==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=28-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE/HYDROLASE INHIBITOR 22-MAR-13 4JT9 . COMPND 2 MOLECULE: NAD-DEPENDENT PROTEIN DEACETYLASE SIRTUIN-3, MITO . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR H.DAI . 274 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12910.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 183 66.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 28 10.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 13 4.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 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 . 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 . 16 5.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 15.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 69 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.6 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 1 1 1 0 1 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 1 3 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 . 1 0 1 0 1 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 1 0 0 1 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 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 1 120 A K 0 0 155 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 123.8 -3.9 60.3 12.2 2 121 A G + 0 0 67 2,-0.0 2,-0.1 0, 0.0 0, 0.0 -0.588 360.0 18.9 80.4-146.7 -0.1 60.6 12.4 3 122 A K - 0 0 160 -2,-0.2 2,-0.2 1,-0.1 236,-0.1 -0.294 67.2-139.0 -63.8 130.0 2.1 57.6 11.8 4 123 A L - 0 0 29 234,-0.5 2,-0.2 236,-0.4 -1,-0.1 -0.621 20.0-144.3 -76.5 147.3 0.8 54.5 10.0 5 124 A S > - 0 0 46 -2,-0.2 4,-1.6 236,-0.1 5,-0.1 -0.584 28.0-106.3 -99.9 172.5 1.9 51.2 11.4 6 125 A L H > S+ 0 0 17 -2,-0.2 4,-2.2 2,-0.2 5,-0.1 0.837 124.5 58.2 -61.5 -34.7 2.7 48.0 9.6 7 126 A Q H > S+ 0 0 128 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.908 102.6 51.7 -62.9 -43.4 -0.6 46.8 10.9 8 127 A D H > S+ 0 0 64 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.896 109.0 50.6 -59.6 -43.0 -2.4 49.7 9.2 9 128 A V H X S+ 0 0 0 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.928 109.8 50.0 -61.6 -44.4 -0.7 48.8 5.9 10 129 A A H X