==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=9-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 10-JUL-07 2V5X . COMPND 2 MOLECULE: HISTONE DEACETYLASE 8; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR S.DI MARCO,A.VANNINI,C.VOLPARI,P.GALLINARI,P.JONES,M.MATTU,A . 721 5 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 27613.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 495 68.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 78 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 12 1.7 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.7 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 . 44 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 92 12.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 224 31.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.2 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 2 0 2 2 0 2 1 2 2 1 0 3 1 0 0 2 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 2 2 2 6 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 PARALLEL BRIDGES PER LADDER . 6 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 2 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 14 A L 0 0 149 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -43.2 55.4 10.1 57.6 2 15 A V - 0 0 85 39,-0.1 118,-0.2 2,-0.0 117,-0.2 0.351 360.0 -75.5 85.6 144.6 52.7 7.3 58.0 3 16 A P - 0 0 13 0, 0.0 39,-2.7 0, 0.0 2,-0.4 -0.437 32.4-129.0 -81.0 141.2 48.9 7.6 58.2 4 17 A V E -ab 42 121A 0 116,-1.9 118,-2.0 37,-0.2 2,-0.5 -0.697 19.2-159.6 -78.0 135.0 46.9 8.8 61.2 5 18 A Y E -ab 43 122A 9 37,-1.8 39,-2.4 -2,-0.4 2,-0.5 -0.983 12.2-141.1-120.3 111.8 44.1 6.3 62.1 6 19 A I E +a 44 0A 6 116,-2.8 118,-0.3 -2,-0.5 2,-0.3 -0.695 46.8 132.6 -80.5 125.0 41.3 8.0 64.1 7 20 A Y + 0 0 45 37,-2.1 -2,-0.1 -2,-0.5 3,-0.1 -0.920 24.3 157.9-173.0 137.0 40.2 5.4 66.7 8 21 A S > - 0 0 8 -2,-0.3 4,-2.4 37,-0.1 5,-0.2 -0.921 47.0-115.7-152.0 157.6 39.4 4.7 70.3 9 22 A P H > S+ 0 0 72 0, 0.0 4,-2.0 0, 0.0 5,-0.1 0.846 118.6 51.7 -57.3 -35.6 37.2 1.9 71.8 10 23 A E H > S+ 0 0 113 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.923 108.7 50.2 -68.8 -48.1 34.8 4.5 73.1 11 24 A Y H > S+ 0 0 13 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.955 110.7 49.6 -51.5 -53.4 34.5 6.1 69.6 12 25 A V H X S+ 0 0 13 -4,-2.4 4,-1.1 1,-0.2 14,-0.2 0.901 110.2 49.8 -57.3 -43.8 33.8 2.7 68.0 13 26 A S H < S+ 0 0 74 -4,-2.0 4,-0.5 1,-0.2 3,-0.4 0.899 110.4 51.8 -61.0 -44.4 31.1 1.8 70.5 14 27 A M H >< S+ 0 0 66 -4,-2.1 3,-1.3 1,-0.2 4,-0.3 0.948 110.8 46.4 -53.3 -52.7 29.4 5.2 70.0 15 28 A C H >< S+ 0 0 5 -4,-2.4 3,-0.5 1,-0.3 -1,-0.2 0.640 101.0 69.7 -68.8 -17.2 29.4 4.7 66.2 16 29 A D T 3< S+ 0 0 23 -4,-1.1 7,-1.3 -3,-0.4 -1,-0.3 0.627 83.4 73.0 -74.2 -16.5 28.0 1.1 66.6 17 30 A S T < + 0 0 86 -3,-1.3 -1,-0.2 -4,-0.5 -2,-0.1 0.776 62.7 111.1 -70.4 -32.5 24.6 2.4 67.8 18 31 A L X - 0 0 16 -3,-0.5 3,-1.6 -4,-0.3 6,-0.2 -0.265 62.1-146.9 -54.8 118.0 23.3 3.6 64.4 19 32 A A T 3 S+ 0 0 79 1,-0.3 -1,-0.2 2,-0.2 -3,-0.0 0.752 93.6 62.0 -61.6 -27.9 20.4 1.3 63.5 20 33 A K T 3 S+ 0 0 77 1,-0.2 -1,-0.3 119,-0.1 -2,-0.1 0.732 123.0 18.4 -69.2 -22.9 21.1 1.5 59.7 21 34 A I S X S- 0 0 8 -3,-1.6 3,-1.5 -6,-0.1 4,-0.4 -0.320 83.2-170.3-147.1 59.2 24.6 0.0 60.2 22 35 A P T 3 S- 0 0 64 0, 0.0 -5,-0.2 0, 0.0 -6,-0.1 -0.289 73.7 -7.2 -64.3 133.5 24.8 -1.8 63.6 23 36 A K T 3> S+ 0 0 88 -7,-1.3 4,-2.5 -10,-0.1 5,-0.2 0.461 94.3 125.9 60.2 6.4 28.3 -2.9 64.7 24 37 A R H <> S+ 0 0 5 -3,-1.5 4,-2.9 1,-0.2 5,-0.2 0.923 70.4 52.2 -61.5 -40.6 29.7 -1.9 61.3 25 38 A A H > S+ 0 0 9 -4,-0.4 4,-2.7 -10,-0.2 -1,-0.2 0.916 111.1 47.5 -58.9 -45.3 32.4 0.3 63.0 26 39 A D H > S+ 0 0 27 -14,-0.2 4,-2.7 2,-0.2 -1,-0.2 0.893 112.3 49.1 -59.2 -44.8 33.5 -2.6 65.2 27 40 A M H X S+ 0 0 12 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.937 112.6 48.6 -64.7 -41.9 33.6 -5.0 62.2 28 41 A V H X S+ 0 0 5 -4,-2.9 4,-1.9 -5,-0.2 -2,-0.2 0.966 116.9 40.5 -63.3 -53.1 35.6 -2.4 60.2 29 42 A H H X S+ 0 0 10 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.844 112.1 55.5 -64.3 -35.5 38.1 -1.8 62.9 30 43 A S H X S+ 0 0 8 -4,-2.7 4,-2.3 -5,-0.2 -1,-0.2 0.887 109.2 47.4 -70.5 -33.8 38.3 -5.5 64.0 31 44 A L H X S+ 0 0 0 -4,-1.9 4,-1.6 2,-0.2 -2,-0.2 0.897 112.2 47.8 -71.7 -45.8 39.3 -6.6 60.5 32 45 A I H <>S+ 0 0 0 -4,-1.9 5,-2.4 2,-0.2 6,-0.4 0.900 113.8 50.2 -55.6 -43.3 41.9 -3.9 60.0 33 46 A E H ><5S+ 0 0 92 -4,-2.2 3,-1.9 1,-0.2 -2,-0.2 0.920 107.2 53.5 -61.6 -45.9 43.2 -4.9 63.5 34 47 A A H 3<5S+ 0 0 31 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.764 107.6 49.3 -63.8 -31.9 43.3 -8.6 62.4 35 48 A Y T 3<5S- 0 0 27 -4,-1.6 -1,-0.3 -3,-0.2 -2,-0.2 0.260 114.5-125.1 -85.7 8.1 45.4 -7.8 59.4 36 49 A A T X 5 + 0 0 36 -3,-1.9 3,-0.9 -5,-0.1 4,-0.3 0.720 66.6 139.6 54.1 31.1 47.6 -5.9 61.9 37 50 A L G > < + 0 0 2 -5,-2.4 3,-1.3 1,-0.2 -4,-0.2 0.796 59.2 68.5 -76.5 -27.6 47.3 -2.7 59.8 38 51 A H G > S+ 0 0 32 -6,-0.4 3,-1.2 1,-0.3 5,-0.3 0.722 90.1 65.3 -56.7 -24.2 46.9 -0.5 63.0 39 52 A K G < S+ 0 0 166 -3,-0.9 -1,-0.3 1,-0.3 -2,-0.2 0.752 99.6 50.7 -73.7 -24.3 50.5 -1.3 63.8 40 53 A Q G < S+ 0 0 73 -3,-1.3 2,-0.3 -4,-0.3 -1,-0.3 0.225 108.1 66.5 -96.6 14.1 51.7 0.5 60.7 41 54 A M S < S- 0 0 14 -3,-1.2 2,-1.0 -39,-0.1 -37,-0.2 -0.869 85.3-109.3-132.4 160.3 49.6 3.7 61.6 42 55 A R E -a 4 0A 151 -39,-2.7 -37,-1.8 -2,-0.3 2,-0.2 -0.803 35.1-144.3 -93.8 99.7 49.5 6.4 64.2 43 56 A I E -a 5 0A 84 -2,-1.0 2,-0.4 -5,-0.3 -37,-0.2 -0.460 19.7-172.2 -64.3 124.4 46.4 5.8 66.3 44 57 A V E -a 6 0A 26 -39,-2.4 -37,-2.1 -2,-0.2 65,-0.0 -0.989 21.2-132.2-125.7 123.0 44.8 9.1 67.4 45 58 A K - 0 0 136 -2,-0.4 2,-0.3 -39,-0.2 -37,-0.1 -0.523 32.5-121.3 -64.6 130.7 41.9 9.4 69.9 46 59 A P - 0 0 17 0, 0.0 2,-0.3 0, 0.0 59,-0.2 -0.619 14.6-129.6 -77.6 137.7 39.2 11.8 68.5 47 60 A K - 0 0 82 57,-0.5 2,-0.3 -2,-0.3 61,-0.3 -0.634 27.3-115.6 -72.0 139.1 38.1 14.9 70.3 48 61 A V - 0 0 100 -2,-0.3 53,-0.2 56,-0.1 2,-0.2 -0.633 41.9-106.1 -69.6 139.3 34.3 15.3 70.7 49 62 A A - 0 0 6 51,-2.3 2,-0.1 -2,-0.3 55,-0.1 -0.469 29.6-129.9 -72.7 137.6 33.3 18.4 68.7 50 63 A S > - 0 0 37 -2,-0.2 4,-2.8 1,-0.1 5,-0.2 -0.480 24.4-108.9 -79.0 157.4 32.3 21.5 70.6 51 64 A M H > S+ 0 0 51 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.893 121.8 50.3 -48.3 -45.6 29.1 23.4 69.9 52 65 A E H 4 S+ 0 0 148 2,-0.2 4,-0.5 1,-0.2 -1,-0.2 0.847 108.9 52.1 -68.6 -32.5 31.1 26.2 68.2 53 66 A E H >4 S+ 0 0 32 -3,-0.2 3,-0.9 2,-0.2 -2,-0.2 0.950 114.3 42.0 -65.2 -49.6 32.9 23.7 66.1 54 67 A M H >X S+ 0 0 2 -4,-2.8 4,-2.4 1,-0.2 3,-1.9 0.885 108.9 60.6 -61.4 -37.7 29.6 22.2 64.9 55 68 A A T 3< S+ 0 0 32 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.578 78.7 87.0 -69.1 -11.2 28.2 25.8 64.6 56 69 A T T <4 S+ 0 0 75 -3,-0.9 -1,-0.3 -4,-0.5 -2,-0.2 0.762 118.6 0.6 -61.4 -22.5 30.8 26.4 62.0 57 70 A F T <4 S+ 0 0 36 -3,-1.9 -2,-0.2 -4,-0.2 2,-0.2 0.600 122.2 72.1-125.5 -46.6 28.2 24.9 59.6 58 71 A H S < S- 0 0 2 -4,-2.4 76,-0.2 1,-0.1 -1,-0.2 -0.545 82.0-112.6 -82.0 141.4 25.1 23.9 61.5 59 72 A T > - 0 0 47 74,-1.8 4,-2.1 -2,-0.2 5,-0.1 -0.355 21.1-122.8 -67.1 151.1 22.6 26.6 62.8 60 73 A D H > S+ 0 0 85 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.832 111.7 58.4 -65.5 -30.0 22.3 26.9 66.6 61 74 A A H > S+ 0 0 48 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.903 108.4 44.4 -64.3 -42.4 18.6 26.2 66.4 62 75 A Y H > S+ 0 0 0 2,-0.2 4,-2.7 71,-0.2 -2,-0.2 0.920 114.4 48.6 -66.4 -45.2 19.2 22.8 64.7 63 76 A L H X S+ 0 0 0 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.940 113.2 46.8 -63.2 -48.6 22.0 21.9 67.1 64 77 A Q H X S+ 0 0 115 -4,-2.4 4,-2.5 1,-0.2 5,-0.2 0.928 113.3 48.8 -57.9 -48.8 20.0 22.8 70.2 