==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 25-JUN-04 1W22 . COMPND 2 MOLECULE: HISTONE DEACETYLASE 8; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR A.VANNINI,C.VOLPARI,E.CAROLI CASAVOLA,S.DI MARCO . 701 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 26313.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 477 68.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 78 11.1 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 . 6 0.9 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 . 51 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 78 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 220 31.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.4 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 0 2 2 2 1 2 4 0 1 1 1 0 2 0 1 1 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 0 156 0, 0.0 109,-0.3 0, 0.0 108,-0.1 0.000 360.0 360.0 360.0 3.2 -4.2 -23.1 29.3 2 15 A V - 0 0 67 1,-0.1 109,-0.2 107,-0.1 39,-0.1 -0.514 360.0-107.3 -70.5 135.3 -5.0 -20.7 26.5 3 16 A P - 0 0 4 0, 0.0 39,-2.7 0, 0.0 2,-0.4 -0.249 31.8-112.7 -62.4 155.5 -4.5 -17.1 27.8 4 17 A V E -ab 42 112A 0 107,-2.9 109,-3.6 37,-0.2 2,-0.6 -0.760 24.0-157.2 -91.2 135.7 -7.6 -15.1 28.5 5 18 A Y E -ab 43 113A 10 37,-2.6 39,-1.9 -2,-0.4 2,-0.6 -0.920 11.8-141.7-116.7 105.2 -8.2 -12.1 26.2 6 19 A I E +a 44 0A 8 107,-2.7 2,-0.3 -2,-0.6 39,-0.2 -0.530 45.9 139.0 -68.6 111.7 -10.5 -9.4 27.8 7 20 A Y + 0 0 48 37,-2.1 -2,-0.1 -2,-0.6 3,-0.1 -0.982 21.4 148.7-161.2 148.0 -12.6 -8.2 24.9 8 21 A S >> - 0 0 9 -2,-0.3 4,-2.4 37,-0.1 3,-0.6 -0.864 49.3-117.2-170.4 136.2 -16.1 -7.0 23.8 9 22 A P H 3> S+ 0 0 76 0, 0.0 4,-2.5 0, 0.0 5,-0.2 0.875 115.7 56.2 -50.5 -37.3 -16.9 -4.5 21.1 10 23 A E H 3> S+ 0 0 108 2,-0.2 4,-1.9 1,-0.2 5,-0.1 0.905 109.2 46.8 -60.9 -42.7 -18.6 -2.3 23.8 11 24 A Y H <> S+ 0 0 12 -3,-0.6 4,-2.7 2,-0.2 5,-0.2 0.953 111.4 49.8 -63.7 -52.8 -15.4 -2.2 25.8 12 25 A V H X S+ 0 0 14 -4,-2.4 4,-1.9 1,-0.2 14,-0.3 0.919 113.1 46.3 -53.5 -47.0 -13.1 -1.4 22.9 13 26 A S H X S+ 0 0 69 -4,-2.5 4,-1.0 2,-0.2 -1,-0.2 0.855 110.9 52.6 -65.9 -36.0 -15.3 1.4 21.7 14 27 A M H < S+ 0 0 46 -4,-1.9 3,-0.5 -5,-0.2 -1,-0.2 0.903 111.3 47.6 -65.4 -39.3 -15.5 2.8 25.3 15 28 A C H >< S+ 0 0 8 -4,-2.7 3,-1.4 1,-0.2 -2,-0.2 0.821 103.2 62.9 -70.2 -30.4 -11.7 2.7 25.4 16 29 A D H 3< S+ 0 0 29 -4,-1.9 7,-1.1 1,-0.3 -1,-0.2 0.797 87.8 72.5 -64.8 -27.8 -11.5 