==== 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 DEHYDROGENASE 26-JUN-00 1E3W . COMPND 2 MOLECULE: SHORT CHAIN 3-HYDROXYACYL-COA DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR A.J.POWELL,J.A.READ,R.L.BRADY . 1001 7 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33950.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 733 73.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 144 14.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 1.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 69 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 110 11.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 335 33.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 2.0 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 4 0 1 4 0 0 0 4 4 4 1 7 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 0 12 8 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 PARALLEL BRIDGES PER LADDER . 0 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 0 0 0 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 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 7 A S 0 0 111 0, 0.0 27,-0.0 0, 0.0 26,-0.0 0.000 360.0 360.0 360.0 144.3 45.0 19.7 20.8 2 8 A V > + 0 0 2 25,-0.1 3,-2.1 2,-0.1 25,-0.1 0.370 360.0 134.1 -96.5 -0.5 43.9 16.6 22.5 3 9 A K T 3 S+ 0 0 149 1,-0.3 26,-0.3 26,-0.1 25,-0.2 -0.274 76.4 12.5 -54.1 130.7 45.9 14.3 20.2 4 10 A G T 3 S+ 0 0 38 24,-2.7 -1,-0.3 1,-0.3 25,-0.2 0.267 94.4 130.3 85.9 -13.1 47.7 11.7 22.4 5 11 A L < - 0 0 40 -3,-2.1 25,-3.0 19,-0.1 2,-0.6 -0.416 53.9-134.1 -74.2 149.4 45.7 12.4 25.6 6 12 A V E -a 30 0A 2 23,-0.2 74,-2.8 -2,-0.1 75,-1.9 -0.945 25.4-173.1-106.8 122.4 44.2 9.5 27.5 7 13 A A E -ab 31 81A 1 23,-2.7 25,-2.9 -2,-0.6 2,-0.5 -0.932 17.5-157.5-117.4 134.8 40.6 10.1 28.7 8 14 A V E -ab 32 82A 1 73,-2.7 75,-2.6 -2,-0.4 2,-0.6 -0.960 17.1-167.3-104.6 125.3 38.4 8.0 30.9 9 15 A I E > -ab 33 83A 0 23,-2.9 25,-2.5 -2,-0.5 3,-1.1 -0.961 7.9-152.0-122.4 107.2 34.7 8.8 30.2 10 16 A T E 3 S+ab 34 84A 0 73,-2.6 75,-1.1 -2,-0.6 25,-0.2 -0.571 88.5 25.8 -74.7 150.1 32.1 7.6 32.7 11 17 A G T > S+ 0 0 11 23,-2.0 3,-1.5 74,-0.3 7,-0.5 0.636 84.1 147.0 62.8 29.4 28.7 7.0 31.1 12 18 A G T < + 0 0 0 -3,-1.1 9,-0.2 22,-0.9 23,-0.1 0.455 49.2 73.8 -76.3 -11.8 30.7 6.5 27.9 13 19 A A T 3 S+ 0 0 6 