==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=22-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE(NAD(A)-CHOH(D)) 04-JAN-93 3HUD . COMPND 2 MOLECULE: ALCOHOL DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.D.HURLEY,W.F.BOSRON,J.A.HAMILTON,L.M.AMZEL . 748 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 28171.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 521 69.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 71 9.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 95 12.7 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 0.3 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 . 56 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 101 13.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 135 18.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 2.8 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 7 0 0 3 0 4 4 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 2 2 5 4 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 . 4 5 6 1 1 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 ANTIPARALLEL BRIDGES PER LADDER . 2 2 0 0 0 3 0 0 0 0 1 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 S 0 0 156 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-106.8 16.7 14.1 3.0 2 2 A T > + 0 0 45 72,-0.1 3,-2.2 3,-0.0 73,-0.1 0.715 360.0 119.9-109.7 -30.5 15.3 10.8 1.6 3 3 A A T 3 S+ 0 0 51 1,-0.2 3,-0.1 71,-0.2 72,-0.0 -0.025 75.9 28.3 -40.6 125.8 17.8 9.6 -0.9 4 4 A G T 3 S+ 0 0 66 1,-0.5 -1,-0.2 27,-0.0 2,-0.2 -0.230 114.1 63.3 113.8 -43.9 19.2 6.2 -0.0 5 5 A K S < S- 0 0 122 -3,-2.2 -1,-0.5 1,-0.1 2,-0.2 -0.481 97.3 -84.0-103.6 177.9 16.3 5.0 1.9 6 6 A V - 0 0 77 -2,-0.2 2,-0.4 -3,-0.1 23,-0.2 -0.549 33.7-140.8 -83.1 151.1 12.8 4.3 0.6 7 7 A I E -A 28 0A 14 21,-2.1 21,-2.1 -2,-0.2 2,-0.5 -0.922 4.5-153.0-114.8 142.5 10.1 7.0 0.2 8 8 A K E +A 27 0A 112 -2,-0.4 2,-0.2 19,-0.2 19,-0.2 -0.982 36.6 142.4-111.5 122.7 6.5 6.3 1.0 9 9 A C E -A 26 0A 7 17,-1.3 17,-2.6 -2,-0.5 2,-0.1 -0.755 45.4 -84.1-146.8-170.2 4.2 8.6 -1.0 10 10 A K E +A 25 0A 62 15,-0.2 138,-1.1 -2,-0.2 2,-0.3 -0.424 37.6 167.2 -97.7-179.5 0.8 8.7 -2.8 11 11 A A E -AB 24 147A 0 13,-0.8 13,-2.3 136,-0.2 2,-0.6 -0.914 40.7-110.7-178.6 164.0 -0.2 7.6 -6.4 12 12 A A E -A 23 0A 0 134,-1.2 53,-0.4 11,-0.3 11,-0.3 -0.907 42.9-161.4-113.1 91.3 -3.4 7.0 -8.5 13 13 A V E -A 22 0A 0 9,-3.4 9,-2.5 -2,-0.6 2,-0.6 -0.584 13.0-146.4 -79.8 136.3 -3.3 3.1 -9.0 14 14 A L B +C 63 0B 0 49,-3.0 49,-2.9 -2,-0.3 7,-0.1 -0.929 27.4 162.3-104.8 122.6 -5.2 1.3 -11.7 15 15 A W + 0 0 60 -2,-0.6 2,-0.4 5,-0.5 -1,-0.1 0.743 63.0 27.9-107.0 -39.6 -6.3 -2.1 -10.5 16 16 A E S > S- 0 0 108 4,-0.3 3,-1.3 3,-0.1 -1,-0.3 -0.991 81.7-111.5-132.7 137.9 -9.1 -3.1 -12.9 17 17 A V T 3 S+ 0 0 56 -2,-0.4 37,-0.2 1,-0.3 36,-0.1 -0.410 107.8 20.6 -64.6 144.5 -9.8 -2.2 -16.5 18 18 A K T 3 S+ 0 0 148 35,-2.7 -1,-0.3 1,-0.3 36,-0.1 0.724 106.1 112.8 61.9 31.4 -12.9 0.0 -16.7 19 19 A K < - 0 0 103 -3,-1.3 -1,-0.3 34,-0.2 -3,-0.1 -0.932 69.1-103.5-128.8 144.4 -12.5 0.9 -13.1 20 20 A P - 0 0 97 0, 0.0 -5,-0.5 0, 0.0 -4,-0.3 0.006 43.6 -83.9 -57.3 173.1 -11.7 4.2 -11.4 21 21 A F - 0 0 19 -7,-0.1 2,-0.6 -6,-0.1 -7,-0.2 -0.600 27.4-147.0 -86.7 141.8 -8.4 5.3 -9.9 22 22 A S E -A 13 0A 33 -9,-2.5 -9,-3.4 -2,-0.3 2,-0.8 -0.925 5.3-154.4-108.4 110.6 -7.2 4.5 -6.4 23 23 A I E +A 12 0A 59 -2,-0.6 -11,-0.3 -11,-0.3 2,-0.2 -0.826 39.5 162.5 -83.9 110.8 -5.1 7.3 -4.9 24 24 A E E -A 11 0A 27 -13,-2.3 -13,-0.8 -2,-0.8 2,-0.4 -0.707 47.0 -98.7-126.6 176.8 -3.1 5.2 -2.4 25 25 A D E +A 10 0A 76 -2,-0.2 2,-0.3 -15,-0.2 -15,-0.2 -0.798 48.9 174.3 -90.7 141.4 0.0 5.1 -0.3 26 26 A V E -A 9 0A 0 -17,-2.6 -17,-1.3 -2,-0.4 2,-0.5 -0.858 31.7-121.0-140.0 173.4 2.8 3.2 -2.0 27 27 A E E -A 8 0A 64 104,-2.5 2,-0.7 -2,-0.3 104,-0.4 -0.937 21.2-161.8-123.6 107.5 6.5 2.5 -1.4 28 28 A V E -A 7 0A 0 -21,-2.1 -21,-2.1 -2,-0.5 102,-0.2 -0.800 18.3-142.3 -95.3 114.2 8.9 3.7 -4.1 29 29 A A - 0 0 35 100,-1.9 -23,-0.1 -2,-0.7 -24,-0.1 -0.482 27.9 -71.3 -79.3 144.1 12.2 2.0 -3.8 30 30 A P - 0 0 40 0, 0.0 -1,-0.1 0, 0.0 2,-0.1 0.176 51.6 -96.2 -29.3 131.7 15.8 3.4 -4.3 31 31 A P - 0 0 25 0, 0.0 47,-0.2 0, 0.0 3,-0.1 -0.298 38.1-147.1 -54.2 120.5 17.4 4.3 -7.7 32 32 A K > - 0 0 115 1,-0.2 3,-1.3 45,-0.1 45,-0.1 -0.202 44.1 -60.0 -79.2 178.2 19.5 1.5 -9.1 33 33 A A T 3 S+ 0 0 34 1,-0.3 -1,-0.2 44,-0.2 46,-0.1 -0.377 125.7 12.4 -63.0 143.5 22.6 2.2 -11.2 34 34 A Y T 3 S+ 0 0 148 44,-1.8 120,-2.5 1,-0.2 121,-0.4 0.738 112.4 96.7 58.9 33.8 21.9 4.2 -14.4 35 35 A E E < -E 153 0C 1 -3,-1.3 42,-2.3 118,-0.3 2,-0.3 -0.798 57.9-148.7-136.7 175.0 18.4 5.1 -13.2 36 36 A V E -EF 152 76C 0 116,-2.3 116,-1.9 -2,-0.2 