4.4 22.0 17 30 A S T 3< + 0 0 60 -4,-1.0 2,-0.5 -3,-0.5 -1,-0.3 0.425 63.6 124.5 -70.1 2.3 -13.2 7.5 23.5 18 31 A L X - 0 0 11 -3,-1.4 3,-1.6 3,-0.3 6,-0.2 -0.537 58.0-144.8 -68.4 116.0 -10.1 8.4 25.5 19 32 A A T 3 S+ 0 0 40 -2,-0.5 -1,-0.2 1,-0.3 -3,-0.0 0.834 92.5 44.8 -48.9 -48.6 -9.3 12.0 24.4 20 33 A K T 3 S+ 0 0 37 1,-0.2 -1,-0.3 59,-0.1 -2,-0.1 0.463 125.6 31.1 -83.1 3.7 -5.5 11.9 24.4 21 34 A I S X S- 0 0 13 -3,-1.6 3,-1.3 -5,-0.1 4,-0.3 -0.199 81.4-172.1-155.6 49.8 -5.3 8.5 22.7 22 35 A P T 3 - 0 0 43 0, 0.0 -5,-0.2 0, 0.0 -6,-0.1 -0.152 67.2 -3.2 -53.2 134.4 -8.3 8.1 20.3 23 36 A K T 3> S+ 0 0 127 -7,-1.1 4,-2.5 -10,-0.1 5,-0.2 0.335 87.5 123.2 66.8 -3.3 -8.8 4.7 18.6 24 37 A R H <> S+ 0 0 7 -3,-1.3 4,-3.0 1,-0.2 5,-0.2 0.887 71.6 56.5 -57.3 -37.5 -5.8 3.0 20.0 25 38 A A H > S+ 0 0 11 -4,-0.3 4,-3.0 2,-0.2 5,-0.3 0.969 110.4 42.4 -57.8 -54.3 -7.9 0.3 21.5 26 39 A S H > S+ 0 0 24 -14,-0.3 4,-4.1 2,-0.2 5,-0.3 0.926 114.1 51.8 -57.8 -47.7 -9.5 -0.7 18.1 27 40 A M H X S+ 0 0 4 -4,-2.5 4,-2.5 2,-0.2 5,-0.3 0.951 112.2 46.7 -54.1 -50.0 -6.2 -0.4 16.3 28 41 A V H X S+ 0 0 6 -4,-3.0 4,-1.8 -5,-0.2 -2,-0.2 0.945 118.4 40.2 -57.2 -53.3 -4.6 -2.7 18.9 29 42 A H H X S+ 0 0 10 -4,-3.0 4,-3.0 -5,-0.2 5,-0.2 0.893 113.1 55.7 -63.7 -42.7 -7.5 -5.2 18.8 30 43 A S H X S+ 0 0 14 -4,-4.1 4,-2.3 -5,-0.3 -1,-0.2 0.898 109.4 45.2 -57.4 -45.2 -7.8 -5.0 15.0 31 44 A L H X S+ 0 0 0 -4,-2.5 4,-1.5 -5,-0.3 -1,-0.2 0.881 113.0 51.2 -68.8 -36.3 -4.2 -5.9 14.4 32 45 A I H <>S+ 0 0 0 -4,-1.8 5,-2.4 -5,-0.3 6,-0.4 0.936 113.7 44.8 -63.1 -44.3 -4.4 -8.7 16.9 33 46 A E H ><5S+ 0 0 86 -4,-3.0 3,-1.8 1,-0.2 -2,-0.2 0.856 106.1 61.7 -66.8 -35.5 -7.5 -9.9 15.1 34 47 A A H 3<5S+ 0 0 32 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.839 105.6 44.9 -62.0 -35.1 -5.8 -9.4 11.7 35 48 A Y T 3<5S- 0 0 29 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.296 114.2-125.6 -88.1 8.4 -3.1 -11.9 12.6 36 49 A A T < 5 + 0 0 36 -3,-1.8 -3,-0.2 -5,-0.1 -2,-0.1 0.785 62.7 148.1 51.4 29.7 -6.1 -14.0 13.8 37 50 A L < + 0 0 2 -5,-2.4 3,-0.3 -6,-0.2 -4,-0.2 0.856 54.9 67.1 -61.2 -37.3 -4.2 -14.1 17.1 38 51 A H S S+ 0 0 27 -6,-0.4 4,-0.1 1,-0.2 -9,-0.0 0.177 78.9 61.9 -63.2-162.2 -7.5 -14.2 19.0 39 52 A K S S+ 0 0 152 1,-0.2 -1,-0.2 2,-0.2 3,-0.1 0.739 101.0 67.2 50.5 16.2 -9.6 -17.3 18.4 40 53 A Q S S+ 0 0 72 -3,-0.3 2,-0.3 -37,-0.1 -1,-0.2 0.220 97.4 57.6-141.0 -1.7 -6.6 -18.9 20.0 41 54 A