==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 25-JUL-12 4GA8 . COMPND 2 MOLECULE: ALDO-KETO REDUCTASE FAMILY 1 MEMBER B10; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.COUSIDO-SIAH,F.X.RUIZ FIGUERAS,A.MITSCHLER,A.PODJARNY . 316 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13958.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 213 67.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 36 11.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 8 2.5 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 . 2 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 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 . 15 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 46 14.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 86 27.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 2.5 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 0 0 3 1 2 1 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 1 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 PARALLEL BRIDGES PER LADDER . 2 0 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 0 0 0 0 0 1 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 M 0 0 119 0, 0.0 2,-0.2 0, 0.0 39,-0.1 0.000 360.0 360.0 360.0 -39.6 -39.3 4.2 19.4 2 2 A A - 0 0 9 37,-0.5 272,-0.0 14,-0.1 275,-0.0 -0.507 360.0-110.8 -70.2 149.8 -41.1 4.1 16.1 3 3 A T - 0 0 78 -2,-0.2 12,-2.8 11,-0.1 13,-0.4 -0.130 39.0-118.9 -63.8 173.8 -43.9 1.6 15.8 4 4 A F E -A 14 0A 109 10,-0.3 2,-0.4 11,-0.1 -1,-0.1 -0.802 10.3-147.1-117.4 160.3 -43.3 -1.3 13.4 5 5 A V E -A 13 0A 4 8,-2.1 8,-2.7 -2,-0.3 2,-0.4 -0.999 30.8-127.2-118.7 128.3 -44.9 -2.6 10.3 6 6 A E E -A 12 0A 106 -2,-0.4 6,-0.2 6,-0.2 2,-0.1 -0.623 21.0-146.6 -78.6 126.3 -44.6 -6.4 10.1 7 7 A L > - 0 0 4 4,-2.8 3,-2.7 -2,-0.4 198,-0.1 -0.430 31.0-102.4 -85.5 165.8 -43.1 -7.8 6.9 8 8 A S T 3 S+ 0 0 55 196,-0.4 -1,-0.1 1,-0.3 197,-0.1 0.710 125.2 59.0 -63.0 -18.8 -44.1 -11.1 5.3 9 9 A T T 3 S- 0 0 71 2,-0.1 -1,-0.3 172,-0.0 3,-0.1 0.444 118.2-115.0 -82.0 -3.1 -40.9 -12.6 6.9 10 10 A K S < S+ 0 0 137 -3,-2.7 -2,-0.1 1,-0.3 2,-0.0 0.355 73.5 137.4 74.1 -1.0 -42.3 -11.6 10.3 11 11 A A - 0 0 41 -5,-0.1 -4,-2.8 1,-0.1 2,-0.6 -0.394 56.3-122.3 -66.3 153.8 -39.4 -9.1 10.7 12 12 A K E -A 6 0A 117 -6,-0.2 -6,-0.2 -3,-0.1 -1,-0.1 -0.901 21.1-161.5-106.7 118.9 -40.4 -5.8 12.1 13 13 A M E -A 5 0A 2 -8,-2.7 -8,-2.1 -2,-0.6 29,-0.1 -0.868 26.7-118.1-102.1 119.2 -39.6 -2.7 10.0 14 14 A P E -A 4 0A 5 0, 0.0 -10,-0.3 0, 0.0 -11,-0.1 -0.360 19.8-136.3 -59.3 132.8 -39.6 0.6 