161.5 -14.2 18.1 -34.3 7 7 A N T 3 S+ 0 0 68 173,-0.3 171,-0.2 196,-0.3 -1,-0.1 -0.000 119.7 53.5 -72.4 30.1 -12.4 15.9 -31.7 8 8 A N T 3 S- 0 0 72 -2,-1.2 -1,-0.3 2,-0.2 3,-0.1 0.198 124.0 -92.0-145.6 8.2 -9.3 15.7 -34.0 9 9 A G S < S+ 0 0 29 -3,-2.0 -2,-0.1 1,-0.3 318,-0.0 -0.041 85.6 125.9 103.8 -33.4 -8.6 19.4 -34.6 10 10 A A - 0 0 32 144,-0.1 -4,-2.7 -5,-0.1 2,-0.5 -0.068 53.6-139.7 -56.8 158.0 -10.7 19.8 -37.7 11 11 A K E -A 5 0A 73 -6,-0.3 -6,-0.3 -3,-0.1 -1,-0.1 -0.996 17.2-148.6-126.2 116.5 -13.4 22.5 -38.1 12 12 A M E -A 4 0A 3 -8,-2.3 -8,-3.0 -2,-0.5 29,-0.1 -0.800 23.4-109.2 -94.3 122.4 -16.4 21.2 -39.8 13 13 A P E -A 3 0A 7 0, 0.0 -10,-0.3 0, 0.0 -1,-0.1 -0.302 23.1-137.0 -49.4 127.5 -18.5 23.6 -42.0 14 14 A I S S+ 0 0 2 -12,-1.5 245,-2.4 244,-0.1 2,-0.4 0.752 88.5 43.9 -62.0 -28.5 -21.8 24.3 -40.2 15 15 A L B S+b 259 0B 6 -13,-0.4 25,-0.5 243,-0.2 2,-0.2 -0.965 70.5 175.9-121.6 133.6 -23.8 24.0 -43.4 16 16 A G - 0 0 0 243,-1.8 2,-0.5 -2,-0.4 26,-0.3 -0.735 31.3-109.2-127.6 177.3 -23.3 21.4 -46.0 17 17 A L E -c 42 0B 2 24,-1.7 26,-3.5 -2,-0.2 245,-0.2 -0.948 29.3-142.1-112.9 126.4 -25.0 20.4 -49.3 18 18 A G E -cd 43 262B 5 243,-2.4 245,-0.7 -2,-0.5 26,-0.1 -0.590 14.8-173.0 -84.7 153.9 -26.9 17.1 -49.3 19 19 A T > + 0 0 1 24,-0.7 3,-0.6 -2,-0.2 2,-0.4 0.256 38.5 123.9-130.3 15.3 -26.9 14.9 -52.3 20 20 A W T 3 S+ 0 0 68 1,-0.2 28,-0.1 23,-0.1 -2,-0.1 -0.649 88.8 7.5 -80.0 130.8 -29.4 12.1 -51.7 21 21 A K T 3 S+ 0 0 51 -2,-0.4 -1,-0.2 1,-0.2 243,-0.0 0.123 89.7 133.3 85.3 -16.4 -31.9 12.1 -54.6 22 22 A S < - 0 0 4 -3,-0.6 -1,-0.2 1,-0.1 5,-0.1 -0.520 59.3-127.7 -65.1 114.0 -30.0 14.6 -56.7 23 23 A P >> - 0 0 58 0, 0.0 3,-2.3 0, 0.0 4,-2.1 -0.292 12.5-120.4 -66.2 151.1 -30.0 13.0 -60.1 24 24 A P H 3> S+ 0 0 66 0, 0.0 4,-0.6 0, 0.0 -2,-0.1 0.763 113.0 68.9 -59.1 -25.3 -26.6 12.7 -61.8 25 25 A G H 34 S+ 0 0 73 1,-0.2 -3,-0.0 2,-0.1 4,-0.0 0.565 119.4 17.7 -70.7 -6.6 -28.0 14.8 -64.6 26 26 A Q H <> S+ 0 0 105 -3,-2.3 4,-2.2 3,-0.1 3,-0.2 0.461 99.8 87.4-140.8 -8.8 -28.0 17.7 -62.1 27 27 A V H X S+ 0 0 1 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.879 89.3 56.0 -68.5 -27.8 -25.8 16.9 -59.1 28 28 A T H X S+ 0 0 24 -4,-0.6 4,-1.9 2,-0.2 -1,-0.2 0.841 112.1 38.7 -69.4 -42.6 -22.7 18.4 -61.0 29 29 A E H > S+ 0 0 118 -3,-0.2 4,-3.2 2,-0.2 5,-0.3 0.886 114.3 59.4 -73.5 -37.3 -24.1 21.8 -61.6 30 30 A A H X S+ 0 0 3 