S+ 0 0 2 -4,-2.2 4,-3.2 1,-0.2 -1,-0.2 0.857 109.4 51.6 -61.5 -37.4 -1.8 45.2 6.3 11 130 A E H X S+ 0 0 111 -4,-2.1 4,-2.2 2,-0.2 -1,-0.2 0.844 106.4 54.2 -69.4 -36.2 -5.4 46.3 7.0 12 131 A L H <>S+ 0 0 43 -4,-2.0 5,-2.6 2,-0.2 6,-1.3 0.893 113.8 42.1 -62.0 -38.9 -5.3 48.4 3.8 13 132 A I H ><5S+ 0 0 5 -4,-1.8 3,-1.8 3,-0.2 -2,-0.2 0.913 111.8 53.2 -73.5 -46.6 -4.3 45.3 1.9 14 133 A R H 3<5S+ 0 0 140 -4,-3.2 -2,-0.2 1,-0.3 -1,-0.2 0.886 111.9 47.1 -53.0 -40.9 -6.8 43.0 3.7 15 134 A A T 3<5S- 0 0 68 -4,-2.2 -1,-0.3 -5,-0.1 -2,-0.2 0.388 110.9-125.7 -79.6 1.8 -9.5 45.5 2.7 16 135 A R T < 5S+ 0 0 106 -3,-1.8 -3,-0.2 2,-0.2 3,-0.2 0.822 73.1 132.2 47.0 34.9 -8.2 45.6 -0.9 17 136 A A S - 0 0 0 173,-1.1 3,-1.9 -2,-0.3 4,-0.4 -0.702 56.4 -50.8-148.0-161.4 17.5 45.0 -4.7 27 146 A A G >> S+ 0 0 32 1,-0.3 3,-1.5 -2,-0.2 4,-0.9 0.758 116.7 72.0 -58.6 -30.3 20.3 42.8 -3.5 28 147 A G G 34 S+ 0 0 24 172,-2.4 -1,-0.3 1,-0.3 172,-0.2 0.612 89.7 58.9 -66.0 -15.0 19.1 42.6 0.0 29 148 A I G <4 S+ 0 0 0 -3,-1.9 -1,-0.3 171,-0.4 61,-0.2 0.685 108.5 45.2 -83.8 -17.6 16.1 40.3 -0.8 30 149 A S T X4>S+ 0 0 2 -3,-1.5 3,-1.9 -4,-0.4 5,-1.4 0.581 81.6 90.6-105.5 -13.4 18.4 37.6 -2.3 31 150 A T G ><5S+ 0 0 69 -4,-0.9 3,-1.4 1,-0.3 -1,-0.1 0.858 86.8 56.8 -49.2 -37.7 21.2 37.3 0.3 32 151 A P G 3 5S+ 0 0 69 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.665 97.4 62.6 -69.9 -14.4 19.2 34.6 2.1 33 152 A S G < 5S- 0 0 21 -3,-1.9 53,-0.5 2,-0.2 -2,-0.2 0.493 130.3 -94.1 -80.7 -4.5 19.1 32.5 -1.1 34 153 A G T < 5S+ 0 0 46 -3,-1.4 -3,-0.2 -4,-0.3 -4,-0.0 0.485 91.3 120.8 100.7 8.1 22.9 32.3 -0.9 35 154 A I < - 0 0 17 -5,-1.4 -2,-0.2 -8,-0.1 -1,-0.2 -0.844 47.9-156.3-108.4 103.5 23.8 35.3 -3.1 36 155 A P - 0 0 44 0, 0.0 9,-0.4 0, 0.0 -8,-0.0 -0.341 36.1 -85.8 -74.5 154.7 25.8 38.0 -1.3 37 156 A D > - 0 0 36 1,-0.2 3,-2.6 7,-0.1 9,-0.1 -0.378 40.1-123.7 -50.9 131.8 25.8 41.6 -2.4 38 157 A F T 3 S+ 0 0 48 1,-0.3 8,-2.2 6,-0.2 9,-0.3 0.736 112.1 53.1 -56.8 -21.8 28.5 41.8 -5.2 39 158 A R T 3 S+ 0 0 174 6,-0.1 -1,-0.3 7,-0.1 -2,-0.1 0.487 76.5 121.5 -93.0 -6.3 30.2 44.5 -3.0 40 159 A S <> - 0 0 36 -3,-2.6 4,-2.2 1,-0.1 7,-0.3 -0.421 69.6-117.2 -62.3 122.8 30.3 