21,-0.2 2,-0.3 5,-0.0 -1,-0.3 0.527 106.0 12.7 -78.9 -13.2 28.4 3.9 26.4 14 20 A S S X> S- 0 0 52 -3,-1.5 4,-1.9 25,-0.1 3,-0.8 -0.976 103.7 -6.8-151.9 170.1 25.6 6.4 25.5 15 21 A G H 3> S+ 0 0 15 -2,-0.3 4,-2.4 1,-0.2 5,-0.2 -0.072 117.9 0.9 51.3-131.6 24.5 9.9 25.1 16 22 A L H 3> S+ 0 0 28 2,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.894 134.8 48.8 -63.2 -38.3 26.9 12.7 26.2 17 23 A G H <> S+ 0 0 0 -3,-0.8 4,-2.4 -6,-0.4 -5,-0.3 0.939 112.3 49.6 -71.9 -37.2 29.7 10.5 27.3 18 24 A L H X S+ 0 0 17 -4,-1.9 4,-3.0 -7,-0.5 -1,-0.2 0.919 111.2 49.2 -64.9 -44.7 29.5 8.5 24.0 19 25 A S H X S+ 0 0 18 -4,-2.4 4,-2.5 1,-0.2 -1,-0.2 0.906 109.7 53.1 -64.3 -34.2 29.5 11.7 21.9 20 26 A T H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.906 108.4 48.6 -61.0 -48.4 32.5 12.9 23.9 21 27 A A H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.3 0.877 110.1 52.7 -58.7 -46.2 34.5 9.7 23.2 22 28 A K H X S+ 0 0 96 -4,-3.0 4,-2.6 1,-0.2 -2,-0.2 0.956 112.4 44.4 -58.8 -37.8 33.7 9.9 19.5 23 29 A R H X S+ 0 0 84 -4,-2.5 4,-1.5 2,-0.2 -2,-0.2 0.961 115.6 45.5 -72.8 -44.5 34.9 13.4 19.2 24 30 A L H <>S+ 0 0 1 -4,-2.6 5,-2.9 1,-0.2 3,-0.2 0.920 115.0 47.4 -67.6 -38.6 38.1 12.9 21.3 25 31 A V H ><5S+ 0 0 20 -4,-2.7 3,-2.4 1,-0.2 -1,-0.2 0.914 108.6 54.7 -67.8 -38.4 39.0 9.7 19.5 26 32 A G H 3<5S+ 0 0 63 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.811 108.5 51.5 -65.8 -27.5 38.3 11.4 16.1 27 33 A Q T 3<5S- 0 0 90 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.302 130.1 -93.8 -90.1 9.4 40.9 14.1 17.3 28 34 A G T < 5S+ 0 0 27 -3,-2.4 -24,-2.7 1,-0.3 -3,-0.2 0.629 82.3 128.6 101.4 -6.0 43.6 11.5 18.2 29 35 A A < - 0 0 1 -5,-2.9 2,-0.4 -26,-0.3 -1,-0.3 -0.612 56.2-123.1 -83.1 169.9 42.9 10.9 21.9 30 36 A T E -a 6 0A 18 -25,-3.0 -23,-2.7 -2,-0.2 2,-0.4 -0.872 28.9-161.2-105.2 141.6 42.5 7.5 23.5 31 37 A A E -ac 7 52A 0 20,-2.5 22,-1.7 -2,-0.4 2,-0.6 -0.986 17.0-159.4-131.6 142.4 39.3 6.9 25.4 32 38 A V E -ac 8 53A 0 -25,-2.9 -23,-2.9 -2,-0.4 2,-0.7 -0.939 18.6-146.3-112.1 119.6 38.2 4.4 28.0 33 39 A L E -ac 9 54A 0 20,-2.9 22,-2.8 -2,-0.6 2,-0.6 -0.769 12.9-165.8 -85.3 117.0 34.4 4.0 28.2 34 40 A L E +ac 10 55A 1 -25,-2.5 -23,-2.0 -2,-0.7 -22,-0.9 -0.897 33.0 129.5-108.7 114.2 33.6 3.3 31.8 35 41 A D E - c 0 56A 27 20,-0.9 22,-2.5 -2,-0.6 -25,-0.0 -0.931 60.7 -73.1-156.3 165.8 29.9 2.1 32.0 36 42 A V > - 0 0 51 -2,-0.3 3,-2.2 20,-0.2 5,-0.4 -0.322 44.0-112.8 -70.2 157.4 27.9 -0.7 33.5 37 43 A P T 3 S+ 0 0 83 0, 0.0 5,-0.2 0, 0.0 -1,-0.1 0.828 114.3 60.2 -58.4 -34.0 28.1 -4.2 32.0 38 44 A N T 3 S+ 0 0 158 2,-0.1 -2,-0.0 3,-0.1 2,-0.0 0.541 90.6 90.2 -74.9 -1.7 24.5 -4.1 30.7 39 45 A S S < S- 0 0 28 -3,-2.2 3,-0.4 1,-0.1 4,-0.1 -0.234 94.6-103.9 -80.9 179.8 25.2 -1.0 28.6 40 46 A E S > S+ 0 0 113 1,-0.2 4,-2.7 -27,-0.2 5,-0.3 0.046 78.3 127.7 -91.6 24.5 26.4 -1.1 24.9 41 47 A G H > + 0 0 0 -5,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.833 69.3 46.9 -47.0 -53.8 29.9 -0.2 26.0 42 48 A E H > S+ 0 0 134 -3,-0.4 4,-2.2 2,-0.2 -1,-0.2 0.939 112.8 49.3 -65.3 -44.1 31.6 -3.1 24.2 43 49 A T H > S+ 0 0 67 1,-0.2 4,-2.5 2,-0.2 -2,-0.2 0.888 114.4 45.3 -56.2 -49.1 29.8 -2.5 20.9 44 50 A E H X S+ 0 0 26 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.898 110.5 52.0 -71.2 -29.4 30.5 1.2 21.0 45 51 A A H < S+ 0 0 4 -4,-2.3 4,-0.3 -5,-0.3 7,-0.3 0.873 110.8 49.9 -71.2 -31.3 34.2 0.7 21.9 46 52 A K H >< S+ 0 0 174 -4,-2.2 3,-1.4 1,-0.2 -2,-0.2 0.916 109.6 50.6 -68.0 -47.9 34.5 -1.7 19.0 47 53 A K H 3< S+ 0 0 144 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.866 106.5 55.1 -61.3 -33.4 32.9 0.8 16.6 48 54 A L T 3< S- 0 0 38 -4,-2.0 3,-0.4 1,-0.2 -1,-0.3 0.533 109.2-132.0 -79.0 -5.6 35.2 3.5 17.7 49 55 A G X - 0 0 33 -3,-1.4 3,-1.6 -4,-0.3 -1,-0.2 -0.271 42.3 -33.9 97.0-169.2 38.2 1.4 16.9 50 56 A G T 3 S+ 0 0 67 1,-0.3 -1,-0.2 -3,-0.1 -4,-0.1 0.637 124.3 63.8 -72.0 -14.4 41.5 0.5 18.6 51 57 A N T 3 S+ 0 0 84 -3,-0.4 -20,-2.5 1,-0.1 2,-0.4 0.250 99.2 64.3 -91.7 13.8 42.0 3.8 20.5 52 58 A C E < +c 31 0A 4 -3,-1.6 2,-0.3 -7,-0.3 -20,-0.2 -0.960 62.0 174.6-136.3 126.7 38.8 3.2 22.5 53 59 A I E -c 32 0A 24 -22,-1.7 -20,-2.9 -2,-0.4 2,-0.5 -0.787 26.7-121.5-124.9 160.0 38.2 0.4 24.9 54 60 A F E -c 33 0A 28 -2,-0.3 -20,-0.2 -22,-0.2 -22,-0.1 -0.911 17.9-171.5-102.3 126.3 35.4 -0.5 27.4 55 61 A A E -c 34 0A 2 -22,-2.8 -20,-0.9 -2,-0.5 2,-0.2 -0.896 20.4-140.9-115.9 105.1 36.0 -0.9 31.0 56 62 A P E +c 35 0A 73 0, 0.0 2,-0.3 0, 0.0 -20,-0.2 -0.374 43.6 139.0 -69.3 125.3 32.9 -2.3 32.8 57 63 A A - 0 0 1 -22,-2.5 2,-0.5 -2,-0.2 -2,-0.1 -0.920 50.0-133.5-165.3 144.9 32.4 -0.5 36.1 58 64 A N > - 0 0 60 -2,-0.3 3,-2.5 1,-0.1 7,-0.3 -0.866 24.6-138.7 -99.1 123.7 29.7 1.0 38.3 59 65 A V T 3 S+ 0 0 9 -2,-0.5 62,-0.1 1,-0.3 -1,-0.1 0.699 99.2 64.6 -64.3 -12.9 30.8 4.4 39.5 60 66 A T T 3 S+ 0 0 51 61,-0.1 2,-0.6 62,-0.0 -1,-0.3 0.546 87.9 84.3 -82.9 -2.8 29.5 3.7 43.0 61 67 A S <> - 0 0 30 -3,-2.5 4,-2.5 1,-0.2 5,-0.3 -0.823 60.4-162.0-101.4 121.0 32.0 0.9 43.5 62 68 A E H > S+ 0 0 70 -2,-0.6 4,-2.8 1,-0.2 5,-0.2 0.934 93.9 49.5 -58.9 -46.9 35.5 1.7 44.7 63 69 A K H > S+ 0 0 168 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.897 113.2 45.1 -61.9 -47.1 36.8 -1.7 43.5 64 70 A E H > S+ 0 0 85 2,-0.2 4,-2.2 -6,-0.2 -1,-0.2 0.892 114.5 47.1 -68.8 -37.9 35.3 -1.5 40.1 65 71 A V H X S+ 0 0 0 -4,-2.5 4,-2.5 -7,-0.3 5,-0.2 0.942 112.0 51.2 -69.5 -39.7 36.4 2.1 39.4 66 72 A Q H X S+ 0 0 81 -4,-2.8 4,-2.5 -5,-0.3 -2,-0.2 0.896 109.7 51.3 -60.7 -42.1 39.9 1.3 40.7 67 73 A A H X S+ 0 0 60 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.876 109.5 49.2 -62.4 -36.3 40.0 -1.7 38.3 68 74 A A H X S+ 0 0 3 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.910 112.3 47.1 -71.5 -37.1 38.9 0.4 35.3 69 75 A L H X S+ 0 0 1 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.880 110.6 53.8 -67.3 -37.4 41.6 3.1 36.1 70 76 A T H X S+ 0 0 69 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.860 108.5 48.9 -60.6 -45.1 44.1 0.3 36.5 71 77 A L H X S+ 0 0 71 -4,-2.3 4,-2.7 2,-0.2 5,-0.3 0.915 110.8 50.6 -60.2 -42.4 43.2 -1.0 33.0 72 78 A A H X S+ 0 0 0 -4,-2.3 4,-3.6 1,-0.2 6,-0.5 0.963 112.4 45.9 -62.8 -40.2 43.5 2.5 31.5 73 79 A K H X S+ 0 0 83 -4,-2.4 4,-2.0 1,-0.3 -1,-0.2 0.902 115.0 47.7 -67.6 -39.8 46.9 3.0 33.0 74 80 A E H < S+ 0 0 132 -4,-2.5 -1,-0.3 2,-0.2 -2,-0.2 0.855 119.1 38.7 -67.4 -53.9 48.1 -0.5 31.9 75 81 A K H < S+ 0 0 125 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.899 133.8 20.0 -62.6 -43.1 46.8 -0.1 28.3 76 82 A F H < S- 0 0 48 -4,-3.6 -3,-0.2 -5,-0.3 -2,-0.2 0.504 96.1-122.2-116.3 -2.9 47.7 3.5 27.7 77 83 A G S < S+ 0 0 39 -4,-2.0 2,-0.3 -5,-0.5 -4,-0.2 0.298 80.0 12.1 90.0 -19.7 50.4 4.3 30.3 78 84 A R - 0 0 81 -6,-0.5 2,-0.4 55,-0.0 -2,-0.1 -0.979 68.1-117.3-172.5 168.8 48.7 7.2 32.0 79 85 A I + 0 0 0 -2,-0.3 -72,-0.2 50,-0.2 54,-0.2 -0.992 28.5 166.5-124.8 127.8 45.4 9.1 32.5 80 86 A D + 0 0 22 -74,-2.8 63,-1.7 -2,-0.4 