==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 21-SEP-99 1D1S . COMPND 2 MOLECULE: ALCOHOL DEHYDROGENASE CLASS IV SIGMA CHAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR P.T.XIE,T.D.HURLEY . 1492 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 55861.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 1035 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 136 9.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 203 13.6 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 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 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 . 116 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 179 12.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 275 18.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 40 2.7 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 10 0 1 3 5 8 6 1 2 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 4 12 8 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 . 8 8 16 0 4 0 5 3 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 4 0 4 0 4 0 0 0 0 2 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 G 0 0 112 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 165.7 19.5 3.9 -9.7 2 2 A T > + 0 0 71 72,-0.1 3,-2.3 2,-0.1 2,-0.1 0.669 360.0 113.5 -92.6 -23.1 18.3 5.8 -6.6 3 3 A A T 3 S+ 0 0 61 1,-0.3 3,-0.1 71,-0.1 72,-0.0 -0.314 87.9 11.1 -54.5 118.5 21.6 5.4 -4.7 4 4 A G T 3 S+ 0 0 52 1,-0.4 -1,-0.3 -2,-0.1 2,-0.2 0.175 110.2 99.7 97.2 -15.5 23.1 8.9 -4.3 5 5 A K S < S- 0 0 130 -3,-2.3 -1,-0.4 24,-0.1 2,-0.2 -0.654 84.5 -99.5-103.5 156.8 20.0 10.7 -5.5 6 6 A V - 0 0 78 -2,-0.2 2,-0.5 -3,-0.1 23,-0.2 -0.577 41.1-136.7 -70.5 134.4 17.4 12.4 -3.4 7 7 A I E -A 28 0A 9 21,-2.8 21,-3.4 -2,-0.2 2,-0.5 -0.858 10.6-153.5 -99.4 130.8 14.4 10.0 -3.2 8 8 A K E +A 27 0A 163 -2,-0.5 2,-0.3 19,-0.2 19,-0.2 -0.909 36.9 130.4-102.1 128.2 10.9 11.5 -3.6 9 9 A C E -A 26 0A 8 17,-2.3 17,-3.5 -2,-0.5 2,-0.3 -0.870 52.6 -80.0-156.7-170.5 8.2 9.5 -1.9 10 10 A K E +A 25 0A 95 -2,-0.3 137,-1.7 15,-0.2 138,-0.3 -0.774 38.5 171.3-106.8 154.4 5.2 9.7 0.5 11 11 A A E -AB 24 146A 0 13,-1.5 13,-2.4 -2,-0.3 2,-0.8 -0.972 38.6-110.4-156.3 152.9 5.2 10.0 4.3 12 12 A A E -A 23 0A 0 133,-2.8 53,-0.4 -2,-0.3 2,-0.3 -0.838 44.1-168.2 -91.4 107.7 2.6 10.6 6.9 13 13 A V E -A 22 0A 0 9,-3.0 9,-1.7 -2,-0.8 2,-0.5 -0.723 20.3-151.3-102.5 146.8 3.4 14.1 8.3 14 14 A L