42.5 0.2 41 160 A P T 4 S+ 0 0 118 0, 0.0 2,-1.8 0, 0.0 -1,-0.1 -0.301 91.7 6.3 -53.9 142.1 34.0 42.3 1.4 42 161 A G T 4 S+ 0 0 63 1,-0.2 -2,-0.1 2,-0.1 -3,-0.0 -0.508 137.3 36.6 87.1 -73.0 35.2 38.7 1.5 43 162 A S T 4 S+ 0 0 75 -2,-1.8 -1,-0.2 -6,-0.0 2,-0.1 0.568 89.3 106.3 -96.6 -11.2 32.2 36.8 -0.0 44 163 A G S >< S- 0 0 0 -4,-2.2 3,-2.3 1,-0.1 4,-0.3 -0.425 78.1-116.6 -74.0 142.1 31.0 39.2 -2.8 45 164 A L G > S+ 0 0 11 -9,-0.4 3,-1.8 1,-0.3 7,-0.2 0.840 113.9 58.4 -35.8 -48.4 31.6 38.6 -6.5 46 165 A Y G 3 S+ 0 0 60 -8,-2.2 -1,-0.3 1,-0.3 3,-0.3 0.662 105.8 48.4 -68.1 -17.7 33.7 41.8 -6.7 47 166 A S G < S+ 0 0 59 -3,-2.3 -1,-0.3 -9,-0.3 -2,-0.2 0.216 99.9 69.9-103.4 11.6 36.1 40.6 -4.0 48 167 A N <> + 0 0 34 -3,-1.8 4,-1.2 -4,-0.3 -1,-0.2 -0.325 53.9 140.0-119.8 51.9 36.5 37.2 -5.7 49 168 A L H >> + 0 0 42 -3,-0.3 5,-2.6 1,-0.2 4,-1.2 0.878 67.9 57.6 -60.3 -42.9 38.4 38.2 -8.8 50 169 A Q H >45S+ 0 0 134 1,-0.2 3,-0.6 3,-0.2 -1,-0.2 0.905 103.3 51.4 -55.5 -50.0 40.7 35.2 -8.8 51 170 A Q H 345S+ 0 0 103 1,-0.2 -1,-0.2 2,-0.1 -2,-0.2 0.799 116.6 39.6 -61.5 -34.9 37.9 32.6 -9.0 52 171 A Y H 3<5S- 0 0 21 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.612 110.9-120.9 -88.7 -11.5 36.3 34.3 -12.0 53 172 A D T <<5 + 0 0 119 -4,-1.2 -3,-0.2 -3,-0.6 -2,-0.1 0.891 56.2 161.5 67.8 47.6 39.7 35.0 -13.6 54 173 A L < - 0 0 15 -5,-2.6 -1,-0.2 1,-0.1 -2,-0.1 -0.812 44.2-152.4-105.3 136.4 39.0 38.8 -13.6 55 174 A P S S- 0 0 77 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.761 87.5 -9.0 -71.5 -28.3 41.6 41.7 -14.0 56 175 A Y S > S- 0 0 104 1,-0.1 3,-1.1 -7,-0.1 4,-0.4 -0.923 80.2-100.3-167.0 155.4 39.3 44.1 -12.0 57 176 A P G > S+ 0 0 45 0, 0.0 3,-1.5 0, 0.0 4,-0.2 0.875 113.6 50.1 -54.7 -53.5 35.7 43.9 -10.8 58 177 A E G > S+ 0 0 98 1,-0.3 3,-2.1 2,-0.2 117,-0.2 0.674 89.3 82.8 -64.6 -19.3 33.8 45.9 -13.4 59 178 A A G X S+ 0 0 0 -3,-1.1 3,-1.8 1,-0.3 -1,-0.3 0.781 77.8 69.3 -54.5 -31.3 35.4 44.0 -16.3 60 179 A I G < S+ 0 0 2 -3,-1.5 -1,-0.3 -4,-0.4 -2,-0.2 0.761 108.7 36.3 -61.3 -23.8 32.8 41.2 -15.9 61 180 A F G < S+ 0 0 17 -3,-2.1 114,-2.9 -4,-0.2 2,-0.4 -0.088 95.2 107.1-119.2 32.3 30.2 43.7 -17.1 62 181 A E <> - 0 0 39 -3,-1.8 4,-2.3 112,-0.2 5,-0.1 -0.933 60.8-144.9-113.5 136.5 32.2 45.5 -19.7 63 182 A L H > S+ 0 0 65 -2,-0.4 4,-2.5 112,-0.4 5,-0.2 0.918 97.5 48.0 -66.1 -47.5 31.7 45.0 -23.5 64 183 A P H > S+ 0 0 103 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.938 115.3 45.5 -63.8 -43.9 35.3 45.4 -24.6 65 184 A F H > S+ 0 0 28 2,-0.2 4,-3.5 1,-0.2 -2,-0.2 0.944 111.5 53.5 -58.8 -45.0 36.6 43.0 -22.0 66 185 A F H < S+ 0 0 7 -4,-2.3 -1,-0.2 1,-0.2 -3,-0.2 0.892 109.0 48.2 -57.4 -42.6 33.8 40.6 -22.8 67 186 A F H < S+ 0 0 184 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.920 114.4 47.2 -63.5 -41.4 34.7 40.6 -26.5 68 187 A H H < S- 0 0 154 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.932 137.9 -0.4 -63.9 -44.0 38.4 40.0 -25.4 69 188 A N < + 0 0 43 -4,-3.5 4,-0.4 -5,-0.2 -1,-0.2 -0.721 58.2 176.5-155.4 96.9 37.4 37.2 -23.0 70 189 A P > + 0 0 19 0, 0.0 4,-2.3 0, 0.0 5,-0.2 0.576 63.7 89.9 -76.7 -10.2 33.8 36.1 -22.4 71 190 A K H > S+ 0 0 99 2,-0.2 4,-1.6 1,-0.2 5,-0.1 0.856 81.4 52.6 -62.9 -44.2 34.7 33.2 -20.0 72 191 A P H >> S+ 0 0 1 0, 0.0 4,-1.8 0, 0.0 3,-0.5 0.961 112.7 46.0 -56.2 -49.5 34.6 35.1 -16.7 73 192 A F H 3> S+ 0 0 2 -4,-0.4 4,-2.5 1,-0.2 -2,-0.2 0.922 111.0 52.8 -56.8 -44.7 31.1 36.4 -17.5 74 193 A F H 3X S+ 0 0 15 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.762 103.6 57.7 -66.4 -21.5 30.0 32.9 -18.6 75 194 A T H < S- 0 0 6 -4,-2.3 3,-1.1 -5,-0.2 4,-0.4 -0.148 82.6 -79.2 -50.6 147.8 21.3 30.5 -14.5 82 201 A P T 3 S+ 0 0 57 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.232 114.2 38.9 -56.8 134.6 17.8 29.3 -13.4 83 202 A G T 3 S+ 0 0 54 2,-0.5 -2,-0.1 -3,-0.1 3,-0.1 0.360 95.9 79.0 108.3 -2.9 17.9 26.2 -11.2 84 203 A N S < S+ 0 0 81 -3,-1.1 2,-0.3 1,-0.2 -4,-0.1 0.850 91.5 42.6 -96.9 -52.1 21.0 26.8 -9.1 85 204 A Y S S- 0 0 65 -4,-0.4 -2,-0.5 27,-0.2 -1,-0.2 -0.673 76.4-133.6 -98.2 153.2 19.6 29.3 -6.5 86 205 A K - 0 0 98 -53,-0.5 28,-0.1 -2,-0.3 186,-0.1 -0.861 18.1-122.5-105.8 133.4 16.3 29.0 -4.6 87 206 A P - 0 0 9 0, 0.0 2,-0.2 0, 0.0 -57,-0.1 -0.403 33.9-144.4 -65.0 151.6 14.0 32.0 -4.2 88 207 A N >> - 0 0 21 -59,-0.2 4,-1.9 -2,-0.0 3,-1.2 -0.499 34.0 -73.9-109.2-176.0 13.2 32.6 -0.5 89 