2,-0.5 -0.997 11.6-134.9-152.7 146.1 16.9 8.2 -11.4 37 37 A R E -EF 151 75C 0 38,-1.6 37,-2.2 -2,-0.3 38,-1.2 -0.934 28.2-165.9-106.2 128.5 14.1 9.0 -8.9 38 38 A I E -EF 150 73C 0 112,-2.6 112,-1.6 -2,-0.5 2,-0.5 -0.735 15.2-143.6-110.1 155.2 12.1 12.1 -9.9 39 39 A K E - F 0 72C 87 33,-1.7 33,-2.3 -2,-0.3 110,-0.2 -0.991 28.9-129.3-118.2 127.9 9.7 14.2 -7.8 40 40 A M E + F 0 71C 6 -2,-0.5 31,-0.3 108,-0.4 3,-0.1 -0.418 32.4 171.9 -82.9 157.5 6.7 15.4 -9.8 41 41 A V E S+ 0 0 23 29,-2.5 333,-2.1 1,-0.4 2,-0.3 0.469 73.8 2.9-124.2 -45.4 5.4 18.9 -10.1 42 42 A A E -GF 373 70C 0 28,-1.6 28,-2.6 331,-0.2 -1,-0.4 -0.979 57.5-174.3-153.9 138.1 2.8 18.6 -12.9 43 43 A V E -GF 372 69C 0 329,-1.9 329,-3.0 -2,-0.3 2,-0.4 -0.930 17.3-137.1-127.6 149.4 1.4 15.7 -15.1 44 44 A G E -GF 371 68C 0 24,-2.6 2,-0.8 -2,-0.3 24,-0.6 -0.890 15.7-126.6-114.3 142.6 -1.1 15.8 -18.0 45 45 A I - 0 0 0 325,-1.6 325,-0.4 -2,-0.4 2,-0.3 -0.758 34.5-173.5 -81.5 105.0 -3.9 13.4 -18.7 46 46 A C >> - 0 0 3 -2,-0.8 3,-1.4 323,-0.1 4,-1.0 -0.779 35.5-120.2-100.5 150.8 -3.4 12.1 -22.3 47 47 A R T 34 S+ 0 0 99 -2,-0.3 -1,-0.1 1,-0.2 4,-0.0 0.755 111.4 69.0 -64.6 -16.0 -5.9 9.9 -24.2 48 48 A T T >> S+ 0 0 30 1,-0.2 3,-1.1 2,-0.2 4,-0.5 0.876 99.6 49.5 -66.9 -30.5 -3.1 7.1 -24.4 49 49 A D H X> S+ 0 0 0 -3,-1.4 4,-1.3 1,-0.3 3,-0.6 0.818 107.0 55.7 -74.7 -26.1 -3.5 6.7 -20.6 50 50 A D H 3< S+ 0 0 4 -4,-1.0 -1,-0.3 1,-0.2 4,-0.2 0.428 96.4 66.7 -84.4 1.7 -7.3 6.5 -21.2 51 51 A H H <4>S+ 0 0 22 -3,-1.1 6,-2.3 2,-0.1 5,-1.4 0.723 100.1 48.0 -94.0 -21.0 -6.7 3.6 -23.6 52 52 A V H X<5S+ 0 0 1 -3,-0.6 3,-2.2 -4,-0.5 -2,-0.2 0.946 107.5 53.0 -82.3 -52.6 -5.5 1.3 -20.9 53 53 A V T 3<5S+ 0 0 15 -4,-1.3 -35,-2.7 1,-0.3 -34,-0.2 0.673 115.1 44.3 -59.5 -6.1 -8.4 2.0 -18.5 54 54 A S T 3 5S- 0 0 37 -4,-0.2 -1,-0.3 -37,-0.2 -2,-0.2 0.369 115.7-109.1-117.6 6.7 -10.9 1.1 -21.3 55 55 A G T < 5S+ 0 0 34 -3,-2.2 242,-0.2 2,-0.2 -3,-0.2 0.532 88.5 113.3 81.3 7.5 -9.2 -2.0 -22.6 56 56 A N S - 0 0 10 -42,-2.3 3,-1.5 -2,-0.3 -44,-0.2 -0.303 54.1 -60.3 -77.3 176.8 22.0 6.0 -9.4 78 78 A E T 3 S+ 0 0 157 1,-0.3 -44,-1.8 -47,-0.2 -1,-0.2 -0.248 123.7 8.0 -57.3 138.9 25.8 5.0 -9.8 79 79 A G T 3 S+ 0 0 49 1,-0.2 2,-0.7 -46,-0.1 -1,-0.3 0.700 82.7 148.1 62.9 21.9 27.3 6.4 -13.0 80 80 A V < + 0 0 1 -3,-1.5 -1,-0.2 1,-0.2 -4,-0.1 -0.811 14.3 164.5 -83.3 