B -E 63 0B 0 49,-1.8 49,-1.4 -2,-0.3 7,-0.1 -0.984 6.5-170.7-112.8 116.8 2.1 15.9 11.4 15 15 A W S S- 0 0 72 -2,-0.5 2,-0.3 5,-0.4 -1,-0.1 0.778 72.9 -13.7 -79.8 -23.3 2.2 19.6 10.9 16 16 A E S S- 0 0 112 4,-0.2 3,-0.5 3,-0.1 -1,-0.3 -0.965 85.1 -77.2-168.5 162.8 1.4 20.2 14.6 17 17 A Q S S+ 0 0 66 -2,-0.3 36,-0.2 1,-0.2 37,-0.2 -0.326 108.6 29.6 -69.3 153.9 0.1 18.4 17.7 18 18 A K S S+ 0 0 143 35,-2.6 -1,-0.2 1,-0.2 36,-0.1 0.854 100.7 106.0 63.4 36.6 -3.6 17.6 18.1 19 19 A Q S S- 0 0 73 -3,-0.5 -1,-0.2 34,-0.1 -3,-0.1 -0.994 72.7-110.2-143.4 140.3 -4.0 17.3 14.4 20 20 A P - 0 0 104 0, 0.0 -5,-0.4 0, 0.0 -4,-0.2 -0.172 45.5 -82.0 -68.3 167.7 -4.4 14.3 12.2 21 21 A F - 0 0 38 -7,-0.1 2,-0.4 -6,-0.1 -7,-0.2 -0.139 32.7-151.0 -64.4 162.0 -1.8 13.0 9.7 22 22 A S E -A 13 0A 40 -9,-1.7 -9,-3.0 -11,-0.0 2,-1.0 -0.965 12.0-139.9-139.8 111.7 -1.2 14.4 6.2 23 23 A I E +A 12 0A 62 -2,-0.4 -11,-0.2 -11,-0.2 2,-0.2 -0.693 39.8 172.9 -75.8 103.8 0.1 12.0 3.6 24 24 A E E -A 11 0A 31 -13,-2.4 -13,-1.5 -2,-1.0 2,-0.5 -0.503 39.7-105.3-108.2 174.6 2.5 14.4 1.8 25 25 A E E -A 10 0A 111 -15,-0.2 107,-0.4 -2,-0.2 2,-0.3 -0.908 49.1-179.3 -98.3 127.8 5.2 14.1 -1.0 26 26 A I E -A 9 0A 0 -17,-3.5 -17,-2.3 -2,-0.5 2,-0.5 -0.892 27.5-128.1-131.9 161.6 8.6 14.3 0.7 27 27 A E E -AC 8 130A 55 103,-2.7 103,-1.8 -2,-0.3 2,-0.7 -0.943 15.8-161.4-110.9 127.5 12.3 14.3 -0.3 28 28 A V E -AC 7 129A 0 -21,-3.4 -21,-2.8 -2,-0.5 101,-0.2 -0.930 17.5-140.1-111.3 108.3 14.7 11.9 1.5 29 29 A A - 0 0 31 99,-2.8 -24,-0.1 -2,-0.7 -23,-0.1 -0.160 30.7 -90.1 -60.9 160.3 18.3 13.0 1.1 30 30 A P - 0 0 38 0, 0.0 2,-0.4 0, 0.0 -1,-0.1 -0.318 51.4 -87.3 -70.6 157.6 21.0 10.4 0.5 31 31 A P - 0 0 19 0, 0.0 47,-0.4 0, 0.0 3,-0.1 -0.521 43.3-154.8 -71.4 125.0 22.8 8.7 3.4 32 32 A K > - 0 0 99 -2,-0.4 3,-1.5 1,-0.2 45,-0.1 0.066 52.6 -30.1 -77.9-162.5 25.9 10.7 4.5 33 33 A T T 3 S- 0 0 79 1,-0.3 -1,-0.2 44,-0.2 46,-0.2 -0.265 132.3 -1.7 -58.3 135.6 28.9 9.1 6.4 34 34 A K T 3 S+ 0 0 117 44,-3.0 119,-2.6 1,-0.2 120,-0.3 0.772 107.2 122.1 51.8 34.7 28.0 6.0 8.5 35 35 A E E < -G 152 0C 4 -3,-1.5 42,-3.2 117,-0.2 2,-0.4 -0.802 48.5-149.6-120.6 160.7 24.3 6.3 7.6 36 36 A V E -GH 151 76C 0 115,-2.6 115,-2.0 -2,-0.3 2,-0.5 -0.998 5.8-146.9-136.2 130.6 21.8 3.9 6.0 37 37 A R E -GH 150 75C 0 38,-3.0 37,-1.8 -2,-0.4 38,-1.0 -0.856 25.7-166.1 -96.4 133.3 18.8 4.6 3.8 38 38 A I E -GH 149 73C 0 111,-3.2 111,-1.9 -2,-0.5 