2,-0.4 0.701 65.5 28.9-107.5 -29.8 45.3 12.8 31.4 81 87 A V E -bd 7 143A 3 -75,-1.9 -73,-2.7 61,-0.2 2,-0.4 -0.991 54.1-168.9-138.4 135.2 41.5 13.5 31.4 82 88 A A E -bd 8 144A 0 61,-2.3 63,-3.1 -2,-0.4 2,-0.5 -0.999 6.0-168.8-123.2 137.8 38.5 12.2 33.2 83 89 A V E -bd 9 145A 0 -75,-2.6 -73,-2.6 -2,-0.4 2,-1.0 -0.964 11.5-150.9-123.8 119.5 34.9 13.1 32.0 84 90 A N E +bd 10 146A 3 61,-3.2 63,-0.8 -2,-0.5 -73,-0.1 -0.752 40.7 139.8 -96.1 101.6 32.1 12.2 34.4 85 91 A C + 0 0 24 -75,-1.1 -74,-0.3 -2,-1.0 -1,-0.2 0.446 30.9 117.5-110.6 -11.1 28.9 11.6 32.4 86 92 A A + 0 0 18 -3,-0.2 2,-0.3 -52,-0.1 61,-0.1 -0.324 42.7 129.6 -61.5 129.1 27.5 8.6 34.3 87 93 A G - 0 0 37 31,-0.1 2,-0.3 -2,-0.0 24,-0.0 -0.976 42.0-146.3-174.0 160.5 24.2 9.5 35.8 88 94 A I - 0 0 51 -2,-0.3 2,-0.3 23,-0.2 27,-0.1 -0.922 12.5-153.3-131.0 159.8 20.5 8.7 36.2 89 95 A A + 0 0 47 -2,-0.3 2,-0.3 2,-0.0 70,-0.1 -0.963 10.6 179.7-132.4 154.7 17.4 10.8 36.5 90 96 A V - 0 0 29 -2,-0.3 2,-0.5 68,-0.1 72,-0.3 -0.964 21.6-142.1-146.4 156.9 14.0 10.3 38.1 91 97 A A + 0 0 89 -2,-0.3 2,-0.4 68,-0.1 68,-0.2 -0.935 42.0 143.5-122.5 100.3 10.9 12.5 38.3 92 98 A I - 0 0 44 66,-2.5 68,-0.4 -2,-0.5 69,-0.3 -0.955 43.1-130.9-140.8 122.1 9.4 12.1 41.8 93 99 A K - 0 0 77 -2,-0.4 3,-0.3 1,-0.1 10,-0.1 -0.331 21.3-121.7 -69.6 155.1 7.7 14.9 43.7 94 100 A T S S+ 0 0 0 1,-0.3 9,-2.6 334,-0.2 2,-0.4 0.935 108.5 10.0 -61.4 -38.9 8.7 15.4 47.4 95 101 A Y E S-G 102 0B 42 7,-0.2 2,-0.9 337,-0.1 -1,-0.3 -0.971 76.0-152.4-141.7 110.4 5.0 14.8 48.1 96 102 A H E >>> -G 101 0B 48 5,-3.2 5,-1.9 -2,-0.4 4,-0.8 -0.806 12.8-163.9 -90.1 101.9 2.7 13.5 45.3 97 103 A E G >45S+ 0 0 74 -2,-0.9 3,-1.0 1,-0.2 -1,-0.2 0.896 79.6 53.4 -59.0 -48.1 -0.7 14.9 46.3 98 104 A K G 345S+ 0 0 174 1,-0.3 -1,-0.2 2,-0.1 -2,-0.0 0.785 122.5 32.4 -65.0 -21.5 -3.1 12.8 44.2 99 105 A K G <45S- 0 0 119 -3,-0.7 -1,-0.3 2,-0.1 -2,-0.2 0.371 100.6-129.9-109.2 1.0 -1.6 9.6 45.5 100 106 A N T <<5 + 0 0 114 -3,-1.0 2,-0.6 -4,-0.8 -3,-0.2 0.907 55.9 155.1 48.8 45.9 -0.6 10.9 49.0 101 107 A Q E < -G 96 0B 99 -5,-1.9 -5,-3.2 3,-0.0 2,-0.3 -0.894 37.0-149.4-113.0 119.7 2.8 9.5 48.3 102 108 A V E -G 95 0B 51 -2,-0.6 -7,-0.2 -7,-0.2 -8,-0.1 -0.604 35.5-101.0 -77.5 143.2 5.9 10.8 50.0 103 109 A H - 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