208 A V H 3> S+ 0 0 28 1,-0.3 4,-2.3 2,-0.2 5,-0.2 0.796 128.1 57.7 -43.7 -41.8 10.2 33.8 1.6 90 209 A T H 3> S+ 0 0 0 -61,-0.2 4,-1.2 1,-0.2 -1,-0.3 0.883 108.4 46.0 -62.4 -39.1 10.6 37.4 0.3 91 210 A H H <> S+ 0 0 1 -3,-1.2 4,-1.7 -62,-0.2 -2,-0.2 0.881 111.8 50.9 -70.1 -40.7 10.3 36.2 -3.3 92 211 A Y H X S+ 0 0 6 -4,-1.9 4,-2.5 1,-0.2 -2,-0.2 0.834 104.6 57.3 -72.1 -28.0 7.3 34.0 -2.5 93 212 A F H X S+ 0 0 1 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.899 107.7 47.7 -63.0 -40.9 5.5 36.9 -0.7 94 213 A L H X S+ 0 0 1 -4,-1.2 4,-1.7 2,-0.2 -2,-0.2 0.859 110.9 52.8 -67.6 -35.0 5.8 38.9 -4.0 95 214 A R H X S+ 0 0 36 -4,-1.7 4,-2.7 2,-0.2 -2,-0.2 0.900 109.0 48.2 -61.9 -45.5 4.5 35.8 -5.8 96 215 A L H X S+ 0 0 5 -4,-2.5 4,-1.7 2,-0.2 -2,-0.2 0.865 107.2 56.9 -64.7 -36.8 1.4 35.6 -3.4 97 216 A L H <>S+ 0 0 2 -4,-2.0 5,-2.3 2,-0.2 6,-0.8 0.906 110.4 44.9 -57.1 -44.6 0.9 39.3 -4.0 98 217 A H H ><5S+ 0 0 40 -4,-1.7 3,-2.4 4,-0.2 -2,-0.2 0.950 109.7 53.9 -63.6 -51.2 0.6 38.5 -7.7 99 218 A D H 3<5S+ 0 0 80 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.734 106.2 53.3 -59.3 -27.8 -1.6 35.5 -7.2 100 219 A K T 3<5S- 0 0 56 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.321 117.9-112.1 -89.7 6.4 -4.1 37.6 -5.2 101 220 A G T < 5S+ 0 0 45 -3,-2.4 -3,-0.2 -5,-0.1 -2,-0.1 0.705 87.6 111.1 74.2 23.0 -4.3 40.1 -8.0 102 221 A L < + 0 0 3 -5,-2.3 -81,-3.2 -6,-0.2 2,-0.7 0.618 44.4 97.4-103.9 -15.9 -2.6 43.0 -6.1 103 222 A L E +a 21 0A 6 -6,-0.8 -81,-0.2 -83,-0.2 3,-0.1 -0.663 35.9 172.0 -85.1 113.1 0.7 43.4 -7.9 104 223 A L E S- 0 0 31 -83,-2.8 2,-0.3 -2,-0.7 -82,-0.2 0.950 72.0 -17.2 -76.4 -56.3 0.8 46.2 -10.5 105 224 A R E -a 22 0A 38 -84,-1.4 -82,-3.2 84,-0.1 2,-0.6 -0.991 48.2-148.2-153.7 144.9 4.5 45.9 -11.1 106 225 A L E -ac 23 125A 0 18,-3.0 20,-2.8 -2,-0.3 2,-0.6 -0.946 16.8-164.8-110.7 107.8 7.7 44.5 -9.6 107 226 A Y E -ac 24 126A 4 -84,-3.5 -82,-2.3 -2,-0.6 2,-0.4 -0.837 13.0-173.7 -90.3 117.0 10.9 46.5 -10.4 108 227 A T E -ac 25 127A 0 18,-2.7 20,-2.3 -2,-0.6 21,-0.5 -0.943 29.9-171.2-117.2 136.0 14.0 44.6 -9.7 109 228 A Q + 0 0 30 -84,-1.8 2,-0.2 -2,-0.4 -83,-0.2 0.364 65.5 103.1 -91.0 -4.8 17.7 45.7 -9.8 110 