12.0 15 15 A I S S+ 0 0 3 -12,-2.8 245,-2.8 244,-0.1 2,-0.5 0.702 88.3 51.0 -72.7 -19.9 -42.4 2.7 10.5 16 16 A V B S+b 260 0B 1 -13,-0.4 26,-0.6 243,-0.2 25,-0.5 -0.975 70.6 171.9-115.7 132.8 -40.3 5.9 10.4 17 17 A G E -c 42 0B 0 243,-2.5 2,-0.6 -2,-0.5 26,-0.3 -0.898 34.6-105.0-132.9 164.4 -36.8 5.9 8.9 18 18 A L E -c 43 0B 1 24,-2.6 26,-2.9 -2,-0.3 245,-0.2 -0.798 29.7-144.3 -92.7 121.5 -34.1 8.5 8.0 19 19 A G E -cd 44 263B 5 243,-2.1 245,-0.6 -2,-0.6 26,-0.1 -0.548 14.2-174.2 -79.9 147.2 -33.7 9.3 4.3 20 20 A T > + 0 0 0 24,-0.7 3,-1.4 -2,-0.2 2,-0.3 0.344 37.3 124.5-126.9 4.4 -30.2 10.0 3.0 21 21 A W T 3 S+ 0 0 75 1,-0.2 -2,-0.0 23,-0.1 28,-0.0 -0.549 87.6 8.6 -68.0 132.6 -30.6 11.1 -0.6 22 22 A K T 3 S+ 0 0 52 -2,-0.3 -1,-0.2 1,-0.3 -2,-0.0 0.388 89.4 138.9 75.4 0.2 -28.9 14.5 -1.1 23 23 A S < - 0 0 5 -3,-1.4 -1,-0.3 1,-0.1 5,-0.1 -0.672 52.7-130.8 -76.9 114.2 -27.4 14.3 2.4 24 24 A P >> - 0 0 48 0, 0.0 4,-2.2 0, 0.0 3,-1.9 -0.240 16.8 -99.1 -70.6 152.4 -23.9 15.7 1.7 25 25 A L T 34 S+ 0 0 95 1,-0.2 26,-0.0 2,-0.2 25,-0.0 -0.490 115.8 38.1 -56.8 135.0 -20.6 14.2 2.8 26 26 A G T 34 S+ 0 0 68 -2,-0.2 -1,-0.2 -3,-0.1 -3,-0.0 0.321 122.1 45.2 97.2 -8.8 -19.6 16.1 5.9 27 27 A K T <> S+ 0 0 121 -3,-1.9 4,-2.1 3,-0.0 -2,-0.2 0.520 95.1 68.3-128.1 -30.6 -23.2 16.3 7.2 28 28 A V H X S+ 0 0 0 -4,-2.2 4,-2.5 1,-0.2 5,-0.2 0.871 94.9 57.4 -69.2 -34.3 -24.7 12.8 6.8 29 29 A K H > S+ 0 0 42 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.959 111.7 42.1 -58.5 -49.5 -22.6 11.2 9.4 30 30 A E H > S+ 0 0 104 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.868 110.9 57.5 -66.0 -35.5 -23.8 13.7 12.0 31 31 A A H X S+ 0 0 2 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.931 109.0 45.0 -59.2 -45.6 -27.3 13.4 10.7 32 32 A V H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.897 113.0 51.0 -66.9 -40.4 -27.3 9.6 11.3 33 33 A K H X S+ 0 0 40 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.948 112.7 45.9 -59.0 -50.3 -25.7 10.0 14.8 34 34 A V H X S+ 0 0 22 -4,-3.0 4,-1.9 1,-0.2 -2,-0.2 0.910 112.7 51.5 -58.6 -44.0 -28.4 12.6 15.7 35 35 A A H X>S+ 0 0 0 -4,-2.6 5,-2.5 -5,-0.2 4,-0.6 0.937 109.2 48.7 -60.1 -48.7 -31.1 10.4 14.3 36 36 A I H ><5S+ 0 0 2 -4,-2.7 3,-1.4 1,-0.2 -2,-0.2 0.936 110.8 51.2 -59.2 -45.4 -30.0 7.3 16.3 37 37 A D H 3<5S+ 0 0 104 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.845 108.2 53.1 -58.2 -34.2 -29.8 9.4 19.5 38 38 A A H 3<5S- 0 0 21 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.562 128.7 -97.3 -82.0 -6.6 -33.4 10.6 18.8 39 