65 78 A H H X S+ 0 0 7 -4,-2.2 4,-2.4 -5,-0.2 5,-0.2 0.930 111.8 49.9 -58.1 -43.6 16.9 21.0 68.9 66 79 A L H < S+ 0 0 0 -4,-2.7 4,-0.5 1,-0.2 30,-0.4 0.877 112.4 47.6 -61.8 -39.4 19.1 17.9 68.1 67 80 A Q H X S+ 0 0 74 -4,-2.4 4,-0.9 2,-0.2 -1,-0.2 0.863 111.6 50.0 -68.5 -39.8 20.6 18.0 71.7 68 81 A K H >< S+ 0 0 118 -4,-2.5 3,-0.8 1,-0.2 -2,-0.2 0.947 111.7 45.8 -67.3 -50.9 17.2 18.4 73.3 69 82 A V T 3< S+ 0 0 7 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.627 99.4 74.6 -67.9 -13.2 15.6 15.5 71.5 70 83 A S T 34 S+ 0 0 6 -4,-0.5 24,-1.5 -5,-0.2 2,-0.3 0.912 71.9 92.7 -64.9 -42.7 18.8 13.5 72.3 71 84 A Q S << S- 0 0 119 -4,-0.9 22,-0.0 -3,-0.8 -3,-0.0 -0.393 105.8 -26.4 -51.3 109.0 17.6 13.2 75.9 72 85 A E S S- 0 0 153 -2,-0.3 22,-0.2 2,-0.0 0, 0.0 0.256 99.7 -52.8 65.5 166.9 15.8 9.8 75.8 73 86 A G + 0 0 32 20,-0.2 19,-0.2 1,-0.1 2,-0.1 -0.098 64.4 153.3 -63.4 172.1 14.2 8.2 72.7 74 87 A D + 0 0 52 2,-0.1 -1,-0.1 1,-0.0 18,-0.1 -0.167 30.8 159.4-160.8-106.4 11.7 10.2 70.6 75 88 A D S S+ 0 0 47 16,-0.2 12,-0.1 17,-0.1 17,-0.1 0.420 81.3 79.4 65.4 3.1 10.4 10.3 66.9 76 89 A D + 0 0 128 15,-0.1 -1,-0.1 10,-0.1 -2,-0.1 0.711 55.3 118.3-109.9 -30.9 7.4 12.0 68.4 77 90 A H > - 0 0 56 1,-0.1 3,-0.9 2,-0.1 4,-0.5 -0.105 63.8-132.1 -48.8 131.9 8.4 15.7 69.0 78 91 A P T 3 S+ 0 0 110 0, 0.0 3,-0.3 0, 0.0 4,-0.3 0.799 104.1 45.1 -50.8 -41.1 6.4 18.2 67.0 79 92 A D T 3> S+ 0 0 74 1,-0.2 4,-1.0 2,-0.1 3,-0.4 0.517 89.7 88.6 -86.5 -7.3 9.4 20.2 65.6 80 93 A S T X4>S+ 0 0 3 -3,-0.9 5,-1.8 1,-0.2 3,-0.6 0.885 80.0 58.7 -59.6 -41.7 11.4 17.0 64.6 81 94 A I G >45S+ 0 0 109 -4,-0.5 3,-1.3 -3,-0.3 -1,-0.2 0.863 103.9 49.9 -60.9 -40.0 10.0 16.7 61.1 82 95 A E G 345S+ 0 0 131 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.756 107.0 56.4 -71.8 -24.7 11.1 20.2 60.0 83 96 A Y G <<5S- 0 0 37 -4,-1.0 53,-2.2 -3,-0.6 -1,-0.3 0.188 123.1-106.0 -90.5 18.4 14.6 19.5 61.2 84 97 A G T < 5S+ 0 0 16 -3,-1.3 5,-0.5 1,-0.3 4,-0.2 0.400 79.3 133.4 76.7 -3.4 14.8 16.4 59.0 85 98 A L < + 0 0 4 -5,-1.8 2,-0.4 -6,-0.2 -1,-0.3 -0.366 34.5 69.2 -76.3 161.7 14.3 14.0 62.0 86 99 A G S S- 0 0 4 3,-1.0 -10,-0.1 -3,-0.1 -12,-0.0 -0.992 99.4 -2.3 123.7-140.1 11.8 11.2 61.6 87 100 A Y S S+ 0 0 80 -2,-0.4 -1,-0.1 1,-0.2 -2,-0.1 0.715 135.3 34.7 -83.5 -22.6 11.8 8.1 59.5 88 101 A D S S+ 0 0 36 -4,-0.2 -1,-0.2 1,-0.2 -3,-0.1 0.864 136.9 25.3 -84.4 -41.8 15.0 8.5 57.5 89 102 A C S S- 0 0 0 -5,-0.5 -3,-1.0 47,-0.1 -2,-0.2 -0.602 86.6-166.0-121.0 69.5 16.8 10.1 60.4 90 103 A P - 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