229 A N - 0 0 16 -85,-0.2 19,-0.3 -84,-0.1 -2,-0.1 -0.514 54.1-165.0 -78.5 152.0 18.7 42.0 -9.3 111 230 A I + 0 0 13 -2,-0.2 21,-0.4 1,-0.1 -1,-0.1 0.334 69.1 95.6-114.4 4.1 20.0 39.7 -12.0 112 231 A D S S- 0 0 14 1,-0.1 -27,-0.2 19,-0.1 -1,-0.1 0.659 82.6-139.6 -65.9 -15.0 19.6 36.4 -10.2 113 232 A G > + 0 0 12 1,-0.1 4,-2.0 -3,-0.1 3,-0.2 0.681 56.5 139.4 65.0 20.2 16.2 36.1 -11.9 114 233 A L H > + 0 0 3 1,-0.2 4,-1.4 2,-0.2 -1,-0.1 0.719 62.6 61.9 -74.6 -19.5 14.6 34.7 -8.7 115 234 A E H 4>S+ 0 0 1 2,-0.2 5,-1.7 1,-0.2 4,-0.3 0.952 108.4 43.2 -64.2 -51.2 11.4 36.7 -9.3 116 235 A R H >45S+ 0 0 88 1,-0.2 3,-2.0 2,-0.2 -2,-0.2 0.923 112.3 54.4 -52.5 -49.5 10.8 34.8 -12.5 117 236 A V H 3<5S+ 0 0 54 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.795 100.3 59.8 -60.7 -30.8 11.8 31.5 -10.8 118 237 A S T 3<5S- 0 0 0 -4,-1.4 -1,-0.3 -3,-0.3 -2,-0.2 0.538 125.5-100.7 -76.9 -7.6 9.2 32.2 -8.0 119 238 A G T < 5S+ 0 0 38 -3,-2.0 -3,-0.2 1,-0.3 -2,-0.1 0.452 72.2 145.7 103.9 3.3 6.5 32.1 -10.7 120 239 A I < - 0 0 5 -5,-1.7 -1,-0.3 1,-0.1 -2,-0.1 -0.603 53.8-113.7 -72.1 128.0 5.8 35.8 -11.2 121 240 A P > - 0 0 44 0, 0.0 3,-1.2 0, 0.0 4,-0.3 -0.273 16.6-119.0 -63.7 152.1 5.0 36.4 -14.9 122 241 A A G > S+ 0 0 45 1,-0.3 3,-1.3 2,-0.2 5,-0.1 0.790 110.9 63.1 -59.8 -34.2 7.4 38.4 -17.1 123 242 A S G 3 S+ 0 0 70 1,-0.3 -1,-0.3 3,-0.1 -3,-0.0 0.732 102.2 51.7 -64.5 -24.4 4.7 41.1 -17.9 124 243 A K G < S+ 0 0 44 -3,-1.2 -18,-3.0 -19,-0.1 2,-0.4 0.527 101.0 82.9 -85.9 -7.8 4.7 41.9 -14.2 125 244 A L E < -c 106 0A 0 -3,-1.3 2,-0.5 -4,-0.3 -18,-0.2 -0.790 52.2-168.9-108.7 137.7 8.5 42.3 -14.0 126 245 A V E -c 107 0A 2 -20,-2.8 -18,-2.7 -2,-0.4 2,-1.2 -0.924 12.0-166.6-117.5 101.7 10.8 45.2 -14.8 127 246 A E E > -c 108 0A 23 -2,-0.5 3,-1.7 -20,-0.2 -18,-0.2 -0.744 5.5-171.0 -89.9 92.9 14.2 43.7 -14.7 128 247 A A T 3 S+ 0 0 0 -20,-2.3 -19,-0.2 -2,-1.2 -1,-0.2 0.665 80.6 36.7 -71.7 -23.8 16.2 47.0 -14.7 129 248 A H T 3 S- 0 0 66 -21,-0.5 44,-2.4 1,-0.4 -1,-0.3 0.144 118.6-107.6-108.9 16.1 19.7 45.6 -15.3 130 249 A G E < -F 172 0B 6 -3,-1.7 -1,-0.4 42,-0.3 2,-0.3 -0.366 33.7 -99.4 93.8-168.2 18.5 42.8 -17.6 131 250 A T E > -F 171 0B 12 40,-1.8 