39 A G T <<5S+ 0 0 8 -3,-1.4 -37,-0.5 -4,-0.6 -3,-0.2 0.493 72.3 145.1 106.4 3.3 -34.5 7.0 18.5 40 40 A Y < + 0 0 0 -5,-2.5 -1,-0.3 -6,-0.2 -23,-0.1 -0.533 14.1 169.7 -65.2 142.9 -34.6 6.3 14.7 41 41 A R + 0 0 62 -25,-0.5 33,-3.2 -2,-0.2 2,-0.5 0.490 56.7 75.8-127.9 -16.1 -33.6 2.7 14.0 42 42 A H E -ce 17 74B 0 -26,-0.6 -24,-2.6 31,-0.2 2,-0.4 -0.881 57.9-177.2-103.0 121.2 -34.4 2.6 10.3 43 43 A I E -ce 18 75B 0 31,-1.9 33,-2.2 -2,-0.5 2,-0.6 -0.989 15.7-147.3-118.8 129.0 -32.0 4.3 7.9 44 44 A D E +ce 19 76B 3 -26,-2.9 -24,-0.7 -2,-0.4 2,-0.2 -0.860 29.9 164.5 -99.0 120.4 -32.7 4.4 4.1 45 45 A C - 0 0 0 31,-2.6 2,-0.3 -2,-0.6 3,-0.1 -0.689 17.7-166.4-125.2 171.6 -29.5 4.3 2.0 46 46 A A > > - 0 0 0 -2,-0.2 3,-1.0 31,-0.2 5,-0.5 -0.933 31.7-128.4-161.0 147.3 -28.4 3.7 -1.6 47 47 A Y G > 5S+ 0 0 49 31,-1.0 3,-1.7 -2,-0.3 5,-0.2 0.915 112.1 56.8 -50.5 -47.4 -25.3 3.0 -3.6 48 48 A V G 3 5S+ 0 0 17 1,-0.3 -1,-0.2 30,-0.2 74,-0.0 0.698 91.2 69.3 -67.3 -17.0 -26.2 5.9 -5.9 49 49 A Y G < 5S- 0 0 39 -3,-1.0 -1,-0.3 1,-0.1 -2,-0.2 0.683 91.5-147.8 -74.9 -17.1 -26.4 8.4 -3.0 50 50 A Q T < 5S+ 0 0 131 -3,-1.7 -3,-0.1 -4,-0.5 -2,-0.1 0.761 74.8 89.3 60.2 29.6 -22.6 8.1 -2.8 51 51 A N >>< + 0 0 2 -5,-0.5 4,-1.7 2,-0.1 3,-0.7 0.215 41.7 113.0-136.1 11.1 -22.5 8.6 0.9 52 52 A E H 3> S+ 0 0 3 -6,-0.3 4,-2.5 1,-0.2 5,-0.1 0.810 72.6 62.1 -61.2 -30.9 -22.9 5.1 2.4 53 53 A H H 3> S+ 0 0 62 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.900 105.1 46.4 -63.8 -38.1 -19.4 5.1 3.9 54 54 A E H <> S+ 0 0 34 -3,-0.7 4,-2.0 2,-0.2 -1,-0.2 0.893 111.1 52.3 -71.4 -37.2 -20.3 8.1 6.1 55 55 A V H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.915 109.1 51.3 -57.2 -43.1 -23.5 6.4 7.1 56 56 A G H X S+ 0 0 0 -4,-2.5 4,-2.6 43,-0.3 -2,-0.2 0.882 106.3 53.9 -64.2 -38.8 -21.5 3.4 8.0 57 57 A E H X S+ 0 0 61 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.902 109.4 48.3 -60.5 -43.6 -19.1 5.4 10.1 58 58 A A H X S+ 0 0 0 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.920 113.3 46.1 -65.0 -44.8 -22.0 6.8 12.1 59 59 A I H X S+ 0 0 2 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.947 112.5 50.8 -63.8 -46.4 -23.6 3.4 12.7 60 60 A Q H X S+ 0 0 97 -4,-2.6 4,-2.7 1,-0.2 -2,-0.2 0.923 112.2 46.3 -58.1 -47.3 -20.3 1.8 13.7 61 61 A E H X S+ 0 0 42 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.911 111.8 50.3 -64.5 -41.7 -19.5 4.5 16.2 62 62 A K H <>S+ 0 0 20 -4,-2.3 5,-2.4 1,-0.2 6,-1.0 0.870 113.5 46.3 -67.2 -34.7 -23.0 4.5 17.8 63 63 A I H ><5S+ 0 0 56 -4,-2.5 3,-1.8 3,-0.2 -2,-0.2 