M S S- 0 0 12 -39,-0.1 2,-0.9 -36,-0.1 -37,-0.2 -0.813 98.0 -98.8-125.3 164.3 -7.2 -17.3 23.4 42 55 A R E -a 4 0A 93 -39,-2.7 -37,-2.6 -2,-0.3 2,-0.4 -0.798 39.3-142.7 -90.2 109.8 -10.3 -17.5 25.6 43 56 A I E -a 5 0A 83 -2,-0.9 2,-0.4 -39,-0.2 -37,-0.2 -0.612 22.1-176.2 -77.0 126.0 -12.3 -14.4 24.9 44 57 A V E -a 6 0A 33 -39,-1.9 -37,-2.1 -2,-0.4 55,-0.0 -0.989 23.7-125.7-127.3 129.0 -13.9 -13.0 28.0 45 58 A K - 0 0 129 -2,-0.4 2,-0.2 -39,-0.2 -37,-0.1 -0.459 32.1-113.6 -71.0 141.9 -16.2 -10.0 28.2 46 59 A P - 0 0 17 0, 0.0 2,-0.4 0, 0.0 50,-0.2 -0.486 21.9-139.7 -76.4 146.4 -15.2 -7.2 30.7 47 60 A K - 0 0 77 48,-0.3 2,-0.2 -2,-0.2 52,-0.2 -0.898 23.3-114.3-107.7 134.6 -17.4 -6.5 33.7 48 61 A V - 0 0 98 -2,-0.4 44,-0.2 47,-0.1 2,-0.1 -0.499 33.2-115.9 -69.9 131.6 -18.0 -2.9 34.7 49 62 A A - 0 0 6 42,-2.3 46,-0.1 -2,-0.2 2,-0.1 -0.440 27.9-134.7 -69.8 137.8 -16.4 -2.1 38.1 50 63 A S > - 0 0 41 -2,-0.1 4,-2.6 1,-0.1 5,-0.3 -0.410 24.1-106.3 -86.4 167.2 -18.9 -1.1 40.8 51 64 A M H > S+ 0 0 43 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.938 121.8 51.4 -57.8 -46.4 -18.5 1.8 43.1 52 65 A E H 4 S+ 0 0 146 1,-0.2 -1,-0.2 2,-0.2 4,-0.1 0.894 111.2 47.9 -57.8 -44.4 -17.7 -0.6 46.0 53 66 A E H >4 S+ 0 0 36 1,-0.2 3,-1.9 2,-0.2 -2,-0.2 0.961 112.2 46.2 -65.2 -49.8 -15.0 -2.3 43.9 54 67 A M H >X S+ 0 0 1 -4,-2.6 4,-2.0 1,-0.3 3,-1.1 0.824 106.4 62.2 -62.9 -28.7 -13.3 0.8 42.7 55 68 A A T 3< S+ 0 0 30 -4,-2.0 -1,-0.3 -5,-0.3 -2,-0.2 0.402 72.7 91.8 -78.5 2.9 -13.4 2.2 46.2 56 69 A T T <4 S+ 0 0 84 -3,-1.9 -1,-0.3 -5,-0.1 -2,-0.1 0.625 117.0 4.5 -69.1 -10.0 -11.2 -0.7 47.5 57 70 A F T <4 S+ 0 0 41 -3,-1.1 -2,-0.2 1,-0.3 2,-0.1 0.520 123.9 66.9-135.1 -53.8 -8.5 1.9 46.7 58 71 A H S < S- 0 0 2 -4,-2.0 -1,-0.3 1,-0.1 67,-0.2 -0.469 83.7-110.4 -77.9 149.4 -10.0 5.2 45.6 59 72 A T > - 0 0 50 65,-2.2 4,-2.8 -2,-0.1 5,-0.2 -0.458 17.5-122.4 -79.2 150.9 -12.0 7.3 48.0 60 73 A D H > S+ 0 0 88 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.859 114.1 60.7 -59.6 -33.4 -15.7 7.8 47.8 61 74 A A H > S+ 0 0 47 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.959 110.2 39.1 -58.3 -50.0 -15.0 11.5 47.6 62 75 A Y H > S+ 0 0 0 62,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.915 116.5 50.6 -68.1 -42.7 -13.0 11.0 44.4 63 76 A L H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -2,-0.2 0.946 112.2 45.9 -61.0 -51.0 -15.3 8.4 42.9 64 77 A Q H X S+ 0 0 108 -4,-2.9 4,-1.7 2,-0.2 -2,-0.2 0.956 113.5 49.5 -56.5 -53.5 -18.5 10.4 43.4 65 78 A H H >X S+ 0 0 69 -4,-2.0 4,-2.1 -5,-0.3 3,-0.7 0.934 110.3 50.0 -51.1 -52.8 -16.8 13.6 42.0 66 79 A L H 3X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.3 21,-0.3 0.913 109.5 51.7 -54.0 -44.0 -15.5 11.8 39.0 67 80 A Q H 3< S+ 0 0 87 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.796 108.3 54.5 -64.0 -27.2 -19.0 10.4 38.4 68 81 A K H X< S+ 0 0 157 -4,-1.7 3,-1.7 -3,-0.7 -2,-0.2 0.955 108.3 43.5 -72.3 -52.8 -20.4 13.9 38.6 69 82 A V H 3< S+ 0 0 55 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.724 98.5 73.4 -66.7 -20.9 -18.2 15.6 35.9 70 83 A S T 3< 0 0 4 -4,-1.4 15,-2.1 -5,-0.3 -1,-0.3 0.569 360.0 360.0 -68.4 -3.9 -18.7 12.6 33.7 71 84 A Q < 0 0 160 -3,-1.7 -2,-0.2 13,-0.2 -3,-0.1 0.673 360.0 360.0-107.2 360.0 -22.2 14.2 33.4 72 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 73 95 A E 0 0 172 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 153.5 -8.4 19.3 43.1 74 96 A Y - 0 0 67 52,-0.1 53,-3.6 2,-0.1 3,-0.1 0.071 360.0 -94.4-109.1 21.0 -8.7 15.7 42.0 75 97 A G S S+ 0 0 23 51,-0.3 5,-0.3 1,-0.3 2,-0.2 0.618 80.8 141.6 77.7 12.7 -6.1 16.0 39.3 76 98 A L + 0 0 17 3,-0.1 2,-0.4 1,-0.1 -1,-0.3 -0.577 31.5 59.4 -87.5 152.0 -8.7 16.8 36.6 77 99 A G S S+ 0 0 26 3,-2.1 -1,-0.1 -2,-0.2 0, 0.0 -0.932 97.6 7.0 146.9-121.0 -8.0 19.3 33.8 78 100 A Y S S+ 0 0 93 -2,-0.4 -1,-0.2 2,-0.2 -2,-0.0 0.996 135.8 28.8 -64.1 -70.6 -5.4 19.5 31.1 79 101 A D S S+ 0 0 80 1,-0.3 -1,-0.1 -3,-0.1 -59,-0.1 0.877 139.5 28.5 -61.1 -41.4 -3.5 16.3 31.4 80 102 A C S S- 0 0 1 -5,-0.3 -3,-2.1 47,-0.1 2,-0.4 -0.572 81.4-174.4-122.6 68.9 -6.6 14.6 32.7 81 103 A P - 0 0 25 0, 0.0 2,-2.5 0, 0.0 -62,-0.2 -0.493 28.0-130.2 -68.8 118.4 -9.6 16.4 31.2 82 104 A A - 0 0 33 -2,-0.4 3,-0.1 4,-0.0 5,-0.0 -0.435 38.4-175.7 -69.3 78.2 -12.8 15.1 32.7 83 105 A T > - 0 0 44 -2,-2.5 3,-1.7 1,-0.2 4,-0.2 -0.282 39.3 -73.2 -72.0 162.5 -14.5 14.6 29.3 84 106 A E T 3 S+ 0 0 168 1,-0.3 -13,-0.2 2,-0.1 -1,-0.2 -0.263 120.8 14.3 -55.9 140.4 -18.1 13.4 29.1 85 107 A G T 3> S+ 0 0 14 -15,-2.1 4,-1.7 -18,-0.1 -1,-0.3 0.642 83.9 131.7 67.5 16.5 -18.5 9.8 30.0 86 108 A I H <> + 0 0 3 -3,-1.7 4,-2.9 1,-0.2 5,-0.2 0.880 67.4 57.5 -67.6 -36.7 -15.1 9.6 31.5 87 109 A F H > S+ 0 0 16 -21,-0.3 4,-2.7 -4,-0.2 -1,-0.2 0.900 107.5 48.2 -60.3 -39.6 -16.4 7.9 34.7 88 110 A D H > S+ 0 0 89 