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.941 110.4 39.2 -52.9 -56.5 -25.7 21.5 -58.1 31 31 A V H X S+ 0 0 0 -4,-2.9 4,-2.9 2,-0.2 -1,-0.2 0.954 114.6 53.3 -60.2 -53.1 -22.3 21.1 -56.5 32 32 A K H X S+ 0 0 22 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.913 112.0 45.1 -46.9 -53.3 -20.6 23.7 -58.7 33 33 A V H X S+ 0 0 25 -4,-3.2 4,-2.5 2,-0.2 -1,-0.2 0.929 111.3 54.4 -59.3 -43.0 -23.2 26.3 -57.9 34 34 A A H X>S+ 0 0 0 -4,-2.3 5,-2.2 -5,-0.3 4,-2.0 0.934 108.5 48.3 -56.7 -48.8 -23.0 25.4 -54.2 35 35 A I H <5S+ 0 0 1 -4,-2.9 3,-0.5 1,-0.2 -2,-0.2 0.961 111.4 49.7 -56.1 -54.1 -19.2 26.0 -54.2 36 36 A D H <5S+ 0 0 94 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.869 109.0 53.2 -49.7 -48.5 -19.6 29.4 -56.0 37 37 A V H <5S- 0 0 49 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.861 129.4 -95.3 -57.5 -41.7 -22.2 30.4 -53.4 38 38 A G T <5S+ 0 0 23 -4,-2.0 -3,-0.2 -3,-0.5 2,-0.1 0.432 71.8 144.4 139.9 -0.2 -19.9 29.6 -50.6 39 39 A Y < + 0 0 2 -5,-2.2 -1,-0.3 -6,-0.2 -23,-0.1 -0.461 18.8 177.9 -67.8 139.1 -20.5 26.1 -49.4 40 40 A R + 0 0 54 -25,-0.5 33,-0.5 -2,-0.1 2,-0.3 -0.127 62.1 69.1-131.5 37.9 -17.4 24.1 -48.3 41 41 A H - 0 0 0 31,-0.2 -24,-1.7 -29,-0.1 2,-0.4 -0.886 54.9-177.9-160.2 116.1 -19.1 21.0 -47.2 42 42 A I E -ce 17 74B 1 31,-1.2 33,-1.7 -2,-0.3 2,-0.6 -0.968 19.3-140.9-120.5 134.6 -20.8 18.4 -49.4 43 43 A D E +ce 18 75B 4 -26,-3.5 -24,-0.7 -2,-0.4 2,-0.3 -0.895 30.3 171.8-100.9 120.0 -22.5 15.3 -48.0 44 44 A C - 0 0 0 31,-2.5 2,-0.3 -2,-0.6 3,-0.1 -0.817 15.9-176.6-126.7 162.5 -22.1 12.2 -50.0 45 45 A A - 0 0 0 -2,-0.3 5,-0.5 31,-0.2 6,-0.4 -0.973 33.0-127.1-151.2 159.2 -22.8 8.5 -49.9 46 46 A H S > S+ 0 0 30 31,-0.8 3,-1.5 -2,-0.3 5,-0.2 0.910 109.8 55.1 -74.2 -41.6 -22.1 5.4 -52.0 47 47 A V T 3 S+ 0 0 27 1,-0.3 -1,-0.2 30,-0.2 74,-0.1 0.583 91.2 72.0 -69.1 -13.5 -25.7 4.4 -52.0 48 48 A Y T 3 S- 0 0 38 -3,-0.2 -1,-0.3 -28,-0.1 -27,-0.2 0.796 92.0-149.9 -70.1 -25.3 -26.8 7.8 -53.4 49 49 A Q S < S+ 0 0 126 -3,-1.5 -2,-0.1 -4,-0.4 -3,-0.1 0.763 74.4 87.2 61.5 30.7 -25.2 6.6 -56.6 50 50 A N >> + 0 0 3 -5,-0.5 4,-1.3 -27,-0.1 3,-1.2 0.245 45.4 117.2-134.7 9.6 -24.2 10.0 -57.9 51 51 A E H 3> S+ 0 0 3 -6,-0.4 4,-1.4 1,-0.3 -5,-0.1 0.666 75.2 55.4 -51.1 -22.8 -20.8 10.1 -56.1 52 52 A N H 3> S+ 0 0 68 2,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.848 105.6 48.5 -81.5 -39.1 -19.1 10.2 -59.6 53 53 A E H <> S+ 0 