0.938 111.8 51.1 -67.1 -46.5 -22.8 0.7 18.1 64 64 A Q H 3<5S+ 0 0 118 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.779 110.0 49.6 -62.8 -29.5 -19.2 0.9 19.6 65 65 A E T 3<5S- 0 0 108 -4,-1.9 -1,-0.3 -5,-0.2 -2,-0.2 0.324 115.4-118.9 -94.3 6.9 -20.4 3.5 22.1 66 66 A K T < 5S+ 0 0 184 -3,-1.8 -3,-0.2 2,-0.2 -2,-0.1 0.706 76.4 128.9 63.2 26.2 -23.3 1.2 23.0 67 67 A A S > - 0 0 129 -2,-0.3 3,-1.7 -3,-0.1 4,-0.5 -0.845 26.1-124.0-100.5 145.4 -27.3 -2.7 19.1 70 70 A R G >4 S+ 0 0 37 -2,-0.3 3,-1.4 1,-0.3 -1,-0.1 0.861 110.6 62.1 -50.3 -40.6 -27.1 -3.9 15.4 71 71 A E G 34 S+ 0 0 142 1,-0.3 -1,-0.3 3,-0.1 -3,-0.0 0.711 102.6 49.8 -62.0 -23.7 -30.2 -6.1 16.0 72 72 A D G <4 S+ 0 0 90 -3,-1.7 -1,-0.3 2,-0.0 2,-0.2 0.502 96.4 86.5 -96.4 -6.0 -32.3 -3.0 16.7 73 73 A L << - 0 0 2 -3,-1.4 2,-0.4 -4,-0.5 -31,-0.2 -0.636 61.6-157.5 -90.7 155.5 -31.2 -1.2 13.6 74 74 A F E -e 42 0B 11 -33,-3.2 -31,-1.9 -2,-0.2 2,-0.5 -0.901 13.8-173.1-137.1 98.9 -32.9 -1.7 10.2 75 75 A I E -e 43 0B 0 -2,-0.4 31,-1.9 -33,-0.2 32,-1.5 -0.858 1.3-171.5-106.8 127.2 -30.7 -0.7 7.4 76 76 A V E +ef 44 107B 1 -33,-2.2 -31,-2.6 -2,-0.5 2,-0.3 -0.944 7.8 170.8-117.4 133.4 -32.0 -0.6 3.8 77 77 A S E - f 0 108B 0 30,-2.2 32,-2.6 -2,-0.4 2,-0.4 -0.806 18.9-132.5-132.1-177.5 -30.0 -0.2 0.7 78 78 A K E - f 0 109B 0 -2,-0.3 -31,-1.0 30,-0.2 2,-0.6 -0.988 11.3-126.4-142.7 142.5 -30.6 -0.4 -3.0 79 79 A L E - 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0 0 20 -5,-1.9 -1,-0.2 -6,-0.1 3,-0.1 -0.686 58.9-145.5-109.8 164.8 -22.1 -4.1 8.2 103 103 A S S S+ 0 0 90 1,-0.3 2,-0.3 -2,-0.2 -1,-0.1 0.545 88.1 9.3-102.3 -13.5 -22.1 -7.9 8.1 104 104 A Y - 0 0 38 -7,-0.1 2,-0.3 50,-0.0 -1,-0.3 -0.987 66.7-131.1-158.9 153.8 -25.7 -7.9 6.7 105 105 A L E - g 0 154B 0 48,-2.3 50,-2.3 -2,-0.3 51,-0.2 -0.828 11.2-144.5-101.7 150.6 -28.4 -5.7 5.4 106 106 A D E S+ 0 0 18 -31,-1.9 50,-0.6 -2,-0.3 2,-0.3 0.883 87.1 5.7 -78.2 -41.0 -32.0 -5.8 6.6 107 107 A V E -fg 76 156B 0 -32,-1.5 -30,-2.2 48,-0.2 2,-0.5 -0.985 60.3-164.4-143.9 134.1 -33.5 -5.1 3.2 108 108 A Y E -fg 77 157B 0 48,-1.9 50,-2.0 -2,-0.3 2,-0.3 -0.986 20.6-162.4-116.4 125.5 -31.9 -4.8 -0.3 109 109 A L E -fg 78 158B 0 -32,-2.6 -30,-3.7 -2,-0.5 2,-0.7 -0.763 28.3-120.4-109.7 145.2 -34.1 -3.2 -2.9 110 110 A I E -fg 79 159B 0 48,-1.8 50,-0.9 -2,-0.3 -30,-0.1 -0.800 32.2-152.2 -72.6 120.7 -34.1 -3.0 -6.7 111 111 A H S S+ 0 0 10 -32,-2.2 -1,-0.2 -2,-0.7 -31,-0.2 0.897 71.3 0.1 -71.0 -43.4 -33.8 0.8 -6.9 112 112 A W - 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