2,-0.6 -0.958 21.7-137.1-128.2 142.3 16.0 2.1 4.3 39 39 A K E -GH 148 72C 97 33,-3.5 33,-2.0 -2,-0.4 2,-0.6 -0.832 28.9-131.8 -94.5 117.8 12.9 1.1 2.5 40 40 A I E + H 0 71C 1 107,-2.3 31,-0.2 -2,-0.6 3,-0.1 -0.592 30.8 171.6 -76.2 115.6 10.0 0.5 5.0 41 41 A L E - 0 0 41 29,-1.9 332,-1.5 -2,-0.6 2,-0.3 0.907 68.8 -1.3 -86.6 -50.9 8.2 -2.7 4.3 42 42 A A E -IH 372 70C 2 28,-1.5 28,-2.3 330,-0.2 2,-0.4 -0.997 62.1-175.1-145.6 142.1 5.9 -2.9 7.4 43 43 A T E -IH 371 69C 0 328,-2.4 328,-2.8 -2,-0.3 26,-0.2 -0.992 16.1-136.5-143.8 131.8 5.5 -0.7 10.5 44 44 A G E -IH 370 68C 0 24,-2.3 2,-0.9 -2,-0.4 24,-0.5 -0.468 19.9-120.1 -86.9 157.9 3.4 -1.1 13.7 45 45 A I - 0 0 2 324,-1.7 324,-0.3 -2,-0.1 2,-0.3 -0.835 34.9-169.4 -99.7 98.1 1.3 1.6 15.4 46 46 A C >> - 0 0 7 -2,-0.9 3,-1.4 1,-0.1 4,-0.9 -0.670 31.6-121.3 -88.5 142.5 2.8 1.9 19.0 47 47 A R H 3> S+ 0 0 99 -2,-0.3 4,-0.8 1,-0.3 3,-0.2 0.751 110.3 66.5 -54.6 -27.4 1.0 3.9 21.7 48 48 A T H >> S+ 0 0 20 1,-0.2 4,-1.1 2,-0.2 3,-1.0 0.906 93.6 57.2 -62.5 -40.0 4.1 6.1 22.0 49 49 A D H <> S+ 0 0 0 -3,-1.4 4,-1.1 1,-0.3 3,-0.4 0.868 104.6 53.2 -58.0 -36.9 3.5 7.5 18.4 50 50 A D H 3X S+ 0 0 4 -4,-0.9 4,-2.8 1,-0.2 -1,-0.3 0.749 96.3 68.0 -69.9 -23.3 0.1 8.6 19.6 51 51 A H H S+ 0 0 31 -3,-1.0 5,-1.7 -4,-0.8 4,-1.6 0.909 98.3 51.5 -61.6 -41.5 1.7 10.4 22.5 52 52 A V H <5S+ 0 0 1 -4,-1.1 -1,-0.2 -3,-0.4 -2,-0.2 0.915 110.9 46.7 -61.1 -45.5 3.2 12.9 20.0 53 53 A I H <5S+ 0 0 25 -4,-1.1 -35,-2.6 1,-0.2 -2,-0.2 0.957 113.7 48.3 -60.8 -51.2 -0.2 13.5 18.5 54 54 A K H <5S- 0 0 106 -4,-2.8 -1,-0.2 -37,-0.2 -2,-0.2 0.726 110.8-124.9 -61.1 -27.0 -1.8 14.0 21.9 55 55 A G T <5S+ 0 0 26 -4,-1.6 -3,-0.2 -5,-0.2 -4,-0.1 0.597 78.6 119.6 90.1 13.0 1.0 16.3 22.9 56 56 A T < + 0 0 59 -5,-1.7 240,-1.8 -6,-0.2 2,-0.4 0.293 69.8 59.8 -91.9 10.3 2.0 14.4 26.0 57 57 A M S S- 0 0 38 -6,-0.7 2,-0.1 -5,-0.2 -2,-0.1 -0.997 91.1-116.1-139.4 130.1 5.4 13.8 24.5 58 58 A V + 0 0 85 -2,-0.4 2,-0.3 0, 0.0 -6,-0.1 -0.441 48.1 147.1 -68.2 135.7 7.8 16.6 23.5 59 59 A S - 0 0 27 -2,-0.1 2,-0.2 -7,-0.1 -42,-0.1 -0.953 44.0-113.4-166.8 153.1 8.7 16.9 19.8 60 60 A K - 0 0 94 -2,-0.3 77,-0.1 58,-0.2 -44,-0.0 -0.618 48.7 -93.9 -88.3 150.1 9.6 19.5 17.1 61 61 A F S S+ 0 0 57 -2,-0.2 2,-0.1 75,-0.1 -46,-0.1 -0.927 96.1 37.1-123.6 146.7 7.2 20.1 14.2 62 62 A P S S+ 0 0 16 0, 0.0 75,-2.6 0, 0.0 2,-0.3 0.604 83.9 158.0 -74.5 166.2 6.8 19.1 11.5 63 63 A V B -Ef 