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.890 109.9 53.3 -65.7 -40.0 -17.8 5.1 32.5 89 111 A Y H X S+ 0 0 9 -4,-1.7 4,-1.8 2,-0.2 -2,-0.2 0.951 112.0 44.5 -57.6 -52.0 -14.5 4.9 30.7 90 112 A A H X S+ 0 0 2 -4,-2.9 4,-3.0 1,-0.2 5,-0.3 0.924 111.7 51.5 -60.2 -49.1 -12.7 4.5 34.0 91 113 A A H X S+ 0 0 2 -4,-2.7 4,-2.7 1,-0.2 -42,-2.3 0.822 108.8 51.9 -60.2 -33.9 -15.1 1.9 35.4 92 114 A A H X S+ 0 0 12 -4,-2.0 4,-2.7 -44,-0.2 -1,-0.2 0.897 112.8 44.2 -70.4 -41.1 -14.9 -0.2 32.3 93 115 A I H X S+ 0 0 2 -4,-1.8 4,-1.9 2,-0.2 5,-0.3 0.991 117.6 44.4 -65.4 -59.7 -11.0 -0.3 32.5 94 116 A G H X S+ 0 0 0 -4,-3.0 4,-2.2 1,-0.2 3,-0.4 0.927 115.2 48.9 -49.2 -50.2 -11.0 -1.0 36.2 95 117 A G H X S+ 0 0 0 -4,-2.7 4,-2.1 -5,-0.3 -48,-0.3 0.939 109.3 54.4 -54.8 -46.6 -13.8 -3.5 35.8 96 118 A A H X S+ 0 0 0 -4,-2.7 4,-1.0 1,-0.2 -1,-0.2 0.787 109.8 44.3 -58.0 -36.3 -11.8 -5.1 33.0 97 119 A T H X S+ 0 0 0 -4,-1.9 4,-2.3 -3,-0.4 -1,-0.2 0.842 111.4 54.4 -79.5 -35.3 -8.6 -5.6 35.0 98 120 A I H X S+ 0 0 2 -4,-2.2 4,-2.3 -5,-0.3 -2,-0.2 0.842 108.9 48.7 -67.2 -32.0 -10.6 -6.9 38.0 99 121 A T H X S+ 0 0 12 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.818 108.7 52.3 -78.1 -27.6 -12.2 -9.5 35.7 100 122 A A H X S+ 0 0 0 -4,-1.0 4,-1.5 -5,-0.2 -2,-0.2 0.906 109.2 52.4 -68.7 -39.1 -8.8 -10.5 34.4 101 123 A A H >X S+ 0 0 0 -4,-2.3 4,-2.4 1,-0.2 3,-0.8 0.962 109.2 47.3 -58.6 -52.9 -7.8 -10.9 38.0 102 124 A Q H 3X S+ 0 0 45 -4,-2.3 4,-2.5 1,-0.3 -1,-0.2 0.877 105.5 60.2 -58.2 -38.0 -10.8 -13.2 38.7 103 125 A C H 3< S+ 0 0 12 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.869 110.4 42.5 -57.1 -36.0 -10.0 -15.2 35.6 104 126 A L H << S+ 0 0 7 -4,-1.5 -2,-0.2 -3,-0.8 -1,-0.2 0.881 107.8 56.6 -78.5 -40.9 -6.6 -15.9 37.3 105 127 A I H < S+ 0 0 22 -4,-2.4 -2,-0.2 -5,-0.1 -1,-0.2 0.942 110.8 52.3 -56.1 -42.3 -7.9 -16.6 40.7 106 128 A D S < S- 0 0 96 -4,-2.5 3,-0.1 -5,-0.2 0, 0.0 -0.224 101.2-110.7 -81.1-178.8 -10.1 -19.2 39.2 107 129 A G S S+ 0 0 40 1,-0.1 -1,-0.2 -2,-0.0 -2,-0.0 0.203 82.9 74.9 -96.6-142.3 -8.3 -21.7 37.0 108 130 A M S S+ 0 0 148 2,-0.0 2,-0.2 1,-0.0 -1,-0.1 0.859 91.8 77.3 38.4 52.4 -8.0 -22.6 33.3 109 131 A C + 0 0 14 -5,-0.1 3,-0.1 -108,-0.1 -107,-0.1 -0.538 42.5 173.6 174.2 113.7 -5.9 -19.5 32.7 110 132 A K S S+ 0 0 61 -109,-0.3 166,-2.3 1,-0.3 2,-0.3 0.541 82.9 34.6-102.6 -11.5 -2.2 -18.8 33.4 111 133 A V E - 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