118.6 24.3 8.5 -13.9 81 81 A T + 0 0 104 -2,-0.7 -1,-0.2 -3,-0.1 -2,-0.1 0.801 51.3 67.2-104.1 -39.3 25.9 11.4 -15.7 82 82 A T S S+ 0 0 56 75,-0.0 2,-0.3 77,-0.0 77,-0.1 0.668 108.8 20.7 -56.2 -31.7 23.4 13.5 -17.7 83 83 A V - 0 0 0 4,-0.1 3,-0.1 76,-0.0 6,-0.0 -0.874 66.2-165.3-136.0 166.5 21.3 14.9 -14.8 84 84 A K > - 0 0 98 -2,-0.3 3,-1.3 1,-0.1 -11,-0.3 -0.857 42.4 -62.7-148.7 167.5 22.1 15.4 -11.1 85 85 A P T 3 S+ 0 0 67 0, 0.0 2,-0.7 0, 0.0 -11,-0.2 -0.086 120.9 28.9 -53.2 156.9 20.0 16.1 -7.9 86 86 A G T 3 S+ 0 0 58 -13,-2.7 -12,-0.1 1,-0.2 -11,-0.0 0.004 94.4 128.9 77.6 -36.8 18.1 19.4 -8.0 87 87 A D < - 0 0 36 -3,-1.3 -14,-2.6 -2,-0.7 2,-0.4 -0.038 59.3-120.1 -53.7 155.8 17.9 19.3 -11.9 88 88 A K E +H 72 0C 46 72,-0.4 72,-1.8 -16,-0.2 2,-0.3 -0.756 38.0 174.8 -98.9 136.7 14.7 19.8 -13.9 89 89 A V E -HI 71 159C 0 -18,-2.6 -18,-2.6 -2,-0.4 70,-0.2 -0.949 31.4-149.3-142.7 163.3 13.6 17.0 -16.1 90 90 A I E - 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0 0 3 550,-0.3 -8,-0.2 575,-0.3 2,-0.1 -0.516 62.7-158.5 -83.8 73.2 11.4 3.9 -31.8 111 111 A C > - 0 0 0 -2,-1.9 3,-2.3 -16,-0.6 2,-1.7 -0.339 24.3-114.3 -59.4 139.4 14.4 2.7 -29.7 112 112 A L T 3 S+ 0 0 72 1,-0.3 -1,-0.1 -2,-0.1 -16,-0.1 0.010 110.1 65.2 -69.4 32.5 14.6 -0.9 -28.8 113 113 A K T 3 S+ 0 0 77 -2,-1.7 -1,-0.3 -18,-0.1 11,-0.1 0.150 76.0 118.9-131.8 1.7 14.1 -0.3 -25.1 114 114 A N < - 0 0 28 -3,-2.3 4,-0.3 -19,-0.1 3,-0.2 -0.452 58.2-146.3 -74.5 149.3 10.5 1.1 -25.5 115 115 A D S S+ 0 0 29 26,-0.4 26,-0.2 -22,-0.2 -1,-0.1 0.041 77.9 88.5-100.5 33.6 7.5 -0.7 -23.9 116 116 A L S S+ 0 0 25 2,-0.1 -1,-0.2 25,-0.1 -22,-0.0 0.918 79.1 53.2 -95.4 -45.5 5.0 0.0 -26.7 117 117 A G S S- 0 0 36 1,-0.3 -2,-0.1 -3,-0.2 -1,-0.0 0.974 134.7 -3.2 -51.6 -65.7 5.4 -2.9 -29.1 118 118 A N S S- 0 0 156 -4,-0.3 -1,-0.3 -59,-0.0 2,-0.2 -0.882 87.1-128.5-135.3 99.8 4.9 -5.6 -26.5 119 119 A P + 0 0 41 0, 0.0 -4,-0.1 0, 0.0 -3,-0.1 -0.306 27.9 176.2 -57.3 118.5 4.5 -4.3 -22.9 120 120 A R - 0 0 145 -2,-0.2 3,-0.1 2,-0.1 -61,-0.0 0.799 32.4-139.7 -85.1 -36.9 6.6 -5.8 -20.1 121 121 A G + 0 0 0 1,-0.2 18,-1.4 18,-0.2 2,-0.1 0.734 68.8 88.5 79.6 27.8 5.4 -3.5 -17.3 122 122 A T S S- 0 0 17 16,-0.2 2,-0.4 6,-0.1 -1,-0.2 -0.342 81.8 -92.2-130.4-158.3 8.9 -3.1 -15.9 123 123 A L > - 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