==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 30-MAY-05 1ZUA . COMPND 2 MOLECULE: ALDO-KETO REDUCTASE FAMILY 1 MEMBER B10; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR O.GALLEGO,F.X.RUIZ,A.ARDEVOL,M.DOMINGUEZ,R.ALVAREZ,A.R.DE . 317 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13942.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 207 65.3 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 . 10 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 . 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 . 17 5.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 12.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 85 26.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 0 0 3 2 2 0 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 . 3 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 1 902 X H 0 0 99 0, 0.0 2,-0.6 0, 0.0 275,-0.0 0.000 360.0 360.0 360.0 142.1 -26.6 29.7 -20.1 2 1 X M - 0 0 132 39,-0.1 2,-0.1 276,-0.0 39,-0.1 -0.793 360.0-132.0 -89.8 121.4 -23.7 31.8 -18.9 3 2 X A - 0 0 7 -2,-0.6 272,-0.0 37,-0.5 275,-0.0 -0.469 26.5-108.5 -67.3 145.1 -24.3 33.4 -15.6 4 3 X T - 0 0 78 -2,-0.1 12,-2.8 11,-0.1 2,-0.2 -0.236 38.1-113.9 -61.1 149.5 -23.4 37.2 -15.4 5 4 X F E -A 15 0A 77 10,-0.2 2,-0.4 11,-0.1 -1,-0.1 -0.621 13.6-152.0 -92.4 154.1 -20.4 38.1 -13.3 6 5 X V E -A 14 0A 4 8,-2.1 8,-2.9 -2,-0.2 2,-0.4 -0.998 28.0-128.7-112.1 127.1 -20.1 40.1 -10.2 7 6 X E E -A 13 0A 103 -2,-0.4 6,-0.2 6,-0.2 2,-0.1 -0.619 20.3-146.1 -79.1 131.0 -16.7 41.8 -10.0 8 7 X L > - 0 0 4 4,-3.0 3,-2.2 -2,-0.4 198,-0.1 -0.454 30.9-101.6 -87.2 169.3 -14.7 41.2 -6.8 9 8 X S T 3 S+ 0 0 56 196,-0.4 -1,-0.1 1,-0.3 197,-0.1 0.741 126.0 57.0 -64.5 -18.8 -12.4 43.7 -5.1 10 9 X T T 3 S- 0 0 77 2,-0.1 -1,-0.3 172,-0.0 3,-0.1 0.483 118.8-114.0 -84.1 -7.3 -9.6 41.7 -6.6 11 10 X K S < S+ 0 0 142 -3,-2.2 -2,-0.1 1,-0.3 2,-0.0 0.264 73.6 136.5 79.1 -1.5 -11.0 42.3 -10.1 12 11 X A - 0 0 18 -5,-0.1 -4,-3.0 1,-0.1 2,-0.6 -0.378 56.8-120.2 -66.6 155.4 -11.7 38.5 -10.4 13 12 X K E -A 7 0A 121 -6,-0.2 -6,-0.2 -3,-0.1 -1,-0.1 -0.884 22.3-163.2-106.9 117.7 -15.1 37.7 -11.8 14 13 X M E -A 6 0A 2 -8,-2.9 -8,-2.1 -2,-0.6 29,-0.0 -0.854 25.9-120.2-103.0 118.2 -17.5 35.6 -9.7 15 14 X P E -A 5 0A 5 0, 0.0 -10,-0.2 0, 0.0 246,-0.1 -0.368 18.3-135.4 -59.0 135.5 -20.4 34.0 -11.6 16 15 X I S S+ 0 0 2 -12,-2.8 245,-2.4 244,-0.1 2,-0.4 0.622 88.6 46.9 -72.8 -18.9 -23.7 35.3 -10.1 17 16 X V B S+b 261 0B 0 -13,-0.2 26,-0.6 243,-0.2 25,-0.5 -0.995 70.0 169.1-119.6 134.6 -25.4 31.8 -10.0 18 17 X G E -c 43 0B 0 243,-2.2 2,-0.6 -2,-0.4 26,-0.2 -0.875 36.4-100.3-132.7 170.6 -23.6 28.8 -8.6 19 18 X L E -c 44 0B 1 24,-2.3 26,-2.8 -2,-0.3 245,-0.2 -0.835 30.7-144.3 -94.1 123.5 -24.5 25.2 -7.6 20 19 X G E -cd 45 264B 5 243,-2.0 245,-0.6 -2,-0.6 26,-0.1 -0.548 14.2-174.0 -79.2 151.4 -25.0 24.5 -3.9 21 20 X T > + 0 0 0 24,-0.5 3,-1.4 -2,-0.2 2,-0.4 0.306 36.9 125.3-133.1 5.7 -23.8 21.2 -2.5 22 21 X W T 3 S+ 0 0 74 1,-0.3 -2,-0.1 23,-0.1 28,-0.1 -0.559 88.2 9.5 -68.4 127.9 -24.9 21.0 1.1 23 22 X K T 3 S+ 0 0 53 -2,-0.4 -1,-0.3 1,-0.3 -2,-0.0 0.346 90.2 140.0 83.6 -0.3 -27.0 17.8 1.6 24 23 X S < - 0 0 5 -3,-1.4 -1,-0.3 1,-0.1 5,-0.1 -0.636 53.7-122.5 -77.1 117.4 -26.1 16.5 -1.9 25 24 X P >> - 0 0 46 0, 0.0 4,-2.4 0, 0.0 3,-2.2 -0.224 11.6-113.2 -62.4 143.8 -25.5 12.8 -1.4 26 25 X L T 34 S+ 0 0 93 1,-0.3 26,-0.0 2,-0.2 25,-0.0 -0.685 116.3 44.2 -67.0 129.2 -22.4 10.9 -2.2 27 26 X G T 34 S+ 0 0 65 -2,-0.4 -1,-0.3 -3,-0.1 4,-0.0 0.059 122.7 38.1 114.1 -24.4 -23.9 8.8 -5.0 28 27 X K T <> S+ 0 0 118 -3,-2.2 4,-2.1 3,-0.1 -2,-0.2 0.487 96.0 72.8-123.9 -26.9 -25.7 11.9 -6.5 29 28 X V H X S+ 0 0 0 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.860 92.3 57.4 -71.6 -32.3 -23.5 14.9 -6.2 30 29 X K H > S+ 0 0 49 -5,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.965 111.1 42.9 -61.3 -47.2 -21.0 13.9 -8.9 31 30 X E H > S+ 0 0 114 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.878 110.6 57.0 -62.3 -38.1 -23.7 13.7 -11.5 32 31 X A H X S+ 0 0 2 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.924 108.7 46.1 -59.1 -46.0 -25.3 16.9 -10.2 33 32 X V H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.906 112.7 50.0 -66.0 -38.8 -21.9 18.8 -10.9 34 33 X K H X S+ 0 0 31 -4,-2.2 4,-2.4 2,-0.2 -2,-0.2 0.946 112.8 46.6 -62.8 -45.7 -21.6 17.2 -14.3 35 34 X V H X S+ 0 0 20 -4,-2.9 4,-2.0 1,-0.2 -2,-0.2 0.912 112.6 51.0 -60.3 -45.3 -25.1 18.2 -15.2 36 35 X