40,-0.7 3,-0.1 3,-0.5 -0.993 10.6-132.2-156.3 153.1 18.1 39.0 -17.3 132 251 A F E 3 S+ 0 0 6 -21,-0.4 40,-0.1 -2,-0.3 -1,-0.1 0.517 92.4 87.9 -81.8 -5.8 19.6 35.6 -18.0 133 252 A A E 3 S+ 0 0 24 38,-0.1 13,-2.8 13,-0.1 14,-0.4 0.633 97.1 26.8 -72.8 -15.7 16.2 34.5 -19.4 134 253 A S E < - 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0 0 95 0, 0.0 2,-0.3 0, 0.0 -3,-0.1 -0.253 5.2-153.7 -64.1 146.8 10.0 61.3 4.9 237 356 A R > - 0 0 62 -5,-0.1 3,-2.2 -16,-0.1 -16,-0.1 -0.901 27.3-111.8-121.1 155.8 6.3 61.5 4.0 238 357 A S T 3 S+ 0 0 90 -2,-0.3 -234,-0.5 1,-0.3 -20,-0.1 0.826 116.3 48.2 -59.4 -33.4 3.4 61.3 6.5 239 358 A R T 3 S+ 0 0 88 -22,-0.3 -18,-0.8 -20,-0.2 2,-0.3 0.150 85.0 120.3 -96.4 21.5 2.2 58.0 5.2 240 359 A D E < -e 221 0A 14 -3,-2.2 2,-0.4 -20,-0.2 -236,-0.4 -0.636 41.0-167.5 -84.0 140.0 5.6 56.2 5.2 241 360 A V E -e 222 0A 13 -20,-2.6 -18,-2.8 -2,-0.3 2,-0.4 -0.988 3.3-161.1-125.0 139.6 6.2 53.1 7.2 242 361 A A E -e 223 0A 44 -2,-0.4 2,-0.5 -20,-0.2 -18,-0.2 -0.977 8.6-173.4-118.6 129.9 9.6 51.5 8.0 243 362 A Q E -e 224 0A 43 -20,-3.1 -18,-1.3 -2,-0.4 2,-0.2 -0.901 25.1-165.9-120.3 98.6 10.1 47.9 9.1 244 363 A L E +e 225 0A 82 -2,-0.5 2,-0.3 -20,-0.2 -18,-0.3 -0.553 39.1 38.8 -97.0 150.4 13.8 47.7 9.9 245 364 A G S S+ 0 0 28 -20,-1.1 -18,-0.1 -2,-0.2 -2,-0.1 -0.791 101.4 12.9 117.8-163.7 16.0 44.8 10.5 246 365 A D > - 0 0 96 -2,-0.3 4,-2.4 1,-0.1 5,-0.1 -0.222 63.3-143.4 -44.4 124.1 16.1 41.4 8.8 247 366 A V H > S+ 0 0 11 2,-0.2 4,-2.7 -219,-0.2 5,-0.2 0.885 99.7 52.6 -64.4 -40.9 14.0 41.5 5.6 248 367 A V H > S+ 0 0 28 2,-0.2 4,-2.7 1,-0.2 -1,-0.2 0.914 111.6 46.4 -63.6 -43.0 12.8 37.9 6.0 249 368 A H H > S+ 0 0 112 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.898 112.1 51.8 -63.0 -41.4 11.6 38.7 9.5 250 369 A G H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.922 112.9 44.8 -57.9 -45.5 10.0 41.9 8.3 251 370 A V H X S+ 0 0 0 -4,-2.7 4,-3.0 2,-0.2 -2,-0.2 0.925 111.5 51.3 -68.4 -46.3 8.2 40.0 5.6 252 371 A E H X S+ 0 0 98 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.861 108.7 53.6 -58.8 -36.8 7.1 37.2 7.9 253 372 A S H X S+ 0 0 30 -4,-2.1 4,-2.1 2,-0.2 -1,-0.2 0.927 111.5 44.1 -60.9 -48.4 