14 137B 0 -49,-1.4 -49,-1.8 73,-0.2 2,-0.6 -0.993 41.9-135.2-156.0 155.7 7.8 15.5 12.1 64 64 A I - 0 0 0 73,-2.0 75,-0.3 -2,-0.3 -51,-0.1 -0.957 32.0-168.8-115.8 107.6 7.4 12.0 10.8 65 65 A V + 0 0 0 -2,-0.6 80,-2.0 -53,-0.4 79,-0.9 0.073 35.5 99.4 -83.1-164.5 6.7 9.5 13.6 66 66 A G + 0 0 0 77,-0.2 77,-1.1 78,-0.2 78,-0.9 0.318 25.7 172.9 92.6 135.0 6.7 5.7 13.7 67 67 A H + 0 0 2 -23,-0.4 2,-0.8 76,-0.2 26,-0.3 0.363 53.1 88.5-153.0 -9.2 9.6 3.6 15.0 68 68 A E E +H 44 0C 0 -24,-0.5 -24,-2.3 24,-0.1 2,-0.3 -0.860 65.0 123.7-101.0 100.9 8.5 -0.0 15.1 69 69 A A E -H 43 0C 0 -2,-0.8 2,-0.4 22,-0.4 -26,-0.2 -0.978 53.2-135.7-156.3 167.6 9.4 -1.5 11.6 70 70 A T E +H 42 0C 0 -28,-2.3 -29,-1.9 -2,-0.3 -28,-1.5 -0.975 38.3 165.1-121.7 139.5 11.1 -4.0 9.3 71 71 A G E -HJ 40 89C 0 18,-3.1 18,-2.7 -2,-0.4 2,-0.4 -0.851 34.3-119.0-147.3 179.6 12.9 -2.7 6.2 72 72 A I E -HJ 39 88C 43 -33,-2.0 -33,-3.5 -2,-0.3 2,-0.5 -0.976 37.5-110.0-125.4 137.3 15.3 -3.4 3.4 73 73 A V E +H 38 0C 3 14,-2.2 13,-3.0 -2,-0.4 -35,-0.2 -0.603 31.3 178.8 -73.0 117.4 18.5 -1.4 2.8 74 74 A E E - 0 0 30 -37,-1.8 2,-0.3 -2,-0.5 -1,-0.2 0.953 69.6 -10.0 -79.3 -58.8 18.2 0.9 -0.3 75 75 A S E -H 37 0C 9 -38,-1.0 -38,-3.0 10,-0.1 2,-0.4 -0.988 59.5-139.9-144.4 151.0 21.7 2.5 -0.0 76 76 A I E -H 36 0C 58 -2,-0.3 -40,-0.2 -40,-0.2 3,-0.1 -0.933 22.9-130.2-112.4 134.5 24.6 2.6 2.5 77 77 A G > - 0 0 9 -42,-3.2 3,-1.4 -2,-0.4 -44,-0.2 -0.093 47.5 -59.8 -72.4 177.4 26.6 5.8 3.2 78 78 A E T 3 S+ 0 0 141 -47,-0.4 -44,-3.0 1,-0.2 -1,-0.2 -0.318 121.0 14.9 -63.1 132.3 30.4 6.2 3.2 79 79 A G T 3 S+ 0 0 31 1,-0.3 -1,-0.2 -46,-0.2 -46,-0.1 0.155 82.4 145.7 92.9 -19.5 32.1 4.0 5.8 80 80 A V < + 0 0 15 -3,-1.4 -1,-0.3 -45,-0.2 -4,-0.1 -0.301 13.0 164.5 -57.1 129.3 29.2 1.7 6.6 81 81 A T + 0 0 121 -3,-0.1 -1,-0.1 -47,-0.0 3,-0.1 0.553 59.6 62.5-123.4 -16.3 30.5 -1.9 7.3 82 82 A T S S+ 0 0 60 1,-0.1 2,-0.3 74,-0.0 76,-0.1 0.748 105.4 31.1 -87.6 -25.9 27.6 -3.8 9.0 83 83 A V - 0 0 7 4,-0.0 -1,-0.1 74,-0.0 3,-0.0 -0.960 59.3-161.6-134.9 153.6 25.0 -3.8 6.2 84 84 A K > - 0 0 116 -2,-0.3 3,-2.0 1,-0.1 -11,-0.3 -0.827 45.3 -73.5-127.1 161.5 24.9 -3.7 2.4 85 85 A P T 3 S+ 0 0 75 0, 0.0 -11,-0.2 0, 0.0 3,-0.1 -0.302 120.6 28.6 -55.5 139.5 22.1 -2.8 -0.1 86 86 A G T 3 S+ 0 0 44 -13,-3.0 2,-0.1 1,-0.3 -12,-0.1 0.270 87.3 132.3 94.4 -15.9 19.4 -5.5 -0.1 87 87 A D < - 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