0 59 -3,-1.2 4,-0.9 2,-0.2 -2,-0.2 0.657 110.4 53.1 -75.7 -19.5 -21.0 13.3 -60.9 54 54 A V H X S+ 0 0 0 -4,-1.3 4,-2.1 2,-0.2 3,-0.5 0.915 103.1 56.6 -79.1 -48.9 -20.2 15.1 -57.6 55 55 A G H X S+ 0 0 0 -4,-1.4 4,-3.5 1,-0.2 -2,-0.2 0.859 103.3 56.4 -47.5 -41.1 -16.5 14.4 -58.0 56 56 A V H X S+ 0 0 42 -4,-1.2 4,-2.8 2,-0.2 -1,-0.2 0.906 104.9 49.4 -58.9 -48.4 -16.6 16.1 -61.4 57 57 A A H X S+ 0 0 0 -4,-0.9 4,-2.3 -3,-0.5 5,-0.3 0.929 114.7 46.7 -58.0 -44.7 -18.0 19.4 -60.0 58 58 A I H X S+ 0 0 2 -4,-2.1 4,-2.0 2,-0.2 5,-0.2 0.984 112.6 48.2 -60.5 -57.4 -15.2 19.2 -57.3 59 59 A Q H X S+ 0 0 70 -4,-3.5 4,-1.9 1,-0.2 -2,-0.2 0.861 112.7 50.1 -49.6 -44.5 -12.5 18.4 -59.9 60 60 A E H X S+ 0 0 57 -4,-2.8 4,-1.3 2,-0.2 -1,-0.2 0.915 113.1 41.8 -64.4 -50.8 -13.7 21.3 -62.2 61 61 A K H <>S+ 0 0 13 -4,-2.3 5,-2.2 1,-0.2 6,-0.9 0.690 111.5 58.1 -72.0 -22.5 -13.8 24.1 -59.5 62 62 A L H ><5S+ 0 0 45 -4,-2.0 3,-1.8 -5,-0.3 -1,-0.2 0.942 106.9 46.6 -72.2 -44.2 -10.6 22.9 -58.1 63 63 A R H 3<5S+ 0 0 151 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.822 105.6 58.7 -69.5 -25.7 -8.9 23.4 -61.5 64 64 A E T 3<5S- 0 0 91 -4,-1.3 -1,-0.3 -5,-0.1 -2,-0.2 0.331 110.3-127.3 -79.8 4.5 -10.4 26.8 -61.9 65 65 A Q T < 5S+ 0 0 173 -3,-1.8 -3,-0.2 2,-0.2 -2,-0.1 0.890 70.8 133.0 49.1 43.6 -8.6 27.6 -58.7 66 66 A V S > - 0 0 114 -2,-0.3 3,-1.4 -3,-0.1 4,-0.9 -0.820 22.9-123.1-110.4 154.4 -8.6 24.6 -52.7 69 69 A R G >4 S+ 0 0 19 -2,-0.3 3,-0.8 1,-0.3 -1,-0.1 0.905 114.9 67.6 -58.9 -34.4 -8.9 21.0 -51.5 70 70 A E G 34 S+ 0 0 120 1,-0.2 -1,-0.3 3,-0.1 -3,-0.0 0.841 104.2 43.3 -50.8 -36.2 -7.5 22.4 -48.3 71 71 A E G <4 S+ 0 0 80 -3,-1.4 -1,-0.2 2,-0.0 -2,-0.2 0.616 96.9 84.2 -87.3 -25.2 -10.8 24.4 -47.9 72 72 A L << - 0 0 1 -4,-0.9 2,-0.3 -3,-0.8 -31,-0.2 -0.421 59.6-152.5 -79.6 161.9 -13.4 21.8 -48.8 73 73 A F - 0 0 5 -33,-0.5 -31,-1.2 -2,-0.1 2,-0.4 -0.795 18.6-173.2-135.9 86.4 -14.9 19.3 -46.4 74 74 A I E -e 42 0B 0 -2,-0.3 31,-1.5 -33,-0.2 32,-1.2 -0.704 3.7-167.1 -85.4 138.2 -16.0 16.3 -48.4 75 75 A V E +ef 43 106B 2 -33,-1.7 -31,-2.5 -2,-0.4 2,-0.3 -0.973 11.8 167.3-130.7 139.2 -18.0 13.6 -46.6 76 76 A S E - f 0 107B 0 30,-1.7 32,-2.5 -2,-0.4 2,-0.3 -0.901 18.8-136.7-140.6 173.0 -18.9 10.1 -47.5 77 77 A K E - f 0 108B 0 -2,-0.3 -31,-0.8 30,-0.2 2,-0.5 -0.960 18.4-113.5-139.6 150.9 -20.3 6.9 -45.8 78 78 A L E - 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