5.7 39.9 10.3 254 373 A L H X S+ 0 0 0 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.894 111.5 53.4 -64.1 -42.4 3.6 41.5 7.5 255 374 A V H X>S+ 0 0 5 -4,-3.0 5,-2.5 2,-0.2 4,-0.9 0.898 108.4 51.3 -57.8 -43.8 2.5 38.0 6.3 256 375 A E H ><5S+ 0 0 122 -4,-2.2 3,-1.0 1,-0.2 -2,-0.2 0.945 110.9 46.6 -57.6 -52.1 1.3 37.3 9.9 257 376 A L H 3<5S+ 0 0 68 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.813 111.1 52.9 -62.6 -31.8 -0.7 40.5 10.1 258 377 A L H 3<5S- 0 0 0 -4,-2.1 -1,-0.3 -5,-0.1 -2,-0.2 0.655 111.4-122.6 -74.5 -18.8 -2.2 39.8 6.6 259 378 A G T <<5S+ 0 0 49 -3,-1.0 3,-0.2 -4,-0.9 -3,-0.2 0.748 78.7 119.5 78.4 28.2 -3.3 36.4 7.8 260 379 A W >< + 0 0 22 -5,-2.5 4,-2.9 -6,-0.2 5,-0.2 0.295 26.9 113.2-105.1 9.1 -1.3 34.7 5.0 261 380 A T H > S+ 0 0 52 -6,-0.5 4,-1.4 1,-0.2 -1,-0.1 0.813 83.9 41.4 -51.8 -35.6 1.1 32.5 7.1 262 381 A E H > S+ 0 0 116 -3,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.888 113.7 48.8 -85.1 -42.2 -0.6 29.2 5.9 263 382 A E H > S+ 0 0 92 2,-0.2 4,-1.4 1,-0.2 -2,-0.2 0.883 112.6 52.9 -58.6 -39.5 -1.0 30.1 2.3 264 383 A M H X S+ 0 0 11 -4,-2.9 4,-2.8 2,-0.2 -2,-0.2 0.861 109.1 47.5 -63.8 -41.2 2.7 31.2 2.4 265 384 A R H X S+ 0 0 117 -4,-1.4 4,-0.8 -5,-0.2 -2,-0.2 0.897 110.1 52.2 -68.1 -41.4 3.8 27.9 3.9 266 385 A D H X S+ 0 0 89 -4,-2.4 4,-1.5 2,-0.2 -2,-0.2 0.790 115.6 42.9 -62.2 -31.0 1.8 26.0 1.2 267 386 A L H X S+ 0 0 11 -4,-1.4 4,-2.0 2,-0.2 5,-0.3 0.956 112.7 47.8 -79.1 -59.2 3.5 28.0 -1.4 268 387 A V H X S+ 0 0 38 -4,-2.8 4,-0.8 1,-0.2 -2,-0.2 0.673 113.3 60.6 -51.9 -16.3 7.0 27.9 -0.0 269 388 A Q H X S+ 0 0 127 -4,-0.8 4,-1.0 -5,-0.2 -2,-0.2 0.990 108.0 30.8 -79.0 -68.8 6.2 24.2 0.2 270 389 A R H < S+ 0 0 127 -4,-1.5 3,-0.2 1,-0.2 -2,-0.2 0.843 119.6 55.9 -61.5 -36.6 5.5 22.9 -3.3 271 390 A E H >< S+ 0 0 26 -4,-2.0 3,-0.7 1,-0.2 -1,-0.2 0.859 100.6 55.2 -69.0 -39.5 7.8 25.4 -4.9 272 391 A T H 3< S+ 0 0 80 -4,-0.8 2,-0.6 -5,-0.3 -1,-0.2 0.796 101.2 62.8 -64.0 -29.1 10.9 24.4 -2.9 273 392 A G T 3< 0 0 68 -4,-1.0 -1,-0.3 -3,-0.2 -2,-0.1 -0.278 360.0 360.0 -88.7 47.1 10.3 20.8 -4.1 274 393 A K < 0 0 169 -3,-0.7 -3,-0.1 -2,-0.6 -191,-0.0 -0.720 360.0 360.0-140.7 360.0 10.9 21.8 -7.7