A H <>S+ 0 0 0 -4,-2.5 5,-2.6 -5,-0.2 4,-0.5 0.951 109.5 48.4 -61.1 -47.5 -24.5 21.7 -13.9 37 36 X I H ><5S+ 0 0 3 -4,-2.7 3,-1.4 1,-0.2 -1,-0.2 0.933 112.2 49.7 -60.1 -42.8 -21.3 22.2 -15.9 38 37 X D H 3<5S+ 0 0 106 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.857 108.3 53.7 -61.0 -34.7 -23.1 21.0 -19.1 39 38 X A T 3<5S- 0 0 19 -4,-2.0 -1,-0.3 -5,-0.2 -2,-0.2 0.446 130.8 -94.2 -81.6 -3.0 -25.9 23.4 -18.4 40 39 X G T < 5S+ 0 0 14 -3,-1.4 -37,-0.5 -4,-0.5 -3,-0.2 0.369 74.2 146.2 107.7 -1.6 -23.4 26.3 -18.1 41 40 X Y < + 0 0 0 -5,-2.6 -1,-0.3 -6,-0.2 -23,-0.1 -0.436 12.4 164.7 -62.3 143.4 -22.7 26.5 -14.4 42 41 X R + 0 0 68 -25,-0.5 33,-2.9 1,-0.1 2,-0.5 0.530 56.2 76.1-129.3 -28.7 -19.1 27.5 -13.6 43 42 X H E -ce 18 75B 0 -26,-0.6 -24,-2.3 31,-0.2 2,-0.4 -0.816 56.9-178.3 -90.0 125.9 -19.5 28.4 -9.8 44 43 X I E -ce 19 76B 0 31,-1.9 33,-2.3 -2,-0.5 2,-0.6 -0.997 16.1-148.6-124.5 126.8 -19.7 25.5 -7.4 45 44 X D E +ce 20 77B 4 -26,-2.8 -24,-0.5 -2,-0.4 2,-0.2 -0.891 29.3 166.6 -99.3 123.6 -20.1 26.1 -3.7 46 45 X C - 0 0 0 31,-2.5 2,-0.3 -2,-0.6 3,-0.1 -0.707 17.6-166.4-126.9 170.7 -18.5 23.5 -1.5 47 46 X A > - 0 0 0 -2,-0.2 3,-1.0 31,-0.2 5,-0.5 -0.931 30.8-128.5-159.5 149.0 -17.5 22.8 2.1 48 47 X Y G > S+ 0 0 44 31,-1.2 3,-1.8 -2,-0.3 5,-0.2 0.905 111.5 55.7 -54.1 -45.8 -15.3 20.4 4.1 49 48 X V G 3 S+ 0 0 15 1,-0.3 -1,-0.3 30,-0.2 31,-0.0 0.702 91.4 71.1 -71.7 -16.3 -18.3 19.7 6.4 50 49 X Y G < S- 0 0 40 -3,-1.0 -1,-0.3 1,-0.1 -27,-0.2 0.715 91.2-149.1 -71.6 -17.1 -20.5 18.7 3.5 51 50 X Q S < S+ 0 0 117 -3,-1.8 -3,-0.1 -4,-0.4 -2,-0.1 0.710 73.1 90.4 56.8 34.1 -18.3 15.5 3.3 52 51 X N >> + 0 0 3 -5,-0.5 4,-1.6 2,-0.1 3,-0.9 0.232 42.1 111.9-136.8 10.2 -18.8 15.2 -0.5 53 52 X E H 3> S+ 0 0 3 -6,-0.3 4,-2.6 1,-0.3 5,-0.2 0.820 71.7 62.6 -62.8 -29.2 -15.9 17.2 -1.9 54 53 X H H 3> S+ 0 0 59 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.879 105.6 46.0 -66.3 -34.0 -14.2 14.2 -3.3 55 54 X E H <> S+ 0 0 33 -3,-0.9 4,-2.1 2,-0.2 -1,-0.2 0.860 110.3 52.8 -74.5 -35.3 -17.1 13.5 -5.6 56 55 X V H X S+ 0 0 0 -4,-1.6 4,-2.4 2,-0.2 5,-0.2 0.940 109.5 51.8 -57.9 -44.3 -17.4 17.1 -6.7 57 56 X G H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 5,-0.2 0.898 106.5 51.7 -59.5 -44.5 -13.6 16.8 -7.5 58 57 X E H X S+ 0 0 55 -4,-1.8 4,-2.4 1,-0.2 -1,-0.2 0.922 110.2 50.0 -56.9 -49.2 -14.2 13.7 -9.6 59 58 X A H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.933 112.7 45.7 -56.4 -49.3 -16.9 15.5 -11.6 60 59 X I H X S+ 0 0 1 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.949 112.6 49.6 -62.9 -43.7 -14.7 18.6 -12.3 61 60 X Q H X S+ 0 0 90 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.912 111.7 48.8 -63.0 -44.8 -11.7 16.5 -13.3 62 61 X E H X S+ 0 0 39 -4,-2.4 4,-2.2 -5,-0.2 -1,-0.2 0.924 111.3 49.8 -61.2 -43.1 -13.7 14.4 -15.7 63 62 X K H <>S+ 0 0 20 -4,-2.4 5,-2.2 2,-0.2 6,-1.0 0.882 111.6 47.7 -64.0 -37.8 -15.3 17.5 -17.3 64 63 X I H ><5S+ 0 0 57 -4,-2.4 3,-1.7 -5,-0.2 -2,-0.2 0.942 112.5 50.8 -66.6 -38.6 -11.9 19.1 -17.7 65 64 X Q H 3<5S+ 0 0 115 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.805 109.4 50.3 -67.7 -31.9 -10.6 15.8 -19.2 66 65 X E T 3<5S- 0 0 97 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.389 113.8-121.0 -83.9 3.9 -13.5 15.7 -21.6 67 66 X K T < 5S+ 0 0 183 -3,-1.7 -3,-0.2 2,-0.2 -2,-0.1 0.707 76.3 129.0 59.4 24.7 -12.7 19.4 -22.7 68 67 X A S > - 0 0 126 -2,-0.3 3,-1.6 -3,-0.1 4,-0.7 -0.859 25.4-122.7-105.8 148.0 -11.4 24.8 -18.6 71 70 X R G >4 S+ 0 0 37 -2,-0.4 3,-1.4 1,-0.3 -1,-0.1 0.877 109.8 61.0 -53.8 -39.9 -10.2 25.3 -15.0 72 71 X E G 34 S+ 0 0 149 1,-0.3 -1,-0.3 3,-0.1 -3,-0.0 0.753 104.0 51.1 -65.5 -21.8 -9.7 29.1 -15.5 73 72 X D G <4 S+ 0 0 89 -3,-1.6 -1,-0.3 2,-0.0 2,-0.2 0.551 95.9 86.0 -91.1 -14.1 -13.5 29.4 -16.3 74 73 X L << - 0 0 3 -3,-1.4 2,-0.4 -4,-0.7 -31,-0.2 -0.604 63.0-155.4 -81.7 158.0 -14.6 27.5 -13.2 75 74 X F E -e 43 0B 10 -33,-2.9 -31,-1.9 -2,-0.2 2,-0.5 -0.928 14.8-172.9-137.7 97.9 -15.1 29.3 -9.9 76 75 X I E -e 44 0B 0 -2,-0.4 31,-1.8 -33,-0.2 32,-1.5 -0.884 2.7-173.7-109.2 123.9 -14.7 26.9 -7.0 77 76 X V E +ef 45 108B 1 -33,-2.3 -31,-2.5 -2,-0.5 2,-0.2 -0.942 7.5 169.0-113.1 135.3 -15.5 28.0 -3.4 78 77 X S E - f 0 109B 0 30,-1.8 32,-2.4 -2,-0.4 2,-0.3 -0.810 19.6-131.7-135.9-176.6 -14.9 26.0 -0.2 79 78 X K E - f 0 110B 0 -2,-0.2 -31,-1.2 30,-0.2 2,-0.6 -0.990 11.2-126.3-144.8 140.8 